*HEADER    CELL CYCLE, HYDROLASE                   19-OCT-04   1XSF              
*TITLE     SOLUTION STRUCTURE OF A RESUSCITATION PROMOTING FACTOR                
*TITLE    2 DOMAIN FROM MYCOBACTERIUM TUBERCULOSIS                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROBABLE RESUSCITATION-PROMOTING FACTOR RPFB;              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RPFBC DOMAIN;                                              
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS;                     
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: RV1009;                                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET15B                                    
*KEYWDS    LYSOZYME-LIKE STRUCTURE                                               
*EXPDTA    NMR, 30 STRUCTURES                                                    
*AUTHOR    M.COHEN-GONSAUD, P.BARTHE, B.HENDERSON, J.WARD,                       
*AUTHOR   2 C.ROUMESTAND, N.H.KEEP                                               
*REVDAT   1   15-FEB-05 1XSF    0                                                

 ASSI {    1}
    (( segid "    " and resid 43   and name HE1 ))
    (( segid "    " and resid 43   and name HH2 ))
       4.800     2.900     1.200 peak     1 spectrum    1 weight  0.10000E+01 volume  0.30613E-03 ppm1     10.494 ppm2      6.783 CV     1
  ASSI {    1}
    (( segid "    " and resid 43   and name HE1 ))
    (( segid "    " and resid 32   and name HA  ))
       4.600     2.700     1.400 peak     1 spectrum    1 weight  0.10000E+01 volume  0.38112E-03 ppm1     10.491 ppm2      4.845 CV     1
  ASSI {    2}
    (( segid "    " and resid 43   and name HE1 ))
    (( segid "    " and resid 79   and name HD2 ))
       4.600     2.600     1.400 peak     2 spectrum    1 weight  0.10000E+01 volume  0.13280E-03 ppm1     10.491 ppm2      2.637 CV     1
  ASSI {    3}
    (( segid "    " and resid 43   and name HE1 ))
    (( segid "    " and resid 43   and name HN  ))
       5.900     4.400     0.100 peak     3 spectrum    1 weight  0.10000E+01 volume  0.16227E-03 ppm1     10.488 ppm2      8.571 CV     1
  ASSI {    4}
    (( segid "    " and resid 43   and name HE1 ))
    (( segid "    " and resid 43   and name HZ2 ))
       2.800     1.000     1.000 peak     4 spectrum    1 weight  0.10000E+01 volume  0.17825E-02 ppm1     10.490 ppm2      7.564 CV     1
  ASSI {    5}
    (( segid "    " and resid 43   and name HE1 ))
    (( segid "    " and resid 41   and name HA2 ))
       3.700     1.700     1.700 peak     5 spectrum    1 weight  0.10000E+01 volume  0.40496E-03 ppm1     10.489 ppm2      3.111 CV     1
  ASSI {    6}
    (( segid "    " and resid 43   and name HE1 ))
    (( segid "    " and resid 43   and name HD1 ))
       2.400     0.700     0.700 peak     6 spectrum    1 weight  0.10000E+01 volume  0.58761E-02 ppm1     10.491 ppm2      7.480 CV     1
  ASSI {    7}
    (( segid "    " and resid 43   and name HE1 ))
    (( segid "    " and resid 79   and name HD1 ))
       4.300     2.300     1.700 peak     7 spectrum    1 weight  0.10000E+01 volume  0.58125E-03 ppm1     10.491 ppm2      2.250 CV     1
  ASSI {    8}
    (( segid "    " and resid 43   and name HE1 ))
    (( segid "    " and resid 79   and name HE  ))
       4.000     2.000     2.000 peak     8 spectrum    1 weight  0.10000E+01 volume  0.36441E-03 ppm1     10.488 ppm2      8.355 CV     1
  ASSI {    9}
    (( segid "    " and resid 43   and name HE1 ))
    (  segid "    " and resid 35   and name HB% )
       3.800     1.800     1.800 peak     9 spectrum    1 weight  0.10000E+01 volume  0.47115E-03 ppm1     10.489 ppm2      0.497 CV     1
  ASSI {   10}
    (( segid "    " and resid 31   and name HE1 ))
    (( segid "    " and resid 87   and name HG2 ))
       2.900     1.100     1.100 peak    10 spectrum    1 weight  0.10000E+01 volume  0.14299E-02 ppm1     10.465 ppm2      2.469 CV     1
  ASSI {   11}
    (( segid "    " and resid 31   and name HE1 ))
    (( segid "    " and resid 87   and name HB2 ))
       6.000     5.400     0.000 peak    11 spectrum    1 weight  0.10000E+01 volume  0.24091E-04 ppm1     10.465 ppm2      2.182 CV     1
  ASSI {   12}
    (( segid "    " and resid 31   and name HE1 ))
    (( segid "    " and resid 31   and name HD1 ))
       2.400     0.700     0.700 peak    12 spectrum    1 weight  0.10000E+01 volume  0.44012E-02 ppm1     10.465 ppm2      7.200 CV     1
  ASSI {   13}
    (( segid "    " and resid 31   and name HE1 ))
    (( segid "    " and resid 31   and name HZ2 ))
       2.900     1.000     1.000 peak    13 spectrum    1 weight  0.10000E+01 volume  0.13779E-02 ppm1     10.463 ppm2      7.084 CV     1
  ASSI {   14}
    (( segid "    " and resid 31   and name HE1 ))
    (( segid "    " and resid 27   and name HB1 ))
       5.000     3.100     1.000 peak    14 spectrum    1 weight  0.10000E+01 volume  0.13470E-03 ppm1     10.463 ppm2      2.806 CV     1
  ASSI {   15}
    (( segid "    " and resid 31   and name HE1 ))
    (  segid "    " and resid 83   and name HG2%)
       3.800     1.900     1.900 peak    15 spectrum    1 weight  0.10000E+01 volume  0.41941E-03 ppm1     10.462 ppm2      0.420 CV     1
  ASSI {   16}
    (( segid "    " and resid 31   and name HE1 ))
    (( segid "    " and resid 87   and name HA  ))
       4.400     2.500     1.600 peak    16 spectrum    1 weight  0.10000E+01 volume  0.15139E-03 ppm1     10.464 ppm2      4.458 CV     1
  ASSI {   17}
    (( segid "    " and resid 31   and name HE1 ))
    (( segid "    " and resid 28   and name HA1 ))
       6.000     6.000     0.000 peak    17 spectrum    1 weight  0.10000E+01 volume  0.11585E-04 ppm1     10.464 ppm2      3.932 CV     1
  ASSI {   18}
    (( segid "    " and resid 31   and name HE1 ))
    (( segid "    " and resid 90   and name HB1 ))
       4.800     2.900     1.200 peak    18 spectrum    1 weight  0.10000E+01 volume  0.37363E-03 ppm1     10.465 ppm2      1.955 CV     1
  ASSI {   19}
    (( segid "    " and resid 98   and name HE1 ))
    (( segid "    " and resid 98   and name HD1 ))
       2.500     0.800     0.800 peak    19 spectrum    1 weight  0.10000E+01 volume  0.34596E-02 ppm1      9.902 ppm2      7.086 CV     1
  ASSI {   20}
    (( segid "    " and resid 98   and name HE1 ))
    (( segid "    " and resid 98   and name HZ2 ))
       3.000     1.100     1.100 peak    20 spectrum    1 weight  0.10000E+01 volume  0.12911E-02 ppm1      9.902 ppm2      6.945 CV     1
  ASSI {   21}
    (( segid "    " and resid 98   and name HE1 ))
    (( segid "    " and resid 55   and name HA  ))
       4.600     2.700     1.400 peak    21 spectrum    1 weight  0.10000E+01 volume  0.53007E-03 ppm1      9.902 ppm2      4.276 CV     1
  ASSI {   22}
    (( segid "    " and resid 98   and name HE1 ))
    (( segid "    " and resid 55   and name HB  ))
       2.700     0.900     0.900 peak    22 spectrum    1 weight  0.10000E+01 volume  0.24052E-02 ppm1      9.902 ppm2      2.214 CV     1
  ASSI {   24}
    (( segid "    " and resid 98   and name HE1 ))
    (  segid "    " and resid 55   and name HG1%)
       2.500     2.500     3.500 peak    24 spectrum    1 weight  0.10000E+01 volume  0.26171E-02 ppm1      9.903 ppm2      0.630 CV     1
  ASSI {   25}
    (( segid "    " and resid 98   and name HE1 ))
    (  segid "    " and resid 34   and name HD1%)
       5.000     3.100     1.000 peak    25 spectrum    1 weight  0.10000E+01 volume  0.15612E-03 ppm1      9.900 ppm2      0.516 CV     1
  ASSI {   26}
    (( segid "    " and resid 95   and name HE1 ))
    (( segid "    " and resid 95   and name HB2 ))
       5.400     3.600     0.600 peak    26 spectrum    1 weight  0.10000E+01 volume  0.13442E-03 ppm1      9.859 ppm2      3.552 CV     1
  ASSI {   28}
    (( segid "    " and resid 95   and name HE1 ))
    (( segid "    " and resid 108  and name HG1 ))
       4.300     2.300     1.700 peak    28 spectrum    1 weight  0.10000E+01 volume  0.19455E-03 ppm1      9.853 ppm2      1.465 CV     1
  ASSI {   30}
    (( segid "    " and resid 95   and name HE1 ))
    (( segid "    " and resid 108  and name HN  ))
       4.400     2.400     1.600 peak    30 spectrum    1 weight  0.10000E+01 volume  0.13458E-03 ppm1      9.857 ppm2      7.530 CV     1
  ASSI {   31}
    (( segid "    " and resid 95   and name HE1 ))
    (( segid "    " and resid 95   and name HD1 ))
       2.200     0.600     0.600 peak    31 spectrum    1 weight  0.10000E+01 volume  0.10504E-01 ppm1      9.858 ppm2      7.182 CV     1
  ASSI {   32}
    (( segid "    " and resid 95   and name HE1 ))
    (( segid "    " and resid 107  and name HA  ))
       4.900     3.000     1.100 peak    32 spectrum    1 weight  0.10000E+01 volume  0.31431E-03 ppm1      9.860 ppm2      3.804 CV     1
  ASSI {   33}
    (( segid "    " and resid 95   and name HE1 ))
    (( segid "    " and resid 90   and name HD2 ))
       5.700     4.100     0.300 peak    33 spectrum    1 weight  0.10000E+01 volume  0.39094E-04 ppm1      9.859 ppm2      2.476 CV     1
  ASSI {   34}
    (( segid "    " and resid 95   and name HE1 ))
    (  segid "    " and resid 107  and name HB% )
       4.700     2.800     1.300 peak    34 spectrum    1 weight  0.10000E+01 volume  0.43184E-03 ppm1      9.858 ppm2      0.097 CV     1
  ASSI {   35}
    (( segid "    " and resid 95   and name HE1 ))
    (( segid "    " and resid 95   and name HB1 ))
       4.800     2.900     1.200 peak    35 spectrum    1 weight  0.10000E+01 volume  0.24104E-03 ppm1      9.854 ppm2      2.953 CV     1
  ASSI {   36}
    (( segid "    " and resid 95   and name HE1 ))
    (( segid "    " and resid 108  and name HA  ))
       4.600     2.700     1.400 peak    36 spectrum    1 weight  0.10000E+01 volume  0.24286E-03 ppm1      9.856 ppm2      4.096 CV     1
  ASSI {   37}
    (( segid "    " and resid 59   and name HN  ))
    (  segid "    " and resid 52   and name HD% )
       4.400     2.500     1.600 peak    37 spectrum    1 weight  0.10000E+01 volume  0.17565E-03 ppm1      9.436 ppm2      7.098 CV     1
  ASSI {   38}
    (( segid "    " and resid 59   and name HN  ))
    (( segid "    " and resid 58   and name HN  ))
       6.000     6.000     0.000 peak    38 spectrum    1 weight  0.10000E+01 volume  0.14540E-05 ppm1      9.430 ppm2      9.022 CV     1
  ASSI {   40}
    (( segid "    " and resid 59   and name HN  ))
    (( segid "    " and resid 58   and name HA  ))
       2.500     0.800     0.800 peak    40 spectrum    1 weight  0.10000E+01 volume  0.19220E-02 ppm1      9.430 ppm2      5.382 CV     1
  ASSI {   41}
    (( segid "    " and resid 59   and name HN  ))
    (( segid "    " and resid 59   and name HA  ))
       2.900     1.000     1.000 peak    41 spectrum    1 weight  0.10000E+01 volume  0.12876E-02 ppm1      9.431 ppm2      4.132 CV     1
  ASSI {   42}
    (( segid "    " and resid 59   and name HN  ))
    (( segid "    " and resid 60   and name HA1 ))
       6.000     6.000     0.000 peak    42 spectrum    1 weight  0.10000E+01 volume  0.86046E-05 ppm1      9.433 ppm2      3.976 CV     1
  ASSI {   43}
    (( segid "    " and resid 59   and name HN  ))
    (( segid "    " and resid 58   and name HB2 ))
       2.900     1.100     1.100 peak    43 spectrum    1 weight  0.10000E+01 volume  0.17157E-02 ppm1      9.431 ppm2      3.168 CV     1
  ASSI {   44}
    (( segid "    " and resid 59   and name HN  ))
    (( segid "    " and resid 58   and name HB1 ))
       3.500     1.500     1.500 peak    44 spectrum    1 weight  0.10000E+01 volume  0.17350E-02 ppm1      9.431 ppm2      2.830 CV     1
  ASSI {   45}
    (( segid "    " and resid 59   and name HN  ))
    (( segid "    " and resid 59   and name HG1 ))
       3.700     1.700     1.700 peak    45 spectrum    1 weight  0.10000E+01 volume  0.16475E-02 ppm1      9.430 ppm2      2.455 CV     1
  ASSI {   46}
    (( segid "    " and resid 59   and name HN  ))
    (( segid "    " and resid 59   and name HB2 ))
       2.800     1.000     1.000 peak    46 spectrum    1 weight  0.10000E+01 volume  0.19112E-02 ppm1      9.430 ppm2      2.305 CV     1
  ASSI {   47}
    (( segid "    " and resid 59   and name HN  ))
    (( segid "    " and resid 59   and name HB1 ))
       2.600     0.900     0.900 peak    47 spectrum    1 weight  0.10000E+01 volume  0.16474E-02 ppm1      9.430 ppm2      1.958 CV     1
  ASSI {   48}
    (( segid "    " and resid 59   and name HN  ))
    (  segid "    " and resid 52   and name HE% )
       3.500     1.500     1.500 peak    48 spectrum    1 weight  0.10000E+01 volume  0.88344E-03 ppm1      9.430 ppm2      6.745 CV     1
  ASSI {   49}
    (( segid "    " and resid 59   and name HN  ))
    (( segid "    " and resid 51   and name HA  ))
       4.100     2.100     1.900 peak    49 spectrum    1 weight  0.10000E+01 volume  0.24838E-03 ppm1      9.431 ppm2      4.863 CV     1
  ASSI {   51}
    (( segid "    " and resid 62   and name HE1 ))
    (  segid "    " and resid 85   and name HG2%)
       6.000     5.800     0.000 peak    51 spectrum    1 weight  0.10000E+01 volume  0.26489E-04 ppm1      9.413 ppm2      0.517 CV     1
  ASSI {   52}
    (( segid "    " and resid 62   and name HE1 ))
    (( segid "    " and resid 71   and name HN  ))
       3.400     1.400     1.400 peak    52 spectrum    1 weight  0.10000E+01 volume  0.83869E-03 ppm1      9.409 ppm2      8.624 CV     1
  ASSI {   53}
    (( segid "    " and resid 62   and name HE1 ))
    (( segid "    " and resid 68   and name HN  ))
       3.800     1.800     1.800 peak    53 spectrum    1 weight  0.10000E+01 volume  0.33329E-03 ppm1      9.405 ppm2      8.403 CV     1
  ASSI {   54}
    (( segid "    " and resid 62   and name HE1 ))
    (( segid "    " and resid 62   and name HH2 ))
       6.000     6.000     0.000 peak    54 spectrum    1 weight  0.10000E+01 volume  0.21816E-05 ppm1      9.405 ppm2      6.668 CV     1
  ASSI {   55}
    (( segid "    " and resid 62   and name HE1 ))
    (( segid "    " and resid 73   and name HA  ))
       3.400     1.400     1.400 peak    55 spectrum    1 weight  0.10000E+01 volume  0.81900E-03 ppm1      9.409 ppm2      3.959 CV     1
  ASSI {   56}
    (( segid "    " and resid 62   and name HE1 ))
    (( segid "    " and resid 72   and name HB2 ))
       5.600     4.000     0.400 peak    56 spectrum    1 weight  0.10000E+01 volume  0.15929E-03 ppm1      9.408 ppm2      2.450 CV     1
  ASSI {   57}
    (( segid "    " and resid 62   and name HE1 ))
    (  segid "    " and resid 77   and name HB% )
       6.000     5.500     0.000 peak    57 spectrum    1 weight  0.10000E+01 volume  0.36959E-04 ppm1      9.407 ppm2      1.792 CV     1
  ASSI {   59}
    (( segid "    " and resid 62   and name HE1 ))
    (( segid "    " and resid 68   and name HG  ))
       4.000     2.000     2.000 peak    59 spectrum    1 weight  0.10000E+01 volume  0.57763E-03 ppm1      9.412 ppm2      1.311 CV     1
  ASSI {   60}
    (( segid "    " and resid 62   and name HE1 ))
    (  segid "    " and resid 68   and name HD2%)
       3.900     3.900     2.100 peak    60 spectrum    1 weight  0.10000E+01 volume  0.17609E-02 ppm1      9.411 ppm2      0.837 CV     1
  ASSI {   61}
    (( segid "    " and resid 62   and name HE1 ))
    (( segid "    " and resid 59   and name HE22))
       3.600     1.600     1.600 peak    61 spectrum    1 weight  0.10000E+01 volume  0.50819E-03 ppm1      9.407 ppm2      7.495 CV     1
  ASSI {   62}
    (( segid "    " and resid 62   and name HE1 ))
    (( segid "    " and resid 62   and name HZ2 ))
       2.700     0.900     0.900 peak    62 spectrum    1 weight  0.10000E+01 volume  0.23775E-02 ppm1      9.408 ppm2      7.180 CV     1
  ASSI {   63}
    (( segid "    " and resid 62   and name HE1 ))
    (( segid "    " and resid 62   and name HD1 ))
       2.300     0.700     0.700 peak    63 spectrum    1 weight  0.10000E+01 volume  0.56238E-02 ppm1      9.409 ppm2      6.749 CV     1
  ASSI {   64}
    (( segid "    " and resid 62   and name HE1 ))
    (( segid "    " and resid 68   and name HA  ))
       2.600     0.900     0.900 peak    64 spectrum    1 weight  0.10000E+01 volume  0.21476E-02 ppm1      9.408 ppm2      4.316 CV     1
  ASSI {   65}
    (( segid "    " and resid 62   and name HE1 ))
    (( segid "    " and resid 62   and name HB1 ))
       5.100     3.300     0.900 peak    65 spectrum    1 weight  0.10000E+01 volume  0.13543E-03 ppm1      9.409 ppm2      3.086 CV     1
  ASSI {   68}
    (( segid "    " and resid 62   and name HE1 ))
    (( segid "    " and resid 68   and name HB2 ))
       6.000     6.000     0.000 peak    68 spectrum    1 weight  0.10000E+01 volume  0.11504E-04 ppm1      9.409 ppm2      1.657 CV     1
  ASSI {   69}
    (( segid "    " and resid 62   and name HE1 ))
    (  segid "    " and resid 71   and name HB% )
       3.200     1.300     1.300 peak    69 spectrum    1 weight  0.10000E+01 volume  0.15691E-02 ppm1      9.408 ppm2      1.521 CV     1
  ASSI {   70}
    (( segid "    " and resid 62   and name HE1 ))
    (  segid "    " and resid 68   and name HD1%)
       2.900     2.900     3.100 peak    70 spectrum    1 weight  0.10000E+01 volume  0.34580E-02 ppm1      9.409 ppm2      0.994 CV     1
  ASSI {   71}
    (( segid "    " and resid 62   and name HE1 ))
    (( segid "    " and resid 70   and name HN  ))
       6.000     5.400     0.000 peak    71 spectrum    1 weight  0.10000E+01 volume  0.25095E-04 ppm1      9.401 ppm2      7.747 CV     1
  ASSI {   72}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 38   and name HG1 ))
       6.000     6.000     0.000 peak    72 spectrum    1 weight  0.10000E+01 volume  0.17310E-04 ppm1      9.253 ppm2      2.214 CV     1
  ASSI {   73}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 36   and name HN  ))
       6.000     6.000     0.000 peak    73 spectrum    1 weight  0.10000E+01 volume  0.42113E-04 ppm1      9.259 ppm2      8.282 CV     1
  ASSI {   75}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 39   and name HN  ))
       2.900     1.000     1.000 peak    75 spectrum    1 weight  0.10000E+01 volume  0.11421E-02 ppm1      9.253 ppm2      7.796 CV     1
  ASSI {   76}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 40   and name HN  ))
       5.500     3.700     0.500 peak    76 spectrum    1 weight  0.10000E+01 volume  0.10838E-03 ppm1      9.254 ppm2      7.714 CV     1
  ASSI {   77}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 37   and name HN  ))
       3.000     1.100     1.100 peak    77 spectrum    1 weight  0.10000E+01 volume  0.10337E-02 ppm1      9.253 ppm2      7.279 CV     1
  ASSI {   78}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 37   and name HB2 ))
       4.000     2.000     2.000 peak    78 spectrum    1 weight  0.10000E+01 volume  0.11770E-02 ppm1      9.251 ppm2      3.193 CV     1
  ASSI {   79}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 101  and name HB1 ))
       4.500     2.500     1.500 peak    79 spectrum    1 weight  0.10000E+01 volume  0.19926E-03 ppm1      9.253 ppm2      3.026 CV     1
  ASSI {   80}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 38   and name HG2 ))
       3.700     1.700     1.700 peak    80 spectrum    1 weight  0.10000E+01 volume  0.89787E-03 ppm1      9.254 ppm2      2.545 CV     1
  ASSI {   81}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 38   and name HB1 ))
       3.400     1.500     1.500 peak    81 spectrum    1 weight  0.10000E+01 volume  0.96193E-03 ppm1      9.253 ppm2      1.754 CV     1
  ASSI {   82}
    (( segid "    " and resid 38   and name HN  ))
    (  segid "    " and resid 35   and name HB% )
       4.200     2.200     1.800 peak    82 spectrum    1 weight  0.10000E+01 volume  0.76377E-03 ppm1      9.253 ppm2      0.496 CV     1
  ASSI {   83}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 37   and name HA  ))
       3.100     1.200     1.200 peak    83 spectrum    1 weight  0.10000E+01 volume  0.23013E-02 ppm1      9.249 ppm2      4.314 CV     1
  ASSI {   84}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 38   and name HA  ))
       3.000     1.100     1.100 peak    84 spectrum    1 weight  0.10000E+01 volume  0.15356E-02 ppm1      9.251 ppm2      4.092 CV     1
  ASSI {   85}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 34   and name HA  ))
       6.000     5.000     0.000 peak    85 spectrum    1 weight  0.10000E+01 volume  0.34388E-04 ppm1      9.248 ppm2      3.389 CV     1
  ASSI {   86}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 39   and name HA  ))
       6.000     4.800     0.000 peak    86 spectrum    1 weight  0.10000E+01 volume  0.81055E-04 ppm1      9.261 ppm2      4.575 CV     1
  ASSI {   87}
    (( segid "    " and resid 38   and name HN  ))
    (  segid "    " and resid 39   and name HB% )
       5.700     4.000     0.300 peak    87 spectrum    1 weight  0.10000E+01 volume  0.13890E-03 ppm1      9.252 ppm2      1.350 CV     1
  ASSI {   88}
    (( segid "    " and resid 38   and name HN  ))
    (( segid "    " and resid 38   and name HB2 ))
       2.600     0.800     0.800 peak    88 spectrum    1 weight  0.10000E+01 volume  0.24523E-02 ppm1      9.251 ppm2      2.061 CV     1
  ASSI {   89}
    (( segid "    " and resid 52   and name HN  ))
    (  segid "    " and resid 52   and name HD% )
       3.000     1.100     1.100 peak    89 spectrum    1 weight  0.10000E+01 volume  0.12312E-02 ppm1      9.241 ppm2      7.103 CV     1
  ASSI {   90}
    (( segid "    " and resid 52   and name HN  ))
    (( segid "    " and resid 52   and name HB2 ))
       3.100     1.200     1.200 peak    90 spectrum    1 weight  0.10000E+01 volume  0.81719E-03 ppm1      9.244 ppm2      2.730 CV     1
  ASSI {   91}
    (( segid "    " and resid 52   and name HN  ))
    (( segid "    " and resid 51   and name HB2 ))
       3.900     1.900     1.900 peak    91 spectrum    1 weight  0.10000E+01 volume  0.59485E-03 ppm1      9.242 ppm2      2.474 CV     1
  ASSI {   92}
    (( segid "    " and resid 52   and name HN  ))
    (( segid "    " and resid 51   and name HB1 ))
       3.500     1.600     1.600 peak    92 spectrum    1 weight  0.10000E+01 volume  0.44847E-03 ppm1      9.240 ppm2      2.117 CV     1
  ASSI {   93}
    (( segid "    " and resid 52   and name HN  ))
    (( segid "    " and resid 56   and name HA  ))
       3.500     1.500     1.500 peak    93 spectrum    1 weight  0.10000E+01 volume  0.58448E-03 ppm1      9.238 ppm2      3.473 CV     1
  ASSI {   94}
    (( segid "    " and resid 52   and name HN  ))
    (( segid "    " and resid 52   and name HB1 ))
       4.600     2.600     1.400 peak    94 spectrum    1 weight  0.10000E+01 volume  0.39708E-03 ppm1      9.246 ppm2      3.283 CV     1
  ASSI {   95}
    (( segid "    " and resid 52   and name HN  ))
    (( segid "    " and resid 75   and name HN  ))
       6.000     6.000     0.000 peak    95 spectrum    1 weight  0.10000E+01 volume  0.14451E-05 ppm1      9.242 ppm2      8.709 CV     1
  ASSI {   96}
    (( segid "    " and resid 52   and name HN  ))
    (( segid "    " and resid 51   and name HN  ))
       4.000     2.000     2.000 peak    96 spectrum    1 weight  0.10000E+01 volume  0.68666E-03 ppm1      9.240 ppm2      7.561 CV     1
  ASSI {   97}
    (( segid "    " and resid 52   and name HN  ))
    (  segid "    " and resid 51   and name HD% )
       5.000     3.100     1.000 peak    97 spectrum    1 weight  0.10000E+01 volume  0.41994E-03 ppm1      9.241 ppm2      6.919 CV     1
  ASSI {   98}
    (( segid "    " and resid 52   and name HN  ))
    (  segid "    " and resid 52   and name HE% )
       6.000     4.500     0.000 peak    98 spectrum    1 weight  0.10000E+01 volume  0.11362E-03 ppm1      9.242 ppm2      6.745 CV     1
  ASSI {   99}
    (( segid "    " and resid 52   and name HN  ))
    (( segid "    " and resid 58   and name HA  ))
       4.700     2.800     1.300 peak    99 spectrum    1 weight  0.10000E+01 volume  0.28797E-03 ppm1      9.240 ppm2      5.374 CV     1
  ASSI {  100}
    (( segid "    " and resid 52   and name HN  ))
    (( segid "    " and resid 51   and name HA  ))
       2.500     0.800     0.800 peak   100 spectrum    1 weight  0.10000E+01 volume  0.30095E-02 ppm1      9.242 ppm2      4.870 CV     1
  ASSI {  101}
    (( segid "    " and resid 52   and name HN  ))
    (  segid "    " and resid 74   and name HB% )
       4.500     2.600     1.500 peak   101 spectrum    1 weight  0.10000E+01 volume  0.24277E-03 ppm1      9.241 ppm2      0.830 CV     1
  ASSI {  102}
    (( segid "    " and resid 86   and name HN  ))
    (( segid "    " and resid 87   and name HN  ))
       3.000     1.100     1.100 peak   102 spectrum    1 weight  0.10000E+01 volume  0.11265E-02 ppm1      9.189 ppm2      8.809 CV     1
  ASSI {  103}
    (( segid "    " and resid 86   and name HN  ))
    (( segid "    " and resid 88   and name HN  ))
       5.400     3.600     0.600 peak   103 spectrum    1 weight  0.10000E+01 volume  0.84165E-04 ppm1      9.189 ppm2      7.349 CV     1
  ASSI {  104}
    (( segid "    " and resid 86   and name HN  ))
    (( segid "    " and resid 98   and name HZ2 ))
       6.000     6.000     0.000 peak   104 spectrum    1 weight  0.10000E+01 volume  0.17220E-04 ppm1      9.193 ppm2      6.920 CV     1
  ASSI {  105}
    (( segid "    " and resid 86   and name HN  ))
    (( segid "    " and resid 86   and name HA  ))
       3.000     1.200     1.200 peak   105 spectrum    1 weight  0.10000E+01 volume  0.12726E-02 ppm1      9.188 ppm2      4.270 CV     1
  ASSI {  106}
    (( segid "    " and resid 86   and name HN  ))
    (( segid "    " and resid 85   and name HA  ))
       3.700     1.700     1.700 peak   106 spectrum    1 weight  0.10000E+01 volume  0.59172E-03 ppm1      9.190 ppm2      3.643 CV     1
  ASSI {  107}
    (( segid "    " and resid 86   and name HN  ))
    (( segid "    " and resid 87   and name HB1 ))
       5.800     4.200     0.200 peak   107 spectrum    1 weight  0.10000E+01 volume  0.12020E-03 ppm1      9.192 ppm2      2.168 CV     1
  ASSI {  108}
    (( segid "    " and resid 86   and name HN  ))
    (( segid "    " and resid 85   and name HB  ))
       2.900     1.000     1.000 peak   108 spectrum    1 weight  0.10000E+01 volume  0.12021E-02 ppm1      9.188 ppm2      2.074 CV     1
  ASSI {  109}
    (( segid "    " and resid 86   and name HN  ))
    (  segid "    " and resid 86   and name HB% )
       2.400     0.700     0.700 peak   109 spectrum    1 weight  0.10000E+01 volume  0.45762E-02 ppm1      9.189 ppm2      0.759 CV     1
  ASSI {  110}
    (( segid "    " and resid 86   and name HN  ))
    (( segid "    " and resid 57   and name HZ  ))
       3.100     1.200     1.200 peak   110 spectrum    1 weight  0.10000E+01 volume  0.11598E-02 ppm1      9.186 ppm2      7.157 CV     1
  ASSI {  111}
    (( segid "    " and resid 86   and name HN  ))
    (( segid "    " and resid 83   and name HA  ))
       3.600     1.600     1.600 peak   111 spectrum    1 weight  0.10000E+01 volume  0.55031E-03 ppm1      9.187 ppm2      2.902 CV     1
  ASSI {  113}
    (( segid "    " and resid 86   and name HN  ))
    (  segid "    " and resid 85   and name HG2%)
       3.800     1.800     1.800 peak   113 spectrum    1 weight  0.10000E+01 volume  0.13905E-02 ppm1      9.186 ppm2      0.523 CV     1
  ASSI {  114}
    (( segid "    " and resid 86   and name HN  ))
    (  segid "    " and resid 85   and name HG1%)
       3.500     1.500     1.500 peak   114 spectrum    1 weight  0.10000E+01 volume  0.13747E-02 ppm1      9.186 ppm2      0.422 CV     1
  ASSI {  115}
    (( segid "    " and resid 86   and name HN  ))
    (( segid "    " and resid 85   and name HN  ))
       2.700     0.900     0.900 peak   115 spectrum    1 weight  0.10000E+01 volume  0.19547E-02 ppm1      9.187 ppm2      7.704 CV     1
  ASSI {  116}
    (( segid "    " and resid 86   and name HN  ))
    (( segid "    " and resid 84   and name HN  ))
       4.600     2.600     1.400 peak   116 spectrum    1 weight  0.10000E+01 volume  0.17271E-03 ppm1      9.191 ppm2      7.563 CV     1
  ASSI {  117}
    (( segid "    " and resid 86   and name HN  ))
    (  segid "    " and resid 84   and name HB% )
       4.200     2.200     1.800 peak   117 spectrum    1 weight  0.10000E+01 volume  0.65057E-03 ppm1      9.193 ppm2      1.460 CV     1
  ASSI {  118}
    (( segid "    " and resid 90   and name HN  ))
    (  segid "    " and resid 86   and name HB% )
       6.000     6.000     0.000 peak   118 spectrum    1 weight  0.10000E+01 volume  0.11284E-04 ppm1      9.187 ppm2      0.771 CV     1
  ASSI {  119}
    (( segid "    " and resid 90   and name HN  ))
    (( segid "    " and resid 98   and name HZ3 ))
       3.600     1.600     1.600 peak   119 spectrum    1 weight  0.10000E+01 volume  0.55591E-03 ppm1      9.184 ppm2      7.062 CV     1
  ASSI {  121}
    (( segid "    " and resid 90   and name HN  ))
    (( segid "    " and resid 91   and name HN  ))
       2.900     1.100     1.100 peak   121 spectrum    1 weight  0.10000E+01 volume  0.12496E-02 ppm1      9.179 ppm2      8.173 CV     1
  ASSI {  122}
    (( segid "    " and resid 90   and name HN  ))
    (( segid "    " and resid 93   and name HE21))
       3.500     1.500     1.500 peak   122 spectrum    1 weight  0.10000E+01 volume  0.92683E-03 ppm1      9.178 ppm2      7.330 CV     1
  ASSI {  123}
    (( segid "    " and resid 90   and name HN  ))
    (( segid "    " and resid 87   and name HA  ))
       3.600     1.600     1.600 peak   123 spectrum    1 weight  0.10000E+01 volume  0.59765E-03 ppm1      9.178 ppm2      4.458 CV     1
  ASSI {  124}
    (( segid "    " and resid 90   and name HN  ))
    (( segid "    " and resid 90   and name HA  ))
       2.700     0.900     0.900 peak   124 spectrum    1 weight  0.10000E+01 volume  0.21436E-02 ppm1      9.179 ppm2      4.244 CV     1
  ASSI {  125}
    (( segid "    " and resid 90   and name HN  ))
    (( segid "    " and resid 89   and name HA  ))
       3.400     1.400     1.400 peak   125 spectrum    1 weight  0.10000E+01 volume  0.64498E-03 ppm1      9.176 ppm2      3.877 CV     1
  ASSI {  127}
    (( segid "    " and resid 90   and name HN  ))
    (( segid "    " and resid 90   and name HG2 ))
       5.700     4.100     0.300 peak   127 spectrum    1 weight  0.10000E+01 volume  0.50881E-04 ppm1      9.180 ppm2      1.827 CV     1
  ASSI {  129}
    (( segid "    " and resid 90   and name HN  ))
    (  segid "    " and resid 89   and name HG2%)
       3.300     3.300     2.700 peak   129 spectrum    1 weight  0.10000E+01 volume  0.17556E-02 ppm1      9.179 ppm2      1.073 CV     1
  ASSI {  132}
    (( segid "    " and resid 90   and name HN  ))
    (( segid "    " and resid 89   and name HB  ))
       3.300     1.400     1.400 peak   132 spectrum    1 weight  0.10000E+01 volume  0.64542E-03 ppm1      9.184 ppm2      4.834 CV     1
  ASSI {  134}
    (( segid "    " and resid 90   and name HN  ))
    (( segid "    " and resid 90   and name HG1 ))
       3.000     1.100     1.100 peak   134 spectrum    1 weight  0.10000E+01 volume  0.20381E-02 ppm1      9.180 ppm2      1.661 CV     1
  ASSI {  135}
    (( segid "    " and resid 53   and name HN  ))
    (  segid "    " and resid 52   and name HD% )
       5.400     3.700     0.600 peak   135 spectrum    1 weight  0.10000E+01 volume  0.13251E-03 ppm1      9.173 ppm2      7.100 CV     1
  ASSI {  136}
    (( segid "    " and resid 53   and name HN  ))
    (( segid "    " and resid 52   and name HA  ))
       2.700     0.900     0.900 peak   136 spectrum    1 weight  0.10000E+01 volume  0.22860E-02 ppm1      9.169 ppm2      4.911 CV     1
  ASSI {  137}
    (( segid "    " and resid 53   and name HN  ))
    (( segid "    " and resid 75   and name HA  ))
       4.000     2.000     2.000 peak   137 spectrum    1 weight  0.10000E+01 volume  0.48816E-03 ppm1      9.174 ppm2      4.356 CV     1
  ASSI {  138}
    (( segid "    " and resid 53   and name HN  ))
    (( segid "    " and resid 53   and name HA2 ))
       3.400     1.400     1.400 peak   138 spectrum    1 weight  0.10000E+01 volume  0.86792E-03 ppm1      9.171 ppm2      4.020 CV     1
  ASSI {  139}
    (( segid "    " and resid 53   and name HN  ))
    (( segid "    " and resid 52   and name HB2 ))
       4.700     2.800     1.300 peak   139 spectrum    1 weight  0.10000E+01 volume  0.29316E-03 ppm1      9.173 ppm2      2.715 CV     1
  ASSI {  140}
    (( segid "    " and resid 53   and name HN  ))
    (( segid "    " and resid 75   and name HB2 ))
       4.100     2.100     1.900 peak   140 spectrum    1 weight  0.10000E+01 volume  0.64234E-03 ppm1      9.174 ppm2      2.518 CV     1
  ASSI {  141}
    (( segid "    " and resid 53   and name HN  ))
    (  segid "    " and resid 45   and name HG2%)
       3.200     1.300     1.300 peak   141 spectrum    1 weight  0.10000E+01 volume  0.20821E-02 ppm1      9.171 ppm2      0.764 CV     1
  ASSI {  142}
    (( segid "    " and resid 53   and name HN  ))
    (( segid "    " and resid 52   and name HB1 ))
       3.900     1.900     1.900 peak   142 spectrum    1 weight  0.10000E+01 volume  0.16612E-03 ppm1      9.167 ppm2      3.275 CV     1
  ASSI {  143}
    (( segid "    " and resid 47   and name HN  ))
    (( segid "    " and resid 46   and name HB2 ))
       5.500     3.700     0.500 peak   143 spectrum    1 weight  0.10000E+01 volume  0.17460E-03 ppm1      9.040 ppm2      3.090 CV     1
  ASSI {  145}
    (( segid "    " and resid 47   and name HN  ))
    (( segid "    " and resid 46   and name HB1 ))
       5.900     4.400     0.100 peak   145 spectrum    1 weight  0.10000E+01 volume  0.82799E-04 ppm1      9.049 ppm2      2.934 CV     1
  ASSI {  147}
    (( segid "    " and resid 47   and name HN  ))
    (( segid "    " and resid 46   and name HN  ))
       3.900     1.900     1.900 peak   147 spectrum    1 weight  0.10000E+01 volume  0.36182E-03 ppm1      9.045 ppm2      8.432 CV     1
  ASSI {  149}
    (( segid "    " and resid 47   and name HN  ))
    (( segid "    " and resid 46   and name HA  ))
       2.600     0.800     0.800 peak   149 spectrum    1 weight  0.10000E+01 volume  0.31332E-02 ppm1      9.043 ppm2      4.764 CV     1
  ASSI {  150}
    (( segid "    " and resid 47   and name HN  ))
    (( segid "    " and resid 47   and name HB  ))
       4.800     2.900     1.200 peak   150 spectrum    1 weight  0.10000E+01 volume  0.21507E-03 ppm1      9.044 ppm2      4.521 CV     1
  ASSI {  151}
    (( segid "    " and resid 47   and name HN  ))
    (( segid "    " and resid 47   and name HA  ))
       3.100     1.200     1.200 peak   151 spectrum    1 weight  0.10000E+01 volume  0.12909E-02 ppm1      9.043 ppm2      4.382 CV     1
  ASSI {  152}
    (( segid "    " and resid 47   and name HN  ))
    (  segid "    " and resid 47   and name HG2%)
       2.800     1.000     1.000 peak   152 spectrum    1 weight  0.10000E+01 volume  0.24014E-02 ppm1      9.044 ppm2      1.237 CV     1
  ASSI {  153}
    (( segid "    " and resid 47   and name HN  ))
    (  segid "    " and resid 45   and name HG2%)
       3.800     1.800     1.800 peak   153 spectrum    1 weight  0.10000E+01 volume  0.39273E-03 ppm1      9.046 ppm2      0.761 CV     1
  ASSI {  154}
    (( segid "    " and resid 47   and name HN  ))
    (( segid "    " and resid 48   and name HA2 ))
       6.000     6.000     0.000 peak   154 spectrum    1 weight  0.10000E+01 volume  0.49073E-04 ppm1      9.037 ppm2      4.237 CV     1
  ASSI {  155}
    (( segid "    " and resid 47   and name HN  ))
    (( segid "    " and resid 48   and name HA1 ))
       6.000     6.000     0.000 peak   155 spectrum    1 weight  0.10000E+01 volume  0.16935E-04 ppm1      9.040 ppm2      3.937 CV     1
  ASSI {  156}
    (( segid "    " and resid 47   and name HN  ))
    (( segid "    " and resid 45   and name HG12))
       4.700     2.800     1.300 peak   156 spectrum    1 weight  0.10000E+01 volume  0.85103E-04 ppm1      9.040 ppm2      1.347 CV     1
  ASSI {  157}
    (( segid "    " and resid 47   and name HN  ))
    (  segid "    " and resid 45   and name HD1%)
       5.700     4.000     0.300 peak   157 spectrum    1 weight  0.10000E+01 volume  0.77633E-04 ppm1      9.045 ppm2      0.907 CV     1
  ASSI {  158}
    (( segid "    " and resid 58   and name HN  ))
    (( segid "    " and resid 58   and name HA  ))
       3.700     1.700     1.700 peak   158 spectrum    1 weight  0.10000E+01 volume  0.29359E-03 ppm1      9.021 ppm2      5.382 CV     1
  ASSI {  159}
    (( segid "    " and resid 58   and name HN  ))
    (( segid "    " and resid 57   and name HA  ))
       2.500     0.800     0.800 peak   159 spectrum    1 weight  0.10000E+01 volume  0.48983E-02 ppm1      9.018 ppm2      4.943 CV     1
  ASSI {  160}
    (( segid "    " and resid 58   and name HN  ))
    (( segid "    " and resid 58   and name HB1 ))
       3.100     1.200     1.200 peak   160 spectrum    1 weight  0.10000E+01 volume  0.11959E-02 ppm1      9.021 ppm2      2.809 CV     1
  ASSI {  161}
    (( segid "    " and resid 58   and name HN  ))
    (( segid "    " and resid 62   and name HN  ))
       4.400     2.400     1.600 peak   161 spectrum    1 weight  0.10000E+01 volume  0.21003E-03 ppm1      9.014 ppm2      8.125 CV     1
  ASSI {  162}
    (( segid "    " and resid 58   and name HN  ))
    (  segid "    " and resid 57   and name HD% )
       3.600     1.600     1.600 peak   162 spectrum    1 weight  0.10000E+01 volume  0.92600E-03 ppm1      9.014 ppm2      7.766 CV     1
  ASSI {  163}
    (( segid "    " and resid 58   and name HN  ))
    (  segid "    " and resid 51   and name HD% )
       3.900     1.900     1.900 peak   163 spectrum    1 weight  0.10000E+01 volume  0.84549E-03 ppm1      9.014 ppm2      6.913 CV     1
  ASSI {  164}
    (( segid "    " and resid 58   and name HN  ))
    (  segid "    " and resid 51   and name HE% )
       4.800     2.800     1.200 peak   164 spectrum    1 weight  0.10000E+01 volume  0.25642E-03 ppm1      9.016 ppm2      6.851 CV     1
  ASSI {  165}
    (( segid "    " and resid 58   and name HN  ))
    (( segid "    " and resid 58   and name HB2 ))
       4.000     2.000     2.000 peak   165 spectrum    1 weight  0.10000E+01 volume  0.50224E-03 ppm1      9.008 ppm2      3.173 CV     1
  ASSI {  166}
    (( segid "    " and resid 58   and name HN  ))
    (( segid "    " and resid 61   and name HB  ))
       3.400     1.400     1.400 peak   166 spectrum    1 weight  0.10000E+01 volume  0.69489E-03 ppm1      9.019 ppm2      4.453 CV     1
  ASSI {  167}
    (( segid "    " and resid 58   and name HN  ))
    (( segid "    " and resid 57   and name HB2 ))
       3.300     1.400     1.400 peak   167 spectrum    1 weight  0.10000E+01 volume  0.77161E-03 ppm1      9.016 ppm2      3.788 CV     1
  ASSI {  168}
    (( segid "    " and resid 58   and name HN  ))
    (  segid "    " and resid 61   and name HG2%)
       4.700     2.800     1.300 peak   168 spectrum    1 weight  0.10000E+01 volume  0.26751E-03 ppm1      9.018 ppm2      1.414 CV     1
  ASSI {  169}
    (( segid "    " and resid 79   and name HN  ))
    (( segid "    " and resid 79   and name HA  ))
       2.800     1.000     1.000 peak   169 spectrum    1 weight  0.10000E+01 volume  0.17327E-02 ppm1      8.909 ppm2      3.252 CV     1
  ASSI {  170}
    (( segid "    " and resid 79   and name HN  ))
    (( segid "    " and resid 80   and name HB1 ))
       5.800     4.200     0.200 peak   170 spectrum    1 weight  0.10000E+01 volume  0.99286E-04 ppm1      8.912 ppm2      1.734 CV     1
  ASSI {  171}
    (( segid "    " and resid 79   and name HN  ))
    (  segid "    " and resid 78   and name HG2%)
       3.600     1.700     1.700 peak   171 spectrum    1 weight  0.10000E+01 volume  0.27659E-02 ppm1      8.908 ppm2      1.316 CV     1
  ASSI {  172}
    (( segid "    " and resid 79   and name HN  ))
    (( segid "    " and resid 79   and name HB1 ))
       4.700     2.800     1.300 peak   172 spectrum    1 weight  0.10000E+01 volume  0.27800E-03 ppm1      8.910 ppm2      0.316 CV     1
  ASSI {  173}
    (( segid "    " and resid 79   and name HN  ))
    (( segid "    " and resid 80   and name HN  ))
       2.900     1.100     1.100 peak   173 spectrum    1 weight  0.10000E+01 volume  0.13554E-02 ppm1      8.906 ppm2      8.176 CV     1
  ASSI {  174}
    (( segid "    " and resid 79   and name HN  ))
    (( segid "    " and resid 78   and name HB  ))
       2.400     0.700     0.700 peak   174 spectrum    1 weight  0.10000E+01 volume  0.33722E-02 ppm1      8.908 ppm2      4.612 CV     1
  ASSI {  175}
    (( segid "    " and resid 79   and name HN  ))
    (( segid "    " and resid 79   and name HD1 ))
       5.600     3.900     0.400 peak   175 spectrum    1 weight  0.10000E+01 volume  0.16337E-03 ppm1      8.904 ppm2      2.259 CV     1
  ASSI {  176}
    (( segid "    " and resid 79   and name HN  ))
    (( segid "    " and resid 82   and name HE21))
       5.500     3.800     0.500 peak   176 spectrum    1 weight  0.10000E+01 volume  0.62370E-04 ppm1      8.912 ppm2      8.261 CV     1
  ASSI {  178}
    (( segid "    " and resid 79   and name HN  ))
    (( segid "    " and resid 78   and name HA  ))
       2.500     0.800     0.800 peak   178 spectrum    1 weight  0.10000E+01 volume  0.44760E-02 ppm1      8.908 ppm2      4.217 CV     1
  ASSI {  180}
    (( segid "    " and resid 79   and name HN  ))
    (( segid "    " and resid 79   and name HG1 ))
       2.300     0.700     0.700 peak   180 spectrum    1 weight  0.10000E+01 volume  0.26545E-02 ppm1      8.908 ppm2      0.586 CV     1
  ASSI {  181}
    (( segid "    " and resid 59   and name HE21))
    (( segid "    " and resid 59   and name HB1 ))
       5.000     3.100     1.000 peak   181 spectrum    1 weight  0.10000E+01 volume  0.23090E-03 ppm1      8.840 ppm2      1.953 CV     1
  ASSI {  182}
    (( segid "    " and resid 59   and name HE21))
    (  segid "    " and resid 52   and name HE% )
       3.900     1.900     1.900 peak   182 spectrum    1 weight  0.10000E+01 volume  0.10066E-02 ppm1      8.855 ppm2      6.749 CV     1
  ASSI {  183}
    (( segid "    " and resid 59   and name HE21))
    (( segid "    " and resid 62   and name HB1 ))
       3.700     1.700     1.700 peak   183 spectrum    1 weight  0.10000E+01 volume  0.62529E-03 ppm1      8.851 ppm2      3.073 CV     1
  ASSI {  184}
    (( segid "    " and resid 59   and name HE21))
    (( segid "    " and resid 59   and name HG1 ))
       2.800     1.000     1.000 peak   184 spectrum    1 weight  0.10000E+01 volume  0.31800E-02 ppm1      8.854 ppm2      2.458 CV     1
  ASSI {  185}
    (( segid "    " and resid 59   and name HE21))
    (( segid "    " and resid 63   and name HB1 ))
       3.900     3.900     2.100 peak   185 spectrum    1 weight  0.10000E+01 volume  0.10619E-02 ppm1      8.855 ppm2      2.081 CV     1
  ASSI {  186}
    (( segid "    " and resid 59   and name HE21))
    (  segid "    " and resid 68   and name HD1%)
       4.200     2.200     1.800 peak   186 spectrum    1 weight  0.10000E+01 volume  0.68896E-03 ppm1      8.855 ppm2      0.993 CV     1
  ASSI {  189}
    (( segid "    " and resid 93   and name HN  ))
    (( segid "    " and resid 93   and name HA  ))
       2.800     1.000     1.000 peak   189 spectrum    1 weight  0.10000E+01 volume  0.20868E-02 ppm1      8.832 ppm2      4.666 CV     1
  ASSI {  190}
    (( segid "    " and resid 93   and name HN  ))
    (( segid "    " and resid 89   and name HA  ))
       4.400     2.400     1.600 peak   190 spectrum    1 weight  0.10000E+01 volume  0.36723E-03 ppm1      8.837 ppm2      3.868 CV     1
  ASSI {  191}
    (( segid "    " and resid 93   and name HN  ))
    (( segid "    " and resid 93   and name HG1 ))
       3.400     1.400     1.400 peak   191 spectrum    1 weight  0.10000E+01 volume  0.19505E-02 ppm1      8.833 ppm2      2.426 CV     1
  ASSI {  192}
    (( segid "    " and resid 93   and name HN  ))
    (( segid "    " and resid 92   and name HN  ))
       2.500     0.800     0.800 peak   192 spectrum    1 weight  0.10000E+01 volume  0.22517E-02 ppm1      8.830 ppm2      7.808 CV     1
  ASSI {  193}
    (( segid "    " and resid 93   and name HN  ))
    (( segid "    " and resid 94   and name HA1 ))
       6.000     4.500     0.000 peak   193 spectrum    1 weight  0.10000E+01 volume  0.13984E-03 ppm1      8.829 ppm2      3.811 CV     1
  ASSI {  194}
    (( segid "    " and resid 93   and name HN  ))
    (( segid "    " and resid 92   and name HB2 ))
       2.000     0.500     0.500 peak   194 spectrum    1 weight  0.10000E+01 volume  0.76788E-02 ppm1      8.830 ppm2      2.004 CV     1
  ASSI {  196}
    (( segid "    " and resid 93   and name HN  ))
    (( segid "    " and resid 94   and name HN  ))
       2.400     0.700     0.700 peak   196 spectrum    1 weight  0.10000E+01 volume  0.33995E-02 ppm1      8.832 ppm2      8.324 CV     1
  ASSI {  197}
    (( segid "    " and resid 93   and name HN  ))
    (( segid "    " and resid 92   and name HA  ))
       2.900     1.100     1.100 peak   197 spectrum    1 weight  0.10000E+01 volume  0.26552E-02 ppm1      8.832 ppm2      4.271 CV     1
  ASSI {  198}
    (( segid "    " and resid 93   and name HN  ))
    (( segid "    " and resid 93   and name HB2 ))
       3.700     1.700     1.700 peak   198 spectrum    1 weight  0.10000E+01 volume  0.14513E-02 ppm1      8.833 ppm2      2.186 CV     1
  ASSI {  199}
    (( segid "    " and resid 93   and name HN  ))
    (( segid "    " and resid 92   and name HG2 ))
       5.400     3.700     0.600 peak   199 spectrum    1 weight  0.10000E+01 volume  0.36092E-03 ppm1      8.833 ppm2      1.891 CV     1
  ASSI {  200}
    (( segid "    " and resid 93   and name HN  ))
    (( segid "    " and resid 93   and name HB1 ))
       3.400     1.500     1.500 peak   200 spectrum    1 weight  0.10000E+01 volume  0.40532E-03 ppm1      8.833 ppm2      1.650 CV     1
  ASSI {  201}
    (( segid "    " and resid 93   and name HN  ))
    (  segid "    " and resid 89   and name HG2%)
       4.500     2.500     1.500 peak   201 spectrum    1 weight  0.10000E+01 volume  0.28063E-03 ppm1      8.826 ppm2      1.075 CV     1
  ASSI {  202}
    (( segid "    " and resid 87   and name HN  ))
    (( segid "    " and resid 31   and name HZ2 ))
       4.400     2.500     1.600 peak   202 spectrum    1 weight  0.10000E+01 volume  0.26470E-03 ppm1      8.807 ppm2      7.085 CV     1
  ASSI {  203}
    (( segid "    " and resid 87   and name HN  ))
    (( segid "    " and resid 87   and name HA  ))
       2.900     1.100     1.100 peak   203 spectrum    1 weight  0.10000E+01 volume  0.13809E-02 ppm1      8.806 ppm2      4.463 CV     1
  ASSI {  204}
    (( segid "    " and resid 87   and name HN  ))
    (  segid "    " and resid 86   and name HB% )
       2.900     1.100     1.100 peak   204 spectrum    1 weight  0.10000E+01 volume  0.20680E-02 ppm1      8.809 ppm2      0.758 CV     1
  ASSI {  205}
    (( segid "    " and resid 87   and name HN  ))
    (( segid "    " and resid 57   and name HZ  ))
       6.000     6.000     0.000 peak   205 spectrum    1 weight  0.10000E+01 volume  0.20779E-05 ppm1      8.805 ppm2      7.166 CV     1
  ASSI {  206}
    (( segid "    " and resid 87   and name HN  ))
    (( segid "    " and resid 90   and name HB2 ))
       6.000     6.000     0.000 peak   206 spectrum    1 weight  0.10000E+01 volume  0.16571E-05 ppm1      8.806 ppm2      2.020 CV     1
  ASSI {  207}
    (( segid "    " and resid 87   and name HN  ))
    (( segid "    " and resid 88   and name HN  ))
       3.000     1.100     1.100 peak   207 spectrum    1 weight  0.10000E+01 volume  0.13685E-02 ppm1      8.808 ppm2      7.363 CV     1
  ASSI {  208}
    (( segid "    " and resid 87   and name HN  ))
    (( segid "    " and resid 86   and name HA  ))
       3.900     1.900     1.900 peak   208 spectrum    1 weight  0.10000E+01 volume  0.37039E-03 ppm1      8.812 ppm2      4.272 CV     1
  ASSI {  209}
    (( segid "    " and resid 87   and name HN  ))
    (( segid "    " and resid 84   and name HA  ))
       3.600     1.600     1.600 peak   209 spectrum    1 weight  0.10000E+01 volume  0.59381E-03 ppm1      8.808 ppm2      3.959 CV     1
  ASSI {  210}
    (( segid "    " and resid 87   and name HN  ))
    (( segid "    " and resid 85   and name HA  ))
       3.900     1.900     1.900 peak   210 spectrum    1 weight  0.10000E+01 volume  0.43374E-03 ppm1      8.809 ppm2      3.665 CV     1
  ASSI {  211}
    (( segid "    " and resid 87   and name HN  ))
    (( segid "    " and resid 83   and name HA  ))
       4.500     2.500     1.500 peak   211 spectrum    1 weight  0.10000E+01 volume  0.15079E-03 ppm1      8.809 ppm2      2.901 CV     1
  ASSI {  213}
    (( segid "    " and resid 87   and name HN  ))
    (( segid "    " and resid 87   and name HB1 ))
       2.500     0.800     0.800 peak   213 spectrum    1 weight  0.10000E+01 volume  0.66044E-02 ppm1      8.807 ppm2      2.166 CV     1
  ASSI {  214}
    (( segid "    " and resid 87   and name HN  ))
    (( segid "    " and resid 85   and name HB  ))
       5.000     3.100     1.000 peak   214 spectrum    1 weight  0.10000E+01 volume  0.24732E-03 ppm1      8.808 ppm2      2.059 CV     1
  ASSI {  215}
    (( segid "    " and resid 87   and name HN  ))
    (  segid "    " and resid 84   and name HB% )
       4.900     3.000     1.100 peak   215 spectrum    1 weight  0.10000E+01 volume  0.20763E-03 ppm1      8.809 ppm2      1.478 CV     1
  ASSI {  216}
    (( segid "    " and resid 87   and name HN  ))
    (  segid "    " and resid 88   and name HG2%)
       4.200     2.300     1.800 peak   216 spectrum    1 weight  0.10000E+01 volume  0.65397E-03 ppm1      8.810 ppm2      1.179 CV     1
  ASSI {  217}
    (( segid "    " and resid 87   and name HN  ))
    (  segid "    " and resid 83   and name HG2%)
       3.800     1.800     1.800 peak   217 spectrum    1 weight  0.10000E+01 volume  0.47697E-03 ppm1      8.807 ppm2      0.421 CV     1
  ASSI {  219}
    (( segid "    " and resid 35   and name HN  ))
    (( segid "    " and resid 34   and name HN  ))
       3.200     1.300     1.300 peak   219 spectrum    1 weight  0.10000E+01 volume  0.93895E-03 ppm1      8.808 ppm2      8.520 CV     1
  ASSI {  220}
    (( segid "    " and resid 35   and name HN  ))
    (( segid "    " and resid 31   and name HA  ))
       6.000     5.300     0.000 peak   220 spectrum    1 weight  0.10000E+01 volume  0.22735E-04 ppm1      8.811 ppm2      4.443 CV     1
  ASSI {  221}
    (( segid "    " and resid 35   and name HN  ))
    (( segid "    " and resid 34   and name HB  ))
       2.900     1.100     1.100 peak   221 spectrum    1 weight  0.10000E+01 volume  0.12601E-02 ppm1      8.807 ppm2      1.897 CV     1
  ASSI {  222}
    (( segid "    " and resid 35   and name HN  ))
    (  segid "    " and resid 34   and name HG2%)
       5.100     3.200     0.900 peak   222 spectrum    1 weight  0.10000E+01 volume  0.83260E-04 ppm1      8.810 ppm2      0.211 CV     1
  ASSI {  224}
    (( segid "    " and resid 35   and name HN  ))
    (( segid "    " and resid 35   and name HA  ))
       3.100     1.200     1.200 peak   224 spectrum    1 weight  0.10000E+01 volume  0.14279E-02 ppm1      8.805 ppm2      4.305 CV     1
  ASSI {  225}
    (( segid "    " and resid 35   and name HN  ))
    (( segid "    " and resid 36   and name HA1 ))
       6.000     6.000     0.000 peak   225 spectrum    1 weight  0.10000E+01 volume  0.16839E-04 ppm1      8.804 ppm2      3.505 CV     1
  ASSI {  226}
    (( segid "    " and resid 35   and name HN  ))
    (( segid "    " and resid 34   and name HA  ))
       3.700     1.700     1.700 peak   226 spectrum    1 weight  0.10000E+01 volume  0.51674E-03 ppm1      8.805 ppm2      3.400 CV     1
  ASSI {  227}
    (( segid "    " and resid 35   and name HN  ))
    (  segid "    " and resid 55   and name HG2%)
       3.600     3.600     2.400 peak   227 spectrum    1 weight  0.10000E+01 volume  0.82717E-03 ppm1      8.806 ppm2      0.645 CV     1
  ASSI {  228}
    (( segid "    " and resid 35   and name HN  ))
    (  segid "    " and resid 35   and name HB% )
       2.300     0.700     0.700 peak   228 spectrum    1 weight  0.10000E+01 volume  0.64915E-02 ppm1      8.805 ppm2      0.483 CV     1
  ASSI {  229}
    (( segid "    " and resid 35   and name HN  ))
    (( segid "    " and resid 36   and name HA2 ))
       6.000     6.000     0.000 peak   229 spectrum    1 weight  0.10000E+01 volume  0.25102E-04 ppm1      8.814 ppm2      3.845 CV     1
  ASSI {  230}
    (( segid "    " and resid 35   and name HN  ))
    (( segid "    " and resid 36   and name HN  ))
       3.000     1.100     1.100 peak   230 spectrum    1 weight  0.10000E+01 volume  0.14001E-02 ppm1      8.807 ppm2      8.286 CV     1
  ASSI {  231}
    (( segid "    " and resid 35   and name HN  ))
    (( segid "    " and resid 32   and name HA  ))
       4.500     2.500     1.500 peak   231 spectrum    1 weight  0.10000E+01 volume  0.10786E-03 ppm1      8.802 ppm2      4.845 CV     1
  ASSI {  233}
    (( segid "    " and resid 78   and name HN  ))
    (( segid "    " and resid 77   and name HA  ))
       3.300     1.300     1.300 peak   233 spectrum    1 weight  0.10000E+01 volume  0.74688E-03 ppm1      8.776 ppm2      4.824 CV     1
  ASSI {  235}
    (( segid "    " and resid 78   and name HN  ))
    (( segid "    " and resid 78   and name HA  ))
       3.100     1.200     1.200 peak   235 spectrum    1 weight  0.10000E+01 volume  0.12857E-02 ppm1      8.775 ppm2      4.218 CV     1
  ASSI {  236}
    (( segid "    " and resid 78   and name HN  ))
    (( segid "    " and resid 81   and name HB2 ))
       3.900     2.000     2.000 peak   236 spectrum    1 weight  0.10000E+01 volume  0.15744E-03 ppm1      8.777 ppm2      1.934 CV     1
  ASSI {  237}
    (( segid "    " and resid 78   and name HN  ))
    (  segid "    " and resid 78   and name HG2%)
       2.400     2.400     3.600 peak   237 spectrum    1 weight  0.10000E+01 volume  0.60357E-02 ppm1      8.775 ppm2      1.319 CV     1
  ASSI {  240}
    (( segid "    " and resid 78   and name HN  ))
    (( segid "    " and resid 78   and name HB  ))
       4.500     2.500     1.500 peak   240 spectrum    1 weight  0.10000E+01 volume  0.27585E-03 ppm1      8.771 ppm2      4.608 CV     1
  ASSI {  242}
    (( segid "    " and resid 78   and name HN  ))
    (( segid "    " and resid 81   and name HG1 ))
       4.500     2.600     1.500 peak   242 spectrum    1 weight  0.10000E+01 volume  0.22016E-03 ppm1      8.772 ppm2      2.137 CV     1
  ASSI {  243}
    (( segid "    " and resid 78   and name HN  ))
    (  segid "    " and resid 77   and name HB% )
       2.700     0.900     0.900 peak   243 spectrum    1 weight  0.10000E+01 volume  0.31438E-02 ppm1      8.774 ppm2      1.808 CV     1
  ASSI {  244}
    (( segid "    " and resid 78   and name HN  ))
    (  segid "    " and resid 71   and name HB% )
       2.700     2.700     3.300 peak   244 spectrum    1 weight  0.10000E+01 volume  0.14497E-02 ppm1      8.774 ppm2      1.525 CV     1
  ASSI {  245}
    (( segid "    " and resid 78   and name HN  ))
    (( segid "    " and resid 81   and name HN  ))
       4.100     2.100     1.900 peak   245 spectrum    1 weight  0.10000E+01 volume  0.28071E-03 ppm1      8.773 ppm2      7.566 CV     1
  ASSI {  246}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 62   and name HB1 ))
       6.000     4.800     0.000 peak   246 spectrum    1 weight  0.10000E+01 volume  0.35224E-04 ppm1      8.784 ppm2      3.080 CV     1
  ASSI {  247}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 59   and name HN  ))
       2.900     1.100     1.100 peak   247 spectrum    1 weight  0.10000E+01 volume  0.11957E-02 ppm1      8.777 ppm2      9.431 CV     1
  ASSI {  248}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 61   and name HN  ))
       2.700     0.900     0.900 peak   248 spectrum    1 weight  0.10000E+01 volume  0.28411E-02 ppm1      8.777 ppm2      8.657 CV     1
  ASSI {  249}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 62   and name HN  ))
       4.800     2.900     1.200 peak   249 spectrum    1 weight  0.10000E+01 volume  0.13393E-03 ppm1      8.777 ppm2      8.129 CV     1
  ASSI {  250}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 58   and name HA  ))
       4.500     2.600     1.500 peak   250 spectrum    1 weight  0.10000E+01 volume  0.24941E-03 ppm1      8.776 ppm2      5.381 CV     1
  ASSI {  251}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 61   and name HB  ))
       5.600     3.900     0.400 peak   251 spectrum    1 weight  0.10000E+01 volume  0.13469E-03 ppm1      8.778 ppm2      4.465 CV     1
  ASSI {  252}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 59   and name HA  ))
       3.000     1.100     1.100 peak   252 spectrum    1 weight  0.10000E+01 volume  0.13548E-02 ppm1      8.780 ppm2      4.119 CV     1
  ASSI {  253}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 60   and name HA1 ))
       2.000     0.500     0.500 peak   253 spectrum    1 weight  0.10000E+01 volume  0.11241E-01 ppm1      8.779 ppm2      3.969 CV     1
  ASSI {  254}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 60   and name HA2 ))
       2.700     0.900     0.900 peak   254 spectrum    1 weight  0.10000E+01 volume  0.55509E-02 ppm1      8.778 ppm2      3.880 CV     1
  ASSI {  255}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 58   and name HB2 ))
       3.200     1.300     1.300 peak   255 spectrum    1 weight  0.10000E+01 volume  0.75522E-03 ppm1      8.779 ppm2      3.161 CV     1
  ASSI {  256}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 58   and name HB1 ))
       5.300     3.500     0.700 peak   256 spectrum    1 weight  0.10000E+01 volume  0.16346E-03 ppm1      8.777 ppm2      2.822 CV     1
  ASSI {  257}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 59   and name HG2 ))
       4.000     2.000     2.000 peak   257 spectrum    1 weight  0.10000E+01 volume  0.12290E-02 ppm1      8.778 ppm2      2.459 CV     1
  ASSI {  258}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 59   and name HB2 ))
       3.700     1.700     1.700 peak   258 spectrum    1 weight  0.10000E+01 volume  0.13005E-02 ppm1      8.779 ppm2      2.300 CV     1
  ASSI {  259}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 59   and name HB1 ))
       2.900     1.000     1.000 peak   259 spectrum    1 weight  0.10000E+01 volume  0.13955E-02 ppm1      8.779 ppm2      1.964 CV     1
  ASSI {  260}
    (( segid "    " and resid 60   and name HN  ))
    (  segid "    " and resid 52   and name HE% )
       6.000     5.400     0.000 peak   260 spectrum    1 weight  0.10000E+01 volume  0.81922E-04 ppm1      8.773 ppm2      6.750 CV     1
  ASSI {  261}
    (( segid "    " and resid 60   and name HN  ))
    (( segid "    " and resid 63   and name HB1 ))
       4.500     2.500     1.500 peak   261 spectrum    1 weight  0.10000E+01 volume  0.34045E-03 ppm1      8.774 ppm2      2.072 CV     1
  ASSI {  262}
    (( segid "    " and resid 102  and name HN  ))
    (( segid "    " and resid 101  and name HB2 ))
       4.000     2.000     2.000 peak   262 spectrum    1 weight  0.10000E+01 volume  0.20508E-03 ppm1      8.757 ppm2      3.117 CV     1
  ASSI {  263}
    (( segid "    " and resid 102  and name HN  ))
    (( segid "    " and resid 101  and name HB1 ))
       4.300     2.300     1.700 peak   263 spectrum    1 weight  0.10000E+01 volume  0.43680E-03 ppm1      8.756 ppm2      3.008 CV     1
  ASSI {  264}
    (( segid "    " and resid 102  and name HN  ))
    (  segid "    " and resid 102  and name HB% )
       2.600     0.800     0.800 peak   264 spectrum    1 weight  0.10000E+01 volume  0.30907E-02 ppm1      8.756 ppm2      1.465 CV     1
  ASSI {  265}
    (( segid "    " and resid 102  and name HN  ))
    (( segid "    " and resid 101  and name HA  ))
       5.100     3.200     0.900 peak   265 spectrum    1 weight  0.10000E+01 volume  0.84022E-04 ppm1      8.753 ppm2      4.550 CV     1
  ASSI {  266}
    (( segid "    " and resid 102  and name HN  ))
    (( segid "    " and resid 103  and name HN  ))
       3.300     1.300     1.300 peak   266 spectrum    1 weight  0.10000E+01 volume  0.78884E-03 ppm1      8.753 ppm2      7.608 CV     1
  ASSI {  267}
    (( segid "    " and resid 101  and name HN  ))
    (( segid "    " and resid 99   and name HA  ))
       4.500     2.500     1.500 peak   267 spectrum    1 weight  0.10000E+01 volume  0.34269E-03 ppm1      8.718 ppm2      4.344 CV     1
  ASSI {  268}
    (( segid "    " and resid 101  and name HN  ))
    (( segid "    " and resid 99   and name HG2 ))
       6.000     5.600     0.000 peak   268 spectrum    1 weight  0.10000E+01 volume  0.38003E-04 ppm1      8.711 ppm2      2.017 CV     1
  ASSI {  270}
    (( segid "    " and resid 101  and name HN  ))
    (( segid "    " and resid 100  and name HN  ))
       3.000     1.100     1.100 peak   270 spectrum    1 weight  0.10000E+01 volume  0.12669E-02 ppm1      8.719 ppm2      8.000 CV     1
  ASSI {  271}
    (( segid "    " and resid 101  and name HN  ))
    (( segid "    " and resid 101  and name HA  ))
       3.000     1.100     1.100 peak   271 spectrum    1 weight  0.10000E+01 volume  0.15250E-02 ppm1      8.718 ppm2      4.549 CV     1
  ASSI {  272}
    (( segid "    " and resid 101  and name HN  ))
    (( segid "    " and resid 100  and name HA  ))
       3.400     1.500     1.500 peak   272 spectrum    1 weight  0.10000E+01 volume  0.87094E-03 ppm1      8.719 ppm2      3.865 CV     1
  ASSI {  273}
    (( segid "    " and resid 101  and name HN  ))
    (( segid "    " and resid 101  and name HB1 ))
       3.200     1.300     1.300 peak   273 spectrum    1 weight  0.10000E+01 volume  0.28007E-02 ppm1      8.717 ppm2      3.019 CV     1
  ASSI {  274}
    (( segid "    " and resid 101  and name HN  ))
    (( segid "    " and resid 100  and name HB  ))
       2.800     1.000     1.000 peak   274 spectrum    1 weight  0.10000E+01 volume  0.23408E-02 ppm1      8.720 ppm2      2.150 CV     1
  ASSI {  275}
    (( segid "    " and resid 101  and name HN  ))
    (  segid "    " and resid 102  and name HB% )
       5.000     3.200     1.000 peak   275 spectrum    1 weight  0.10000E+01 volume  0.24796E-03 ppm1      8.721 ppm2      1.454 CV     1
  ASSI {  276}
    (( segid "    " and resid 101  and name HN  ))
    (  segid "    " and resid 100  and name HG2%)
       3.800     1.800     1.800 peak   276 spectrum    1 weight  0.10000E+01 volume  0.10096E-02 ppm1      8.721 ppm2      0.961 CV     1
  ASSI {  277}
    (( segid "    " and resid 101  and name HN  ))
    (  segid "    " and resid 100  and name HG1%)
       3.400     1.500     1.500 peak   277 spectrum    1 weight  0.10000E+01 volume  0.15368E-02 ppm1      8.716 ppm2      0.819 CV     1
  ASSI {  278}
    (( segid "    " and resid 101  and name HN  ))
    (( segid "    " and resid 101  and name HB2 ))
       3.600     1.600     1.600 peak   278 spectrum    1 weight  0.10000E+01 volume  0.39574E-03 ppm1      8.710 ppm2      3.135 CV     1
  ASSI {  279}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 52   and name HB2 ))
       3.200     1.200     1.200 peak   279 spectrum    1 weight  0.10000E+01 volume  0.15051E-02 ppm1      8.697 ppm2      2.713 CV     1
  ASSI {  280}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 73   and name HE  ))
       4.500     2.500     1.500 peak   280 spectrum    1 weight  0.10000E+01 volume  0.26924E-03 ppm1      8.702 ppm2      9.187 CV     1
  ASSI {  281}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 74   and name HN  ))
       3.400     1.500     1.500 peak   281 spectrum    1 weight  0.10000E+01 volume  0.52388E-03 ppm1      8.699 ppm2      7.501 CV     1
  ASSI {  282}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 77   and name HN  ))
       4.700     2.700     1.300 peak   282 spectrum    1 weight  0.10000E+01 volume  0.28658E-03 ppm1      8.699 ppm2      7.295 CV     1
  ASSI {  283}
    (( segid "    " and resid 75   and name HN  ))
    (  segid "    " and resid 52   and name HD% )
       3.600     1.700     1.700 peak   283 spectrum    1 weight  0.10000E+01 volume  0.58914E-03 ppm1      8.699 ppm2      7.104 CV     1
  ASSI {  284}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 75   and name HA  ))
       3.000     1.200     1.200 peak   284 spectrum    1 weight  0.10000E+01 volume  0.13577E-02 ppm1      8.700 ppm2      4.359 CV     1
  ASSI {  285}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 52   and name HB1 ))
       2.800     1.000     1.000 peak   285 spectrum    1 weight  0.10000E+01 volume  0.12103E-02 ppm1      8.700 ppm2      3.282 CV     1
  ASSI {  286}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 75   and name HB1 ))
       2.900     1.100     1.100 peak   286 spectrum    1 weight  0.10000E+01 volume  0.11847E-02 ppm1      8.700 ppm2      2.609 CV     1
  ASSI {  287}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 75   and name HB2 ))
       3.700     1.700     1.700 peak   287 spectrum    1 weight  0.10000E+01 volume  0.11492E-02 ppm1      8.701 ppm2      2.522 CV     1
  ASSI {  288}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 76   and name HB1 ))
       4.400     2.400     1.600 peak   288 spectrum    1 weight  0.10000E+01 volume  0.67964E-03 ppm1      8.699 ppm2      1.725 CV     1
  ASSI {  289}
    (( segid "    " and resid 75   and name HN  ))
    (  segid "    " and resid 71   and name HB% )
       5.200     3.400     0.800 peak   289 spectrum    1 weight  0.10000E+01 volume  0.29888E-03 ppm1      8.700 ppm2      1.514 CV     1
  ASSI {  290}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 73   and name HB1 ))
       4.800     2.800     1.200 peak   290 spectrum    1 weight  0.10000E+01 volume  0.50203E-03 ppm1      8.701 ppm2      1.253 CV     1
  ASSI {  291}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 73   and name HG1 ))
       2.900     1.100     1.100 peak   291 spectrum    1 weight  0.10000E+01 volume  0.91843E-03 ppm1      8.700 ppm2      1.115 CV     1
  ASSI {  292}
    (( segid "    " and resid 75   and name HN  ))
    (  segid "    " and resid 74   and name HB% )
       2.800     2.800     3.200 peak   292 spectrum    1 weight  0.10000E+01 volume  0.28712E-02 ppm1      8.699 ppm2      0.815 CV     1
  ASSI {  293}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 76   and name HN  ))
       2.600     0.800     0.800 peak   293 spectrum    1 weight  0.10000E+01 volume  0.22178E-02 ppm1      8.697 ppm2      6.706 CV     1
  ASSI {  294}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 76   and name HB2 ))
       4.500     2.500     1.500 peak   294 spectrum    1 weight  0.10000E+01 volume  0.70284E-03 ppm1      8.697 ppm2      1.791 CV     1
  ASSI {  295}
    (( segid "    " and resid 75   and name HN  ))
    (( segid "    " and resid 73   and name HB2 ))
       4.300     2.300     1.700 peak   295 spectrum    1 weight  0.10000E+01 volume  0.12787E-03 ppm1      8.697 ppm2      1.385 CV     1
  ASSI {  296}
    (( segid "    " and resid 28   and name HN  ))
    (( segid "    " and resid 29   and name HN  ))
       2.400     0.700     0.700 peak   296 spectrum    1 weight  0.10000E+01 volume  0.36114E-02 ppm1      8.667 ppm2      8.501 CV     1
  ASSI {  297}
    (( segid "    " and resid 28   and name HN  ))
    (( segid "    " and resid 27   and name HN  ))
       2.700     0.900     0.900 peak   297 spectrum    1 weight  0.10000E+01 volume  0.16296E-02 ppm1      8.667 ppm2      8.435 CV     1
  ASSI {  298}
    (( segid "    " and resid 28   and name HN  ))
    (( segid "    " and resid 31   and name HN  ))
       4.600     2.700     1.400 peak   298 spectrum    1 weight  0.10000E+01 volume  0.25743E-03 ppm1      8.669 ppm2      7.207 CV     1
  ASSI {  299}
    (( segid "    " and resid 28   and name HN  ))
    (( segid "    " and resid 27   and name HA  ))
       2.400     0.700     0.700 peak   299 spectrum    1 weight  0.10000E+01 volume  0.59255E-02 ppm1      8.667 ppm2      4.640 CV     1
  ASSI {  300}
    (( segid "    " and resid 28   and name HN  ))
    (( segid "    " and resid 28   and name HA1 ))
       2.100     2.100     3.900 peak   300 spectrum    1 weight  0.10000E+01 volume  0.57631E-02 ppm1      8.668 ppm2      3.924 CV     1
  ASSI {  301}
    (( segid "    " and resid 28   and name HN  ))
    (( segid "    " and resid 27   and name HB1 ))
       3.800     1.800     1.800 peak   301 spectrum    1 weight  0.10000E+01 volume  0.97169E-03 ppm1      8.669 ppm2      2.788 CV     1
  ASSI {  302}
    (( segid "    " and resid 28   and name HN  ))
    (  segid "    " and resid 25   and name HG1%)
       3.000     1.100     1.100 peak   302 spectrum    1 weight  0.10000E+01 volume  0.13883E-02 ppm1      8.668 ppm2      0.946 CV     1
  ASSI {  303}
    (( segid "    " and resid 28   and name HN  ))
    (( segid "    " and resid 26   and name HA  ))
       4.300     2.400     1.700 peak   303 spectrum    1 weight  0.10000E+01 volume  0.23465E-03 ppm1      8.664 ppm2      4.263 CV     1
  ASSI {  304}
    (( segid "    " and resid 61   and name HN  ))
    (( segid "    " and resid 62   and name HN  ))
       3.000     1.100     1.100 peak   304 spectrum    1 weight  0.10000E+01 volume  0.11594E-02 ppm1      8.654 ppm2      8.135 CV     1
  ASSI {  307}
    (( segid "    " and resid 61   and name HN  ))
    (( segid "    " and resid 61   and name HB  ))
       2.900     1.100     1.100 peak   307 spectrum    1 weight  0.10000E+01 volume  0.13884E-02 ppm1      8.653 ppm2      4.456 CV     1
  ASSI {  308}
    (( segid "    " and resid 61   and name HN  ))
    (( segid "    " and resid 61   and name HA  ))
       2.600     0.800     0.800 peak   308 spectrum    1 weight  0.10000E+01 volume  0.36117E-02 ppm1      8.653 ppm2      3.991 CV     1
  ASSI {  309}
    (( segid "    " and resid 61   and name HN  ))
    (( segid "    " and resid 60   and name HA2 ))
       3.600     1.600     1.600 peak   309 spectrum    1 weight  0.10000E+01 volume  0.14013E-02 ppm1      8.650 ppm2      3.881 CV     1
  ASSI {  310}
    (( segid "    " and resid 61   and name HN  ))
    (( segid "    " and resid 62   and name HB1 ))
       4.900     3.000     1.100 peak   310 spectrum    1 weight  0.10000E+01 volume  0.26383E-03 ppm1      8.650 ppm2      3.086 CV     1
  ASSI {  311}
    (( segid "    " and resid 61   and name HN  ))
    (  segid "    " and resid 64   and name HB% )
       5.100     3.200     0.900 peak   311 spectrum    1 weight  0.10000E+01 volume  0.22886E-03 ppm1      8.652 ppm2      1.492 CV     1
  ASSI {  312}
    (( segid "    " and resid 61   and name HN  ))
    (  segid "    " and resid 61   and name HG2%)
       4.000     2.000     2.000 peak   312 spectrum    1 weight  0.10000E+01 volume  0.10653E-02 ppm1      8.652 ppm2      1.413 CV     1
  ASSI {  313}
    (( segid "    " and resid 19   and name HN  ))
    (( segid "    " and resid 20   and name HN  ))
       2.600     0.900     0.900 peak   313 spectrum    1 weight  0.10000E+01 volume  0.31108E-02 ppm1      8.650 ppm2      7.979 CV     1
  ASSI {  314}
    (( segid "    " and resid 19   and name HN  ))
    (( segid "    " and resid 18   and name HA  ))
       2.000     0.500     0.500 peak   314 spectrum    1 weight  0.10000E+01 volume  0.17253E-01 ppm1      8.650 ppm2      4.443 CV     1
  ASSI {  315}
    (( segid "    " and resid 19   and name HN  ))
    (( segid "    " and resid 19   and name HA2 ))
       2.100     2.100     3.900 peak   315 spectrum    1 weight  0.10000E+01 volume  0.16406E-01 ppm1      8.649 ppm2      4.020 CV     1
  ASSI {  316}
    (( segid "    " and resid 19   and name HN  ))
    (( segid "    " and resid 18   and name HD1 ))
       4.200     2.200     1.800 peak   316 spectrum    1 weight  0.10000E+01 volume  0.92545E-04 ppm1      8.653 ppm2      3.659 CV     1
  ASSI {  317}
    (( segid "    " and resid 19   and name HN  ))
    (( segid "    " and resid 18   and name HB2 ))
       3.000     1.100     1.100 peak   317 spectrum    1 weight  0.10000E+01 volume  0.17010E-02 ppm1      8.649 ppm2      2.317 CV     1
  ASSI {  318}
    (( segid "    " and resid 19   and name HN  ))
    (( segid "    " and resid 18   and name HG2 ))
       4.600     2.700     1.400 peak   318 spectrum    1 weight  0.10000E+01 volume  0.57615E-03 ppm1      8.650 ppm2      2.054 CV     1
  ASSI {  319}
    (( segid "    " and resid 19   and name HN  ))
    (( segid "    " and resid 18   and name HB1 ))
       3.100     1.200     1.200 peak   319 spectrum    1 weight  0.10000E+01 volume  0.17635E-02 ppm1      8.649 ppm2      1.954 CV     1
  ASSI {  321}
    (( segid "    " and resid 95   and name HN  ))
    (( segid "    " and resid 97   and name HN  ))
       4.500     2.600     1.500 peak   321 spectrum    1 weight  0.10000E+01 volume  0.32384E-03 ppm1      8.627 ppm2      7.609 CV     1
  ASSI {  322}
    (( segid "    " and resid 95   and name HN  ))
    (( segid "    " and resid 98   and name HN  ))
       4.800     2.900     1.200 peak   322 spectrum    1 weight  0.10000E+01 volume  0.33649E-03 ppm1      8.628 ppm2      7.870 CV     1
  ASSI {  323}
    (( segid "    " and resid 95   and name HN  ))
    (( segid "    " and resid 95   and name HD1 ))
       3.000     1.100     1.100 peak   323 spectrum    1 weight  0.10000E+01 volume  0.16516E-02 ppm1      8.628 ppm2      7.180 CV     1
  ASSI {  325}
    (( segid "    " and resid 95   and name HN  ))
    (( segid "    " and resid 96   and name HN  ))
       2.900     1.100     1.100 peak   325 spectrum    1 weight  0.10000E+01 volume  0.14229E-02 ppm1      8.624 ppm2      8.441 CV     1
  ASSI {  326}
    (( segid "    " and resid 95   and name HN  ))
    (( segid "    " and resid 95   and name HA  ))
       2.900     1.000     1.000 peak   326 spectrum    1 weight  0.10000E+01 volume  0.11912E-02 ppm1      8.626 ppm2      4.998 CV     1
  ASSI {  327}
    (( segid "    " and resid 95   and name HN  ))
    (( segid "    " and resid 94   and name HA2 ))
       2.500     0.800     0.800 peak   327 spectrum    1 weight  0.10000E+01 volume  0.41687E-02 ppm1      8.624 ppm2      4.285 CV     1
  ASSI {  328}
    (( segid "    " and resid 95   and name HN  ))
    (( segid "    " and resid 94   and name HA1 ))
       2.800     1.000     1.000 peak   328 spectrum    1 weight  0.10000E+01 volume  0.34925E-02 ppm1      8.623 ppm2      3.816 CV     1
  ASSI {  329}
    (( segid "    " and resid 95   and name HN  ))
    (( segid "    " and resid 95   and name HB2 ))
       2.900     1.100     1.100 peak   329 spectrum    1 weight  0.10000E+01 volume  0.21085E-02 ppm1      8.624 ppm2      3.552 CV     1
  ASSI {  330}
    (( segid "    " and resid 95   and name HN  ))
    (( segid "    " and resid 95   and name HB1 ))
       3.200     1.300     1.300 peak   330 spectrum    1 weight  0.10000E+01 volume  0.23100E-02 ppm1      8.625 ppm2      2.953 CV     1
  ASSI {  331}
    (( segid "    " and resid 82   and name HN  ))
    (( segid "    " and resid 81   and name HN  ))
       2.900     1.000     1.000 peak   331 spectrum    1 weight  0.10000E+01 volume  0.14470E-02 ppm1      8.627 ppm2      7.563 CV     1
  ASSI {  332}
    (( segid "    " and resid 82   and name HN  ))
    (( segid "    " and resid 82   and name HG1 ))
       3.300     1.400     1.400 peak   332 spectrum    1 weight  0.10000E+01 volume  0.73498E-03 ppm1      8.625 ppm2      2.524 CV     1
  ASSI {  333}
    (( segid "    " and resid 82   and name HN  ))
    (( segid "    " and resid 82   and name HB1 ))
       3.300     1.300     1.300 peak   333 spectrum    1 weight  0.10000E+01 volume  0.18544E-02 ppm1      8.626 ppm2      2.296 CV     1
  ASSI {  334}
    (( segid "    " and resid 82   and name HN  ))
    (( segid "    " and resid 83   and name HN  ))
       2.900     1.100     1.100 peak   334 spectrum    1 weight  0.10000E+01 volume  0.13400E-02 ppm1      8.620 ppm2      8.390 CV     1
  ASSI {  335}
    (( segid "    " and resid 82   and name HN  ))
    (( segid "    " and resid 81   and name HB1 ))
       2.900     1.100     1.100 peak   335 spectrum    1 weight  0.10000E+01 volume  0.19723E-02 ppm1      8.621 ppm2      1.814 CV     1
  ASSI {  336}
    (( segid "    " and resid 82   and name HN  ))
    (( segid "    " and resid 82   and name HG2 ))
       3.400     1.400     1.400 peak   336 spectrum    1 weight  0.10000E+01 volume  0.11010E-02 ppm1      8.626 ppm2      2.759 CV     1
  ASSI {  338}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 69   and name HN  ))
       3.400     1.500     1.500 peak   338 spectrum    1 weight  0.10000E+01 volume  0.13935E-02 ppm1      8.620 ppm2      7.104 CV     1
  ASSI {  339}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 70   and name HB1 ))
       3.600     1.700     1.700 peak   339 spectrum    1 weight  0.10000E+01 volume  0.15716E-02 ppm1      8.616 ppm2      3.211 CV     1
  ASSI {  341}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 62   and name HZ2 ))
       2.800     1.000     1.000 peak   341 spectrum    1 weight  0.10000E+01 volume  0.25466E-02 ppm1      8.623 ppm2      7.179 CV     1
  ASSI {  342}
    (( segid "    " and resid 71   and name HN  ))
    (  segid "    " and resid 70   and name HD% )
       3.600     3.600     2.400 peak   342 spectrum    1 weight  0.10000E+01 volume  0.18577E-02 ppm1      8.623 ppm2      6.890 CV     1
  ASSI {  344}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 71   and name HA  ))
       3.000     1.100     1.100 peak   344 spectrum    1 weight  0.10000E+01 volume  0.10995E-02 ppm1      8.624 ppm2      4.828 CV     1
  ASSI {  345}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 70   and name HA  ))
       3.300     1.400     1.400 peak   345 spectrum    1 weight  0.10000E+01 volume  0.13319E-02 ppm1      8.624 ppm2      4.752 CV     1
  ASSI {  346}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 68   and name HA  ))
       2.400     0.700     0.700 peak   346 spectrum    1 weight  0.10000E+01 volume  0.34472E-02 ppm1      8.622 ppm2      4.314 CV     1
  ASSI {  347}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 72   and name HD1 ))
       3.900     1.900     1.900 peak   347 spectrum    1 weight  0.10000E+01 volume  0.56595E-03 ppm1      8.624 ppm2      3.548 CV     1
  ASSI {  348}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 70   and name HB2 ))
       2.600     0.800     0.800 peak   348 spectrum    1 weight  0.10000E+01 volume  0.26535E-02 ppm1      8.623 ppm2      2.918 CV     1
  ASSI {  349}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 72   and name HB1 ))
       6.000     6.000     0.000 peak   349 spectrum    1 weight  0.10000E+01 volume  0.19282E-05 ppm1      8.622 ppm2      1.687 CV     1
  ASSI {  350}
    (( segid "    " and resid 71   and name HN  ))
    (  segid "    " and resid 71   and name HB% )
       2.600     2.600     3.400 peak   350 spectrum    1 weight  0.10000E+01 volume  0.38268E-02 ppm1      8.622 ppm2      1.516 CV     1
  ASSI {  351}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 69   and name HB2 ))
       3.100     3.100     2.900 peak   351 spectrum    1 weight  0.10000E+01 volume  0.57302E-03 ppm1      8.623 ppm2      1.320 CV     1
  ASSI {  352}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 69   and name HG1 ))
       4.000     2.000     2.000 peak   352 spectrum    1 weight  0.10000E+01 volume  0.15355E-02 ppm1      8.624 ppm2      1.003 CV     1
  ASSI {  354}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 70   and name HN  ))
       2.200     0.600     0.600 peak   354 spectrum    1 weight  0.10000E+01 volume  0.56441E-02 ppm1      8.622 ppm2      7.762 CV     1
  ASSI {  355}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 73   and name HN  ))
       4.200     2.200     1.800 peak   355 spectrum    1 weight  0.10000E+01 volume  0.26340E-03 ppm1      8.620 ppm2      6.738 CV     1
  ASSI {  356}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 72   and name HD2 ))
       4.500     2.600     1.500 peak   356 spectrum    1 weight  0.10000E+01 volume  0.43638E-03 ppm1      8.619 ppm2      3.908 CV     1
  ASSI {  357}
    (( segid "    " and resid 71   and name HN  ))
    (( segid "    " and resid 69   and name HA  ))
       3.900     1.900     1.900 peak   357 spectrum    1 weight  0.10000E+01 volume  0.45458E-03 ppm1      8.621 ppm2      3.780 CV     1
  ASSI {  358}
    (( segid "    " and resid 26   and name HN  ))
    (( segid "    " and resid 27   and name HN  ))
       3.400     1.500     1.500 peak   358 spectrum    1 weight  0.10000E+01 volume  0.53546E-03 ppm1      8.612 ppm2      8.419 CV     1
  ASSI {  359}
    (( segid "    " and resid 26   and name HN  ))
    (( segid "    " and resid 25   and name HN  ))
       3.700     1.700     1.700 peak   359 spectrum    1 weight  0.10000E+01 volume  0.11904E-02 ppm1      8.612 ppm2      8.255 CV     1
  ASSI {  360}
    (( segid "    " and resid 26   and name HN  ))
    (( segid "    " and resid 26   and name HA  ))
       2.800     1.000     1.000 peak   360 spectrum    1 weight  0.10000E+01 volume  0.21043E-02 ppm1      8.609 ppm2      4.260 CV     1
  ASSI {  361}
    (( segid "    " and resid 26   and name HN  ))
    (( segid "    " and resid 25   and name HA  ))
       2.100     0.600     0.600 peak   361 spectrum    1 weight  0.10000E+01 volume  0.95529E-02 ppm1      8.610 ppm2      4.070 CV     1
  ASSI {  362}
    (( segid "    " and resid 26   and name HN  ))
    (( segid "    " and resid 26   and name HB  ))
       2.400     0.700     0.700 peak   362 spectrum    1 weight  0.10000E+01 volume  0.44892E-02 ppm1      8.611 ppm2      1.965 CV     1
  ASSI {  363}
    (( segid "    " and resid 26   and name HN  ))
    (  segid "    " and resid 25   and name HG1%)
       2.700     0.900     0.900 peak   363 spectrum    1 weight  0.10000E+01 volume  0.32538E-02 ppm1      8.611 ppm2      0.947 CV     1
  ASSI {  364}
    (( segid "    " and resid 26   and name HN  ))
    (  segid "    " and resid 26   and name HD1%)
       3.000     1.100     1.100 peak   364 spectrum    1 weight  0.10000E+01 volume  0.20107E-02 ppm1      8.611 ppm2      0.830 CV     1
  ASSI {  365}
    (( segid "    " and resid 26   and name HN  ))
    (( segid "    " and resid 26   and name HG12))
       2.900     1.100     1.100 peak   365 spectrum    1 weight  0.10000E+01 volume  0.13574E-02 ppm1      8.609 ppm2      1.444 CV     1
  ASSI {  366}
    (( segid "    " and resid 43   and name HN  ))
    (( segid "    " and resid 45   and name HN  ))
       6.000     4.700     0.000 peak   366 spectrum    1 weight  0.10000E+01 volume  0.56117E-04 ppm1      8.580 ppm2      6.813 CV     1
  ASSI {  367}
    (( segid "    " and resid 21   and name HN  ))
    (( segid "    " and resid 22   and name HN  ))
       3.400     1.500     1.500 peak   367 spectrum    1 weight  0.10000E+01 volume  0.21375E-02 ppm1      8.610 ppm2      8.296 CV     1
  ASSI {  369}
    (( segid "    " and resid 21   and name HN  ))
    (( segid "    " and resid 21   and name HA  ))
       2.000     2.000     4.000 peak   369 spectrum    1 weight  0.10000E+01 volume  0.18069E-01 ppm1      8.606 ppm2      4.351 CV     1
  ASSI {  370}
    (( segid "    " and resid 21   and name HN  ))
    (( segid "    " and resid 20   and name HB  ))
       2.800     1.000     1.000 peak   370 spectrum    1 weight  0.10000E+01 volume  0.25047E-02 ppm1      8.604 ppm2      4.238 CV     1
  ASSI {  371}
    (( segid "    " and resid 21   and name HN  ))
    (( segid "    " and resid 21   and name HG2 ))
       2.700     0.900     0.900 peak   371 spectrum    1 weight  0.10000E+01 volume  0.37053E-02 ppm1      8.605 ppm2      2.270 CV     1
  ASSI {  372}
    (( segid "    " and resid 21   and name HN  ))
    (( segid "    " and resid 21   and name HB2 ))
       2.400     0.700     0.700 peak   372 spectrum    1 weight  0.10000E+01 volume  0.79931E-02 ppm1      8.605 ppm2      2.026 CV     1
  ASSI {  373}
    (( segid "    " and resid 21   and name HN  ))
    (( segid "    " and resid 21   and name HB1 ))
       2.500     2.500     3.500 peak   373 spectrum    1 weight  0.10000E+01 volume  0.81192E-02 ppm1      8.606 ppm2      1.945 CV     1
  ASSI {  374}
    (( segid "    " and resid 21   and name HN  ))
    (  segid "    " and resid 20   and name HG2%)
       3.300     1.400     1.400 peak   374 spectrum    1 weight  0.10000E+01 volume  0.24220E-02 ppm1      8.606 ppm2      1.191 CV     1
  ASSI {  376}
    (( segid "    " and resid 21   and name HN  ))
    (( segid "    " and resid 19   and name HA2 ))
       3.600     1.600     1.600 peak   376 spectrum    1 weight  0.10000E+01 volume  0.64333E-03 ppm1      8.602 ppm2      4.016 CV     1
  ASSI {  377}
    (( segid "    " and resid 43   and name HN  ))
    (( segid "    " and resid 43   and name HD1 ))
       2.600     0.800     0.800 peak   377 spectrum    1 weight  0.10000E+01 volume  0.23440E-02 ppm1      8.571 ppm2      7.482 CV     1
  ASSI {  378}
    (( segid "    " and resid 43   and name HN  ))
    (( segid "    " and resid 42   and name HA  ))
       2.300     0.700     0.700 peak   378 spectrum    1 weight  0.10000E+01 volume  0.48144E-02 ppm1      8.571 ppm2      4.873 CV     1
  ASSI {  379}
    (( segid "    " and resid 43   and name HN  ))
    (( segid "    " and resid 43   and name HB2 ))
       2.900     1.000     1.000 peak   379 spectrum    1 weight  0.10000E+01 volume  0.13100E-02 ppm1      8.573 ppm2      3.527 CV     1
  ASSI {  380}
    (( segid "    " and resid 43   and name HN  ))
    (( segid "    " and resid 42   and name HB2 ))
       3.700     1.700     1.700 peak   380 spectrum    1 weight  0.10000E+01 volume  0.13591E-02 ppm1      8.572 ppm2      3.205 CV     1
  ASSI {  381}
    (( segid "    " and resid 43   and name HN  ))
    (( segid "    " and resid 43   and name HB1 ))
       3.300     1.400     1.400 peak   381 spectrum    1 weight  0.10000E+01 volume  0.26340E-02 ppm1      8.571 ppm2      3.112 CV     1
  ASSI {  382}
    (( segid "    " and resid 43   and name HN  ))
    (( segid "    " and resid 42   and name HD22))
       4.500     2.600     1.500 peak   382 spectrum    1 weight  0.10000E+01 volume  0.66730E-03 ppm1      8.570 ppm2      7.081 CV     1
  ASSI {  383}
    (( segid "    " and resid 43   and name HN  ))
    (( segid "    " and resid 43   and name HA  ))
       3.200     1.300     1.300 peak   383 spectrum    1 weight  0.10000E+01 volume  0.64624E-03 ppm1      8.570 ppm2      3.837 CV     1
  ASSI {  384}
    (( segid "    " and resid 43   and name HN  ))
    (( segid "    " and resid 42   and name HB1 ))
       4.100     2.100     1.900 peak   384 spectrum    1 weight  0.10000E+01 volume  0.40515E-03 ppm1      8.568 ppm2      2.746 CV     1
  ASSI {  385}
    (( segid "    " and resid 43   and name HN  ))
    (  segid "    " and resid 44   and name HB% )
       4.200     2.200     1.800 peak   385 spectrum    1 weight  0.10000E+01 volume  0.52412E-03 ppm1      8.570 ppm2      1.514 CV     1
  ASSI {  386}
    (( segid "    " and resid 64   and name HN  ))
    (( segid "    " and resid 65   and name HN  ))
       2.700     0.900     0.900 peak   386 spectrum    1 weight  0.10000E+01 volume  0.25299E-02 ppm1      8.587 ppm2      7.119 CV     1
  ASSI {  387}
    (( segid "    " and resid 64   and name HN  ))
    (( segid "    " and resid 65   and name HB1 ))
       6.000     6.000     0.000 peak   387 spectrum    1 weight  0.10000E+01 volume  0.58437E-05 ppm1      8.590 ppm2      2.299 CV     1
  ASSI {  388}
    (( segid "    " and resid 64   and name HN  ))
    (( segid "    " and resid 62   and name HN  ))
       6.000     5.600     0.000 peak   388 spectrum    1 weight  0.10000E+01 volume  0.16614E-04 ppm1      8.585 ppm2      8.134 CV     1
  ASSI {  389}
    (( segid "    " and resid 64   and name HN  ))
    (( segid "    " and resid 61   and name HA  ))
       3.000     1.100     1.100 peak   389 spectrum    1 weight  0.10000E+01 volume  0.19093E-02 ppm1      8.584 ppm2      3.990 CV     1
  ASSI {  390}
    (( segid "    " and resid 64   and name HN  ))
    (( segid "    " and resid 63   and name HA  ))
       3.300     1.400     1.400 peak   390 spectrum    1 weight  0.10000E+01 volume  0.89842E-03 ppm1      8.584 ppm2      3.694 CV     1
  ASSI {  391}
    (( segid "    " and resid 64   and name HN  ))
    (( segid "    " and resid 63   and name HB1 ))
       2.500     0.800     0.800 peak   391 spectrum    1 weight  0.10000E+01 volume  0.32574E-02 ppm1      8.584 ppm2      2.083 CV     1
  ASSI {  392}
    (( segid "    " and resid 64   and name HN  ))
    (  segid "    " and resid 64   and name HB% )
       2.200     0.600     0.600 peak   392 spectrum    1 weight  0.10000E+01 volume  0.90417E-02 ppm1      8.585 ppm2      1.487 CV     1
  ASSI {  393}
    (( segid "    " and resid 64   and name HN  ))
    (( segid "    " and resid 63   and name HN  ))
       2.700     0.900     0.900 peak   393 spectrum    1 weight  0.10000E+01 volume  0.19965E-02 ppm1      8.582 ppm2      8.404 CV     1
  ASSI {  394}
    (( segid "    " and resid 64   and name HN  ))
    (( segid "    " and resid 64   and name HA  ))
       2.700     0.900     0.900 peak   394 spectrum    1 weight  0.10000E+01 volume  0.36062E-02 ppm1      8.583 ppm2      4.130 CV     1
  ASSI {  395}
    (( segid "    " and resid 64   and name HN  ))
    (( segid "    " and resid 62   and name HB1 ))
       4.600     2.700     1.400 peak   395 spectrum    1 weight  0.10000E+01 volume  0.37539E-03 ppm1      8.583 ppm2      3.072 CV     1
  ASSI {  397}
    (( segid "    " and resid 64   and name HN  ))
    (( segid "    " and resid 65   and name HD21))
       4.700     2.800     1.300 peak   397 spectrum    1 weight  0.10000E+01 volume  0.25042E-03 ppm1      8.574 ppm2      7.697 CV     1
  ASSI {  398}
    (( segid "    " and resid 48   and name HN  ))
    (( segid "    " and resid 47   and name HN  ))
       2.700     0.900     0.900 peak   398 spectrum    1 weight  0.10000E+01 volume  0.20213E-02 ppm1      8.591 ppm2      9.046 CV     1
  ASSI {  399}
    (( segid "    " and resid 48   and name HN  ))
    (  segid "    " and resid 47   and name HG2%)
       4.400     2.400     1.600 peak   399 spectrum    1 weight  0.10000E+01 volume  0.60088E-03 ppm1      8.594 ppm2      1.235 CV     1
  ASSI {  400}
    (( segid "    " and resid 48   and name HN  ))
    (( segid "    " and resid 48   and name HA2 ))
       2.400     0.700     0.700 peak   400 spectrum    1 weight  0.10000E+01 volume  0.48109E-02 ppm1      8.589 ppm2      4.232 CV     1
  ASSI {  402}
    (( segid "    " and resid 48   and name HN  ))
    (( segid "    " and resid 50   and name HN  ))
       4.000     2.000     2.000 peak   402 spectrum    1 weight  0.10000E+01 volume  0.58805E-03 ppm1      8.593 ppm2      8.215 CV     1
  ASSI {  404}
    (( segid "    " and resid 48   and name HN  ))
    (( segid "    " and resid 49   and name HA  ))
       6.000     6.000     0.000 peak   404 spectrum    1 weight  0.10000E+01 volume  0.51207E-04 ppm1      8.596 ppm2      4.622 CV     1
  ASSI {  405}
    (( segid "    " and resid 48   and name HN  ))
    (( segid "    " and resid 47   and name HA  ))
       3.200     1.300     1.300 peak   405 spectrum    1 weight  0.10000E+01 volume  0.12624E-02 ppm1      8.590 ppm2      4.380 CV     1
  ASSI {  406}
    (( segid "    " and resid 48   and name HN  ))
    (( segid "    " and resid 48   and name HA1 ))
       2.700     0.900     0.900 peak   406 spectrum    1 weight  0.10000E+01 volume  0.52623E-02 ppm1      8.590 ppm2      3.930 CV     1
  ASSI {  407}
    (( segid "    " and resid 48   and name HN  ))
    (( segid "    " and resid 46   and name HA  ))
       3.500     1.600     1.600 peak   407 spectrum    1 weight  0.10000E+01 volume  0.82246E-03 ppm1      8.588 ppm2      4.763 CV     1
  ASSI {  408}
    (( segid "    " and resid 48   and name HN  ))
    (( segid "    " and resid 47   and name HB  ))
       6.000     5.100     0.000 peak   408 spectrum    1 weight  0.10000E+01 volume  0.28879E-04 ppm1      8.588 ppm2      4.523 CV     1
  ASSI {  409}
    (( segid "    " and resid 55   and name HN  ))
    (( segid "    " and resid 55   and name HB  ))
       4.000     2.000     2.000 peak   409 spectrum    1 weight  0.10000E+01 volume  0.26883E-03 ppm1      8.588 ppm2      2.212 CV     1
  ASSI {  410}
    (( segid "    " and resid 55   and name HN  ))
    (  segid "    " and resid 35   and name HB% )
       4.000     2.000     2.000 peak   410 spectrum    1 weight  0.10000E+01 volume  0.36203E-03 ppm1      8.575 ppm2      0.490 CV     1
  ASSI {  411}
    (( segid "    " and resid 55   and name HN  ))
    (( segid "    " and resid 56   and name HN  ))
       2.900     1.000     1.000 peak   411 spectrum    1 weight  0.10000E+01 volume  0.12133E-02 ppm1      8.586 ppm2      7.732 CV     1
  ASSI {  412}
    (( segid "    " and resid 55   and name HN  ))
    (( segid "    " and resid 55   and name HA  ))
       3.700     1.700     1.700 peak   412 spectrum    1 weight  0.10000E+01 volume  0.39019E-03 ppm1      8.584 ppm2      4.285 CV     1
  ASSI {  413}
    (( segid "    " and resid 55   and name HN  ))
    (  segid "    " and resid 55   and name HG1%)
       3.300     1.400     1.400 peak   413 spectrum    1 weight  0.10000E+01 volume  0.28014E-02 ppm1      8.582 ppm2      0.636 CV     1
  ASSI {  414}
    (( segid "    " and resid 15   and name HN  ))
    (( segid "    " and resid 14   and name HN  ))
       3.800     1.800     1.800 peak   414 spectrum    1 weight  0.10000E+01 volume  0.10083E-02 ppm1      8.564 ppm2      8.286 CV     1
  ASSI {  415}
    (( segid "    " and resid 15   and name HN  ))
    (( segid "    " and resid 16   and name HN  ))
       2.800     1.000     1.000 peak   415 spectrum    1 weight  0.10000E+01 volume  0.22110E-02 ppm1      8.562 ppm2      8.058 CV     1
  ASSI {  416}
    (( segid "    " and resid 15   and name HN  ))
    (( segid "    " and resid 14   and name HA  ))
       2.000     0.500     0.500 peak   416 spectrum    1 weight  0.10000E+01 volume  0.14526E-01 ppm1      8.561 ppm2      4.118 CV     1
  ASSI {  417}
    (( segid "    " and resid 15   and name HN  ))
    (( segid "    " and resid 15   and name HA2 ))
       2.100     0.600     0.600 peak   417 spectrum    1 weight  0.10000E+01 volume  0.12097E-01 ppm1      8.561 ppm2      4.006 CV     1
  ASSI {  418}
    (( segid "    " and resid 15   and name HN  ))
    (( segid "    " and resid 14   and name HB  ))
       3.000     1.200     1.200 peak   418 spectrum    1 weight  0.10000E+01 volume  0.23140E-02 ppm1      8.560 ppm2      2.063 CV     1
  ASSI {  420}
    (( segid "    " and resid 15   and name HN  ))
    (  segid "    " and resid 14   and name HG1%)
       2.700     0.900     0.900 peak   420 spectrum    1 weight  0.10000E+01 volume  0.30120E-02 ppm1      8.561 ppm2      0.948 CV     1
  ASSI {  421}
    (( segid "    " and resid 15   and name HN  ))
    (( segid "    " and resid 16   and name HA  ))
       5.200     3.400     0.800 peak   421 spectrum    1 weight  0.10000E+01 volume  0.98205E-04 ppm1      8.557 ppm2      4.323 CV     1
  ASSI {  422}
    (( segid "    " and resid 34   and name HN  ))
    (( segid "    " and resid 34   and name HG11))
       2.600     0.800     0.800 peak   422 spectrum    1 weight  0.10000E+01 volume  0.22990E-02 ppm1      8.520 ppm2      1.518 CV     1
  ASSI {  424}
    (( segid "    " and resid 34   and name HN  ))
    (( segid "    " and resid 31   and name HN  ))
       4.800     2.900     1.200 peak   424 spectrum    1 weight  0.10000E+01 volume  0.13313E-03 ppm1      8.520 ppm2      7.216 CV     1
  ASSI {  425}
    (( segid "    " and resid 34   and name HN  ))
    (( segid "    " and resid 32   and name HA  ))
       6.000     5.400     0.000 peak   425 spectrum    1 weight  0.10000E+01 volume  0.14447E-04 ppm1      8.516 ppm2      4.821 CV     1
  ASSI {  426}
    (( segid "    " and resid 34   and name HN  ))
    (  segid "    " and resid 34   and name HD1%)
       3.400     1.400     1.400 peak   426 spectrum    1 weight  0.10000E+01 volume  0.21229E-02 ppm1      8.519 ppm2      0.504 CV     1
  ASSI {  427}
    (( segid "    " and resid 34   and name HN  ))
    (  segid "    " and resid 34   and name HG2%)
       4.200     2.200     1.800 peak   427 spectrum    1 weight  0.10000E+01 volume  0.74386E-03 ppm1      8.516 ppm2      0.211 CV     1
  ASSI {  428}
    (( segid "    " and resid 34   and name HN  ))
    (( segid "    " and resid 34   and name HB  ))
       2.800     1.000     1.000 peak   428 spectrum    1 weight  0.10000E+01 volume  0.14672E-02 ppm1      8.527 ppm2      1.912 CV     1
  ASSI {  430}
    (( segid "    " and resid 34   and name HN  ))
    (( segid "    " and resid 33   and name HA  ))
       3.900     1.900     1.900 peak   430 spectrum    1 weight  0.10000E+01 volume  0.44723E-03 ppm1      8.524 ppm2      4.259 CV     1
  ASSI {  431}
    (( segid "    " and resid 34   and name HN  ))
    (  segid "    " and resid 105  and name HB% )
       4.100     2.100     1.900 peak   431 spectrum    1 weight  0.10000E+01 volume  0.21953E-03 ppm1      8.522 ppm2      1.196 CV     1
  ASSI {  432}
    (( segid "    " and resid 34   and name HN  ))
    (( segid "    " and resid 34   and name HA  ))
       3.400     1.400     1.400 peak   432 spectrum    1 weight  0.10000E+01 volume  0.61377E-03 ppm1      8.518 ppm2      3.394 CV     1
  ASSI {  433}
    (( segid "    " and resid 29   and name HN  ))
    (  segid "    " and resid 25   and name HG2%)
       4.900     3.000     1.100 peak   433 spectrum    1 weight  0.10000E+01 volume  0.24101E-03 ppm1      8.507 ppm2      0.950 CV     1
  OR {  433}
    (( segid "    " and resid 29   and name HN  ))
    (  segid "    " and resid 25   and name HG1%)
  ASSI {  435}
    (( segid "    " and resid 29   and name HN  ))
    (( segid "    " and resid 30   and name HN  ))
       2.600     0.800     0.800 peak   435 spectrum    1 weight  0.10000E+01 volume  0.21141E-02 ppm1      8.502 ppm2      8.027 CV     1
  ASSI {  436}
    (( segid "    " and resid 29   and name HN  ))
    (( segid "    " and resid 27   and name HA  ))
       3.400     1.400     1.400 peak   436 spectrum    1 weight  0.10000E+01 volume  0.75609E-03 ppm1      8.504 ppm2      4.636 CV     1
  ASSI {  437}
    (( segid "    " and resid 29   and name HN  ))
    (( segid "    " and resid 29   and name HA  ))
       2.600     0.800     0.800 peak   437 spectrum    1 weight  0.10000E+01 volume  0.38185E-02 ppm1      8.503 ppm2      4.422 CV     1
  ASSI {  438}
    (( segid "    " and resid 29   and name HN  ))
    (( segid "    " and resid 29   and name HB1 ))
       2.700     0.900     0.900 peak   438 spectrum    1 weight  0.10000E+01 volume  0.10475E-01 ppm1      8.502 ppm2      3.990 CV     1
  ASSI {  439}
    (( segid "    " and resid 29   and name HN  ))
    (( segid "    " and resid 27   and name HB1 ))
       3.400     1.400     1.400 peak   439 spectrum    1 weight  0.10000E+01 volume  0.20159E-02 ppm1      8.503 ppm2      2.793 CV     1
  ASSI {  440}
    (( segid "    " and resid 29   and name HN  ))
    (( segid "    " and resid 30   and name HB  ))
       5.400     3.700     0.600 peak   440 spectrum    1 weight  0.10000E+01 volume  0.20134E-03 ppm1      8.504 ppm2      1.635 CV     1
  ASSI {  442}
    (( segid "    " and resid 29   and name HN  ))
    (( segid "    " and resid 31   and name HN  ))
       4.000     2.000     2.000 peak   442 spectrum    1 weight  0.10000E+01 volume  0.38987E-03 ppm1      8.500 ppm2      7.202 CV     1
  ASSI {  443}
    (( segid "    " and resid 29   and name HN  ))
    (( segid "    " and resid 27   and name HN  ))
       4.700     2.800     1.300 peak   443 spectrum    1 weight  0.10000E+01 volume  0.35908E-03 ppm1      8.506 ppm2      8.419 CV     1
  ASSI {  444}
    (( segid "    " and resid 29   and name HN  ))
    (( segid "    " and resid 30   and name HG11))
       6.000     4.900     0.000 peak   444 spectrum    1 weight  0.10000E+01 volume  0.10668E-03 ppm1      8.501 ppm2      0.835 CV     1
  ASSI {  445}
    (( segid "    " and resid 54   and name HN  ))
    (( segid "    " and resid 43   and name HB2 ))
       6.000     5.800     0.000 peak   445 spectrum    1 weight  0.10000E+01 volume  0.89485E-04 ppm1      8.508 ppm2      3.513 CV     1
  ASSI {  446}
    (( segid "    " and resid 54   and name HN  ))
    (( segid "    " and resid 56   and name HN  ))
       3.200     1.300     1.300 peak   446 spectrum    1 weight  0.10000E+01 volume  0.10096E-02 ppm1      8.504 ppm2      7.717 CV     1
  ASSI {  447}
    (( segid "    " and resid 54   and name HN  ))
    (( segid "    " and resid 53   and name HA1 ))
       4.200     2.200     1.800 peak   447 spectrum    1 weight  0.10000E+01 volume  0.20353E-03 ppm1      8.502 ppm2      4.125 CV     1
  ASSI {  448}
    (( segid "    " and resid 54   and name HN  ))
    (( segid "    " and resid 43   and name HA  ))
       2.800     1.000     1.000 peak   448 spectrum    1 weight  0.10000E+01 volume  0.11532E-02 ppm1      8.504 ppm2      3.848 CV     1
  ASSI {  449}
    (( segid "    " and resid 54   and name HN  ))
    (( segid "    " and resid 42   and name HB2 ))
       2.800     2.800     3.200 peak   449 spectrum    1 weight  0.10000E+01 volume  0.10835E-02 ppm1      8.504 ppm2      3.207 CV     1
  ASSI {  450}
    (( segid "    " and resid 54   and name HN  ))
    (  segid "    " and resid 39   and name HB% )
       3.900     1.900     1.900 peak   450 spectrum    1 weight  0.10000E+01 volume  0.27648E-03 ppm1      8.505 ppm2      1.345 CV     1
  ASSI {  452}
    (( segid "    " and resid 54   and name HN  ))
    (( segid "    " and resid 53   and name HA2 ))
       3.100     1.200     1.200 peak   452 spectrum    1 weight  0.10000E+01 volume  0.63297E-03 ppm1      8.499 ppm2      4.016 CV     1
  ASSI {  453}
    (( segid "    " and resid 54   and name HN  ))
    (( segid "    " and resid 43   and name HB1 ))
       5.500     3.800     0.500 peak   453 spectrum    1 weight  0.10000E+01 volume  0.21601E-03 ppm1      8.498 ppm2      3.111 CV     1
  ASSI {  454}
    (( segid "    " and resid 54   and name HN  ))
    (( segid "    " and resid 55   and name HN  ))
       6.000     4.900     0.000 peak   454 spectrum    1 weight  0.10000E+01 volume  0.53717E-04 ppm1      8.505 ppm2      8.576 CV     1
  ASSI {  455}
    (( segid "    " and resid 54   and name HN  ))
    (( segid "    " and resid 45   and name HN  ))
       4.400     2.500     1.600 peak   455 spectrum    1 weight  0.10000E+01 volume  0.16668E-03 ppm1      8.505 ppm2      6.822 CV     1
  ASSI {  456}
    (( segid "    " and resid 54   and name HN  ))
    (  segid "    " and resid 45   and name HG2%)
       5.700     4.000     0.300 peak   456 spectrum    1 weight  0.10000E+01 volume  0.65490E-04 ppm1      8.502 ppm2      0.760 CV     1
  ASSI {  457}
    (( segid "    " and resid 54   and name HN  ))
    (( segid "    " and resid 54   and name HA1 ))
       3.100     1.200     1.200 peak   457 spectrum    1 weight  0.10000E+01 volume  0.19812E-02 ppm1      8.497 ppm2      2.670 CV     1
  ASSI {  458}
    (  segid "    " and resid 1    and name HT% )
    (( segid "    " and resid 2    and name HN  ))
       3.400     1.500     1.500 peak   458 spectrum    1 weight  0.10000E+01 volume  0.23705E-02 ppm1      8.477 ppm2      8.021 CV     1
  ASSI {  459}
    (  segid "    " and resid 1    and name HT% )
    (( segid "    " and resid 1    and name HA  ))
       2.700     0.900     0.900 peak   459 spectrum    1 weight  0.10000E+01 volume  0.26617E-02 ppm1      8.476 ppm2      4.738 CV     1
  ASSI {  460}
    (  segid "    " and resid 1    and name HT% )
    (( segid "    " and resid 1    and name HB2 ))
       2.800     2.800     3.200 peak   460 spectrum    1 weight  0.10000E+01 volume  0.28994E-02 ppm1      8.476 ppm2      2.783 CV     1
  ASSI {  462}
    (( segid "    " and resid 13   and name HN  ))
    (( segid "    " and resid 14   and name HN  ))
       3.900     1.900     1.900 peak   462 spectrum    1 weight  0.10000E+01 volume  0.10100E-02 ppm1      8.465 ppm2      8.276 CV     1
  ASSI {  463}
    (( segid "    " and resid 13   and name HN  ))
    (( segid "    " and resid 13   and name HA  ))
       2.500     0.800     0.800 peak   463 spectrum    1 weight  0.10000E+01 volume  0.42888E-02 ppm1      8.468 ppm2      4.407 CV     1
  ASSI {  464}
    (( segid "    " and resid 13   and name HN  ))
    (( segid "    " and resid 12   and name HA  ))
       1.900     0.400     0.400 peak   464 spectrum    1 weight  0.10000E+01 volume  0.20075E-01 ppm1      8.468 ppm2      4.077 CV     1
  ASSI {  465}
    (( segid "    " and resid 13   and name HN  ))
    (( segid "    " and resid 12   and name HB  ))
       4.000     2.000     2.000 peak   465 spectrum    1 weight  0.10000E+01 volume  0.16522E-02 ppm1      8.468 ppm2      2.003 CV     1
  ASSI {  466}
    (( segid "    " and resid 13   and name HN  ))
    (( segid "    " and resid 13   and name HB2 ))
       2.700     2.700     3.300 peak   466 spectrum    1 weight  0.10000E+01 volume  0.40400E-02 ppm1      8.469 ppm2      1.783 CV     1
  ASSI {  467}
    (( segid "    " and resid 13   and name HN  ))
    (( segid "    " and resid 13   and name HB1 ))
       2.500     0.800     0.800 peak   467 spectrum    1 weight  0.10000E+01 volume  0.55278E-02 ppm1      8.468 ppm2      1.736 CV     1
  ASSI {  469}
    (( segid "    " and resid 13   and name HN  ))
    (  segid "    " and resid 12   and name HG1%)
       3.000     3.000     3.000 peak   469 spectrum    1 weight  0.10000E+01 volume  0.39899E-02 ppm1      8.467 ppm2      0.896 CV     1
  ASSI {  470}
    (( segid "    " and resid 8    and name HN  ))
    (( segid "    " and resid 9    and name HG2 ))
       5.200     3.400     0.800 peak   470 spectrum    1 weight  0.10000E+01 volume  0.16244E-03 ppm1      8.457 ppm2      2.260 CV     1
  ASSI {  471}
    (( segid "    " and resid 8    and name HN  ))
    (( segid "    " and resid 8    and name HA  ))
       2.700     0.900     0.900 peak   471 spectrum    1 weight  0.10000E+01 volume  0.34409E-02 ppm1      8.455 ppm2      4.646 CV     1
  ASSI {  473}
    (( segid "    " and resid 8    and name HN  ))
    (( segid "    " and resid 8    and name HB1 ))
       2.700     0.900     0.900 peak   473 spectrum    1 weight  0.10000E+01 volume  0.52642E-02 ppm1      8.456 ppm2      3.207 CV     1
  ASSI {  474}
    (( segid "    " and resid 8    and name HN  ))
    (  segid "    " and resid 7    and name HB% )
       2.900     1.100     1.100 peak   474 spectrum    1 weight  0.10000E+01 volume  0.27040E-02 ppm1      8.454 ppm2      1.341 CV     1
  ASSI {  475}
    (( segid "    " and resid 9    and name HN  ))
    (( segid "    " and resid 8    and name HB2 ))
       3.100     1.200     1.200 peak   475 spectrum    1 weight  0.10000E+01 volume  0.33740E-02 ppm1      8.448 ppm2      3.230 CV     1
  ASSI {  476}
    (( segid "    " and resid 9    and name HN  ))
    (( segid "    " and resid 8    and name HA  ))
       2.400     2.400     3.600 peak   476 spectrum    1 weight  0.10000E+01 volume  0.79948E-02 ppm1      8.450 ppm2      4.644 CV     1
  ASSI {  477}
    (( segid "    " and resid 9    and name HN  ))
    (( segid "    " and resid 9    and name HA  ))
       2.700     0.900     0.900 peak   477 spectrum    1 weight  0.10000E+01 volume  0.29751E-02 ppm1      8.450 ppm2      4.267 CV     1
  ASSI {  478}
    (( segid "    " and resid 9    and name HN  ))
    (( segid "    " and resid 9    and name HG2 ))
       2.800     0.900     0.900 peak   478 spectrum    1 weight  0.10000E+01 volume  0.20975E-02 ppm1      8.450 ppm2      2.252 CV     1
  ASSI {  479}
    (( segid "    " and resid 9    and name HN  ))
    (( segid "    " and resid 9    and name HB2 ))
       3.200     1.300     1.300 peak   479 spectrum    1 weight  0.10000E+01 volume  0.26076E-02 ppm1      8.450 ppm2      2.028 CV     1
  ASSI {  480}
    (( segid "    " and resid 46   and name HN  ))
    (  segid "    " and resid 47   and name HG2%)
       3.500     1.500     1.500 peak   480 spectrum    1 weight  0.10000E+01 volume  0.10461E-02 ppm1      8.432 ppm2      1.237 CV     1
  ASSI {  481}
    (( segid "    " and resid 9    and name HN  ))
    (( segid "    " and resid 9    and name HB1 ))
       2.300     0.700     0.700 peak   481 spectrum    1 weight  0.10000E+01 volume  0.63044E-02 ppm1      8.450 ppm2      1.908 CV     1
  ASSI {  482}
    (( segid "    " and resid 46   and name HN  ))
    (( segid "    " and resid 46   and name HD21))
       5.100     3.300     0.900 peak   482 spectrum    1 weight  0.10000E+01 volume  0.14301E-03 ppm1      8.437 ppm2      7.271 CV     1
  ASSI {  483}
    (( segid "    " and resid 46   and name HN  ))
    (( segid "    " and resid 46   and name HA  ))
       3.200     1.300     1.300 peak   483 spectrum    1 weight  0.10000E+01 volume  0.10433E-02 ppm1      8.439 ppm2      4.774 CV     1
  ASSI {  484}
    (( segid "    " and resid 46   and name HN  ))
    (( segid "    " and resid 45   and name HG11))
       3.200     1.300     1.300 peak   484 spectrum    1 weight  0.10000E+01 volume  0.31639E-02 ppm1      8.440 ppm2      1.343 CV     1
  ASSI {  485}
    (( segid "    " and resid 46   and name HN  ))
    (( segid "    " and resid 45   and name HN  ))
       4.000     2.000     2.000 peak   485 spectrum    1 weight  0.10000E+01 volume  0.96747E-03 ppm1      8.433 ppm2      6.819 CV     1
  ASSI {  486}
    (( segid "    " and resid 46   and name HN  ))
    (( segid "    " and resid 45   and name HA  ))
       2.300     0.600     0.600 peak   486 spectrum    1 weight  0.10000E+01 volume  0.66428E-02 ppm1      8.433 ppm2      3.783 CV     1
  ASSI {  487}
    (( segid "    " and resid 46   and name HN  ))
    (( segid "    " and resid 46   and name HB2 ))
       3.400     1.500     1.500 peak   487 spectrum    1 weight  0.10000E+01 volume  0.90971E-03 ppm1      8.433 ppm2      3.087 CV     1
  ASSI {  488}
    (( segid "    " and resid 46   and name HN  ))
    (( segid "    " and resid 46   and name HB1 ))
       3.300     1.400     1.400 peak   488 spectrum    1 weight  0.10000E+01 volume  0.96900E-03 ppm1      8.432 ppm2      2.929 CV     1
  ASSI {  490}
    (( segid "    " and resid 46   and name HN  ))
    (  segid "    " and resid 45   and name HD1%)
       4.100     2.100     1.900 peak   490 spectrum    1 weight  0.10000E+01 volume  0.16243E-02 ppm1      8.437 ppm2      0.905 CV     1
  ASSI {  491}
    (( segid "    " and resid 46   and name HN  ))
    (  segid "    " and resid 45   and name HG2%)
       3.100     1.200     1.200 peak   491 spectrum    1 weight  0.10000E+01 volume  0.17413E-02 ppm1      8.434 ppm2      0.763 CV     1
  ASSI {  492}
    (( segid "    " and resid 46   and name HN  ))
    (( segid "    " and resid 47   and name HA  ))
       3.700     1.700     1.700 peak   492 spectrum    1 weight  0.10000E+01 volume  0.58596E-03 ppm1      8.427 ppm2      4.389 CV     1
  ASSI {  493}
    (( segid "    " and resid 10   and name HN  ))
    (( segid "    " and resid 9    and name HB1 ))
       4.900     3.100     1.100 peak   493 spectrum    1 weight  0.10000E+01 volume  0.32944E-03 ppm1      8.409 ppm2      1.901 CV     1
  ASSI {  495}
    (( segid "    " and resid 17   and name HN  ))
    (( segid "    " and resid 15   and name HA1 ))
       4.100     2.100     1.900 peak   495 spectrum    1 weight  0.10000E+01 volume  0.63713E-03 ppm1      8.440 ppm2      4.009 CV     1
  ASSI {  496}
    (( segid "    " and resid 17   and name HN  ))
    (( segid "    " and resid 18   and name HD1 ))
       4.400     2.400     1.600 peak   496 spectrum    1 weight  0.10000E+01 volume  0.21066E-03 ppm1      8.437 ppm2      3.660 CV     1
  ASSI {  497}
    (( segid "    " and resid 17   and name HN  ))
    (( segid "    " and resid 16   and name HA  ))
       2.200     2.200     3.800 peak   497 spectrum    1 weight  0.10000E+01 volume  0.13317E-01 ppm1      8.436 ppm2      4.306 CV     1
  ASSI {  498}
    (( segid "    " and resid 17   and name HN  ))
    (( segid "    " and resid 16   and name HN  ))
       2.800     0.900     0.900 peak   498 spectrum    1 weight  0.10000E+01 volume  0.20601E-02 ppm1      8.440 ppm2      8.060 CV     1
  ASSI {  499}
    (( segid "    " and resid 17   and name HN  ))
    (( segid "    " and resid 16   and name HB  ))
       2.800     1.000     1.000 peak   499 spectrum    1 weight  0.10000E+01 volume  0.25871E-02 ppm1      8.438 ppm2      4.159 CV     1
  ASSI {  500}
    (( segid "    " and resid 17   and name HN  ))
    (( segid "    " and resid 17   and name HB2 ))
       2.400     0.700     0.700 peak   500 spectrum    1 weight  0.10000E+01 volume  0.60779E-02 ppm1      8.438 ppm2      1.818 CV     1
  ASSI {  501}
    (( segid "    " and resid 17   and name HN  ))
    (( segid "    " and resid 17   and name HD2 ))
       2.200     0.600     0.600 peak   501 spectrum    1 weight  0.10000E+01 volume  0.70218E-02 ppm1      8.439 ppm2      1.739 CV     1
  ASSI {  502}
    (( segid "    " and resid 17   and name HN  ))
    (( segid "    " and resid 17   and name HG2 ))
       2.800     1.000     1.000 peak   502 spectrum    1 weight  0.10000E+01 volume  0.25737E-02 ppm1      8.438 ppm2      1.475 CV     1
  ASSI {  503}
    (( segid "    " and resid 17   and name HN  ))
    (  segid "    " and resid 16   and name HG2%)
       3.300     3.300     2.700 peak   503 spectrum    1 weight  0.10000E+01 volume  0.19272E-02 ppm1      8.438 ppm2      1.179 CV     1
  ASSI {  504}
    (( segid "    " and resid 17   and name HN  ))
    (( segid "    " and resid 18   and name HD2 ))
       4.000     2.000     2.000 peak   504 spectrum    1 weight  0.10000E+01 volume  0.11349E-02 ppm1      8.434 ppm2      3.861 CV     1
  ASSI {  505}
    (( segid "    " and resid 96   and name HN  ))
    (( segid "    " and resid 96   and name HA1 ))
       2.400     0.700     0.700 peak   505 spectrum    1 weight  0.10000E+01 volume  0.44719E-02 ppm1      8.440 ppm2      3.878 CV     1
  ASSI {  506}
    (( segid "    " and resid 96   and name HN  ))
    (( segid "    " and resid 96   and name HA2 ))
       2.800     1.000     1.000 peak   506 spectrum    1 weight  0.10000E+01 volume  0.41064E-02 ppm1      8.441 ppm2      3.826 CV     1
  ASSI {  507}
    (( segid "    " and resid 96   and name HN  ))
    (( segid "    " and resid 95   and name HB1 ))
       4.900     3.000     1.100 peak   507 spectrum    1 weight  0.10000E+01 volume  0.17634E-03 ppm1      8.443 ppm2      2.943 CV     1
  ASSI {  510}
    (( segid "    " and resid 96   and name HN  ))
    (( segid "    " and resid 95   and name HD1 ))
       6.000     4.800     0.000 peak   510 spectrum    1 weight  0.10000E+01 volume  0.35714E-04 ppm1      8.438 ppm2      7.171 CV     1
  ASSI {  511}
    (( segid "    " and resid 96   and name HN  ))
    (( segid "    " and resid 94   and name HA2 ))
       4.400     2.400     1.600 peak   511 spectrum    1 weight  0.10000E+01 volume  0.36686E-03 ppm1      8.443 ppm2      4.281 CV     1
  ASSI {  512}
    (( segid "    " and resid 96   and name HN  ))
    (( segid "    " and resid 95   and name HB2 ))
       6.000     5.000     0.000 peak   512 spectrum    1 weight  0.10000E+01 volume  0.17731E-04 ppm1      8.440 ppm2      3.544 CV     1
  ASSI {  513}
    (( segid "    " and resid 96   and name HN  ))
    (  segid "    " and resid 97   and name HB% )
       6.000     6.000     0.000 peak   513 spectrum    1 weight  0.10000E+01 volume  0.35985E-04 ppm1      8.442 ppm2      0.180 CV     1
  ASSI {  514}
    (( segid "    " and resid 96   and name HN  ))
    (( segid "    " and resid 98   and name HN  ))
       6.000     4.800     0.000 peak   514 spectrum    1 weight  0.10000E+01 volume  0.35673E-04 ppm1      8.431 ppm2      7.873 CV     1
  ASSI {  515}
    (( segid "    " and resid 96   and name HN  ))
    (( segid "    " and resid 95   and name HA  ))
       3.700     1.700     1.700 peak   515 spectrum    1 weight  0.10000E+01 volume  0.37267E-03 ppm1      8.437 ppm2      4.988 CV     1
  ASSI {  516}
    (( segid "    " and resid 96   and name HN  ))
    (( segid "    " and resid 93   and name HA  ))
       6.000     6.000     0.000 peak   516 spectrum    1 weight  0.10000E+01 volume  0.16345E-04 ppm1      8.431 ppm2      4.679 CV     1
  ASSI {  518}
    (( segid "    " and resid 27   and name HN  ))
    (( segid "    " and resid 27   and name HA  ))
       2.600     0.900     0.900 peak   518 spectrum    1 weight  0.10000E+01 volume  0.34071E-02 ppm1      8.426 ppm2      4.641 CV     1
  ASSI {  519}
    (( segid "    " and resid 27   and name HN  ))
    (( segid "    " and resid 26   and name HA  ))
       2.500     2.500     3.500 peak   519 spectrum    1 weight  0.10000E+01 volume  0.57510E-02 ppm1      8.426 ppm2      4.261 CV     1
  ASSI {  520}
    (( segid "    " and resid 27   and name HN  ))
    (( segid "    " and resid 25   and name HA  ))
       4.900     3.100     1.100 peak   520 spectrum    1 weight  0.10000E+01 volume  0.21273E-03 ppm1      8.426 ppm2      4.077 CV     1
  ASSI {  521}
    (( segid "    " and resid 27   and name HN  ))
    (( segid "    " and resid 27   and name HB1 ))
       3.000     1.100     1.100 peak   521 spectrum    1 weight  0.10000E+01 volume  0.42517E-02 ppm1      8.427 ppm2      2.804 CV     1
  ASSI {  522}
    (( segid "    " and resid 27   and name HN  ))
    (( segid "    " and resid 26   and name HB  ))
       3.100     1.200     1.200 peak   522 spectrum    1 weight  0.10000E+01 volume  0.10206E-02 ppm1      8.430 ppm2      1.953 CV     1
  ASSI {  523}
    (( segid "    " and resid 27   and name HN  ))
    (( segid "    " and resid 26   and name HG12))
       5.500     3.700     0.500 peak   523 spectrum    1 weight  0.10000E+01 volume  0.99977E-04 ppm1      8.428 ppm2      1.443 CV     1
  ASSI {  524}
    (( segid "    " and resid 27   and name HN  ))
    (  segid "    " and resid 25   and name HG1%)
       3.700     1.800     1.800 peak   524 spectrum    1 weight  0.10000E+01 volume  0.50748E-03 ppm1      8.425 ppm2      0.943 CV     1
  ASSI {  527}
    (( segid "    " and resid 27   and name HN  ))
    (( segid "    " and resid 31   and name HD1 ))
       3.900     1.900     1.900 peak   527 spectrum    1 weight  0.10000E+01 volume  0.51018E-03 ppm1      8.436 ppm2      7.189 CV     1
  ASSI {  528}
    (( segid "    " and resid 10   and name HN  ))
    (( segid "    " and resid 11   and name HN  ))
       2.900     1.000     1.000 peak   528 spectrum    1 weight  0.10000E+01 volume  0.23159E-02 ppm1      8.414 ppm2      8.106 CV     1
  ASSI {  529}
    (( segid "    " and resid 10   and name HN  ))
    (( segid "    " and resid 9    and name HA  ))
       1.900     0.400     0.400 peak   529 spectrum    1 weight  0.10000E+01 volume  0.22809E-01 ppm1      8.415 ppm2      4.270 CV     1
  ASSI {  530}
    (( segid "    " and resid 10   and name HN  ))
    (( segid "    " and resid 9    and name HG2 ))
       4.300     2.300     1.700 peak   530 spectrum    1 weight  0.10000E+01 volume  0.62551E-03 ppm1      8.412 ppm2      2.251 CV     1
  ASSI {  531}
    (( segid "    " and resid 10   and name HN  ))
    (( segid "    " and resid 9    and name HB2 ))
       3.000     1.100     1.100 peak   531 spectrum    1 weight  0.10000E+01 volume  0.19196E-02 ppm1      8.414 ppm2      2.027 CV     1
  ASSI {  532}
    (( segid "    " and resid 10   and name HN  ))
    (  segid "    " and resid 10   and name HB% )
       2.300     2.300     3.700 peak   532 spectrum    1 weight  0.10000E+01 volume  0.93988E-02 ppm1      8.415 ppm2      1.370 CV     1
  ASSI {  533}
    (( segid "    " and resid 32   and name HN  ))
    (( segid "    " and resid 31   and name HB1 ))
       3.800     1.800     1.800 peak   533 spectrum    1 weight  0.10000E+01 volume  0.72022E-03 ppm1      8.420 ppm2      3.385 CV     1
  ASSI {  535}
    (( segid "    " and resid 32   and name HN  ))
    (( segid "    " and resid 43   and name HZ2 ))
       4.400     2.400     1.600 peak   535 spectrum    1 weight  0.10000E+01 volume  0.70103E-03 ppm1      8.418 ppm2      7.575 CV     1
  ASSI {  536}
    (( segid "    " and resid 32   and name HN  ))
    (( segid "    " and resid 31   and name HN  ))
       2.700     0.900     0.900 peak   536 spectrum    1 weight  0.10000E+01 volume  0.19706E-02 ppm1      8.415 ppm2      7.209 CV     1
  ASSI {  537}
    (( segid "    " and resid 32   and name HN  ))
    (( segid "    " and resid 32   and name HA  ))
       3.000     1.100     1.100 peak   537 spectrum    1 weight  0.10000E+01 volume  0.12634E-02 ppm1      8.415 ppm2      4.838 CV     1
  ASSI {  538}
    (( segid "    " and resid 32   and name HN  ))
    (( segid "    " and resid 31   and name HA  ))
       3.300     1.400     1.400 peak   538 spectrum    1 weight  0.10000E+01 volume  0.77660E-03 ppm1      8.414 ppm2      4.419 CV     1
  ASSI {  539}
    (( segid "    " and resid 32   and name HN  ))
    (( segid "    " and resid 33   and name HA  ))
       5.900     4.400     0.100 peak   539 spectrum    1 weight  0.10000E+01 volume  0.10531E-03 ppm1      8.415 ppm2      4.256 CV     1
  ASSI {  541}
    (( segid "    " and resid 32   and name HN  ))
    (( segid "    " and resid 32   and name HB1 ))
       2.400     0.700     0.700 peak   541 spectrum    1 weight  0.10000E+01 volume  0.38158E-02 ppm1      8.415 ppm2      2.782 CV     1
  ASSI {  542}
    (( segid "    " and resid 32   and name HN  ))
    (  segid "    " and resid 33   and name HB% )
       4.400     2.400     1.600 peak   542 spectrum    1 weight  0.10000E+01 volume  0.65578E-03 ppm1      8.415 ppm2      1.519 CV     1
  ASSI {  543}
    (( segid "    " and resid 32   and name HN  ))
    (( segid "    " and resid 30   and name HN  ))
       4.500     2.500     1.500 peak   543 spectrum    1 weight  0.10000E+01 volume  0.21641E-03 ppm1      8.411 ppm2      8.026 CV     1
  ASSI {  544}
    (( segid "    " and resid 32   and name HN  ))
    (( segid "    " and resid 29   and name HB2 ))
       3.400     3.400     2.600 peak   544 spectrum    1 weight  0.10000E+01 volume  0.32701E-03 ppm1      8.422 ppm2      3.987 CV     1
  ASSI {  545}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 72   and name HD2 ))
       6.000     6.000     0.000 peak   545 spectrum    1 weight  0.10000E+01 volume  0.23262E-05 ppm1      8.404 ppm2      3.920 CV     1
  ASSI {  546}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 71   and name HN  ))
       4.800     2.800     1.200 peak   546 spectrum    1 weight  0.10000E+01 volume  0.14533E-03 ppm1      8.409 ppm2      8.611 CV     1
  ASSI {  547}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 69   and name HN  ))
       2.400     0.700     0.700 peak   547 spectrum    1 weight  0.10000E+01 volume  0.35678E-02 ppm1      8.406 ppm2      7.109 CV     1
  ASSI {  548}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 62   and name HB1 ))
       6.000     6.000     0.000 peak   548 spectrum    1 weight  0.10000E+01 volume  0.19365E-05 ppm1      8.410 ppm2      3.067 CV     1
  ASSI {  549}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 63   and name HG1 ))
       4.500     2.500     1.500 peak   549 spectrum    1 weight  0.10000E+01 volume  0.11644E-02 ppm1      8.406 ppm2      2.089 CV     1
  OR {  549}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 63   and name HB1 ))
  ASSI {  550}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 68   and name HG  ))
       2.700     0.900     0.900 peak   550 spectrum    1 weight  0.10000E+01 volume  0.33707E-02 ppm1      8.406 ppm2      1.314 CV     1
  ASSI {  551}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 67   and name HN  ))
       2.700     0.900     0.900 peak   551 spectrum    1 weight  0.10000E+01 volume  0.17531E-02 ppm1      8.403 ppm2      8.107 CV     1
  ASSI {  552}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 70   and name HN  ))
       4.400     2.400     1.600 peak   552 spectrum    1 weight  0.10000E+01 volume  0.21139E-03 ppm1      8.400 ppm2      7.762 CV     1
  ASSI {  553}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 68   and name HA  ))
       2.400     0.700     0.700 peak   553 spectrum    1 weight  0.10000E+01 volume  0.39243E-02 ppm1      8.404 ppm2      4.318 CV     1
  ASSI {  554}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 69   and name HA  ))
       6.000     6.000     0.000 peak   554 spectrum    1 weight  0.10000E+01 volume  0.26969E-05 ppm1      8.404 ppm2      3.776 CV     1
  ASSI {  555}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 63   and name HA  ))
       2.900     1.000     1.000 peak   555 spectrum    1 weight  0.10000E+01 volume  0.25039E-02 ppm1      8.404 ppm2      3.691 CV     1
  ASSI {  556}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 67   and name HA2 ))
       3.300     1.400     1.400 peak   556 spectrum    1 weight  0.10000E+01 volume  0.71063E-03 ppm1      8.403 ppm2      2.380 CV     1
  ASSI {  557}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 68   and name HB2 ))
       2.100     0.600     0.600 peak   557 spectrum    1 weight  0.10000E+01 volume  0.66017E-02 ppm1      8.405 ppm2      1.651 CV     1
  ASSI {  558}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 68   and name HB1 ))
       3.100     1.200     1.200 peak   558 spectrum    1 weight  0.10000E+01 volume  0.44752E-02 ppm1      8.405 ppm2      1.540 CV     1
  ASSI {  559}
    (( segid "    " and resid 68   and name HN  ))
    (  segid "    " and resid 68   and name HD1%)
       2.300     0.700     0.700 peak   559 spectrum    1 weight  0.10000E+01 volume  0.39948E-02 ppm1      8.405 ppm2      0.996 CV     1
  ASSI {  560}
    (( segid "    " and resid 68   and name HN  ))
    (  segid "    " and resid 68   and name HD2%)
       3.200     3.200     2.800 peak   560 spectrum    1 weight  0.10000E+01 volume  0.49374E-02 ppm1      8.405 ppm2      0.842 CV     1
  ASSI {  561}
    (( segid "    " and resid 68   and name HN  ))
    (  segid "    " and resid 85   and name HG2%)
       6.000     5.100     0.000 peak   561 spectrum    1 weight  0.10000E+01 volume  0.66330E-04 ppm1      8.405 ppm2      0.518 CV     1
  ASSI {  562}
    (( segid "    " and resid 68   and name HN  ))
    (( segid "    " and resid 66   and name HA2 ))
       3.000     1.100     1.100 peak   562 spectrum    1 weight  0.10000E+01 volume  0.12942E-02 ppm1      8.400 ppm2      3.986 CV     1
  ASSI {  563}
    (( segid "    " and resid 63   and name HN  ))
    (( segid "    " and resid 59   and name HG2 ))
       6.000     6.000     0.000 peak   563 spectrum    1 weight  0.10000E+01 volume  0.57050E-05 ppm1      8.400 ppm2      2.466 CV     1
  ASSI {  565}
    (( segid "    " and resid 63   and name HN  ))
    (( segid "    " and resid 62   and name HN  ))
       3.100     1.200     1.200 peak   565 spectrum    1 weight  0.10000E+01 volume  0.11170E-02 ppm1      8.396 ppm2      8.131 CV     1
  ASSI {  566}
    (( segid "    " and resid 63   and name HN  ))
    (( segid "    " and resid 62   and name HD1 ))
       3.600     1.600     1.600 peak   566 spectrum    1 weight  0.10000E+01 volume  0.52070E-03 ppm1      8.398 ppm2      6.751 CV     1
  ASSI {  567}
    (( segid "    " and resid 63   and name HN  ))
    (( segid "    " and resid 59   and name HA  ))
       4.100     2.100     1.900 peak   567 spectrum    1 weight  0.10000E+01 volume  0.54065E-03 ppm1      8.397 ppm2      4.141 CV     1
  ASSI {  568}
    (( segid "    " and resid 63   and name HN  ))
    (( segid "    " and resid 61   and name HA  ))
       3.900     1.900     1.900 peak   568 spectrum    1 weight  0.10000E+01 volume  0.53726E-03 ppm1      8.396 ppm2      3.984 CV     1
  ASSI {  569}
    (( segid "    " and resid 63   and name HN  ))
    (( segid "    " and resid 63   and name HA  ))
       2.800     1.000     1.000 peak   569 spectrum    1 weight  0.10000E+01 volume  0.19054E-02 ppm1      8.395 ppm2      3.696 CV     1
  ASSI {  570}
    (( segid "    " and resid 63   and name HN  ))
    (( segid "    " and resid 62   and name HB2 ))
       4.200     2.200     1.800 peak   570 spectrum    1 weight  0.10000E+01 volume  0.91273E-03 ppm1      8.397 ppm2      3.476 CV     1
  ASSI {  571}
    (( segid "    " and resid 63   and name HN  ))
    (( segid "    " and resid 62   and name HB1 ))
       2.300     0.600     0.600 peak   571 spectrum    1 weight  0.10000E+01 volume  0.37034E-02 ppm1      8.396 ppm2      3.077 CV     1
  ASSI {  572}
    (( segid "    " and resid 63   and name HN  ))
    (( segid "    " and resid 63   and name HB1 ))
       2.200     0.600     0.600 peak   572 spectrum    1 weight  0.10000E+01 volume  0.59485E-02 ppm1      8.397 ppm2      2.084 CV     1
  ASSI {  573}
    (( segid "    " and resid 63   and name HN  ))
    (  segid "    " and resid 64   and name HB% )
       3.900     1.900     1.900 peak   573 spectrum    1 weight  0.10000E+01 volume  0.13051E-02 ppm1      8.397 ppm2      1.495 CV     1
  ASSI {  574}
    (( segid "    " and resid 63   and name HN  ))
    (  segid "    " and resid 68   and name HD1%)
       5.000     3.200     1.000 peak   574 spectrum    1 weight  0.10000E+01 volume  0.27837E-03 ppm1      8.398 ppm2      0.998 CV     1
  ASSI {  576}
    (( segid "    " and resid 63   and name HN  ))
    (( segid "    " and resid 62   and name HA  ))
       3.500     1.600     1.600 peak   576 spectrum    1 weight  0.10000E+01 volume  0.68523E-03 ppm1      8.392 ppm2      3.833 CV     1
  ASSI {  578}
    (( segid "    " and resid 7    and name HN  ))
    (( segid "    " and resid 6    and name HA  ))
       2.100     0.500     0.500 peak   578 spectrum    1 weight  0.10000E+01 volume  0.14457E-01 ppm1      8.384 ppm2      4.364 CV     1
  ASSI {  579}
    (( segid "    " and resid 7    and name HN  ))
    (( segid "    " and resid 7    and name HA  ))
       2.700     0.900     0.900 peak   579 spectrum    1 weight  0.10000E+01 volume  0.29019E-02 ppm1      8.384 ppm2      4.222 CV     1
  ASSI {  580}
    (( segid "    " and resid 7    and name HN  ))
    (( segid "    " and resid 6    and name HD1 ))
       3.300     3.300     2.700 peak   580 spectrum    1 weight  0.10000E+01 volume  0.35804E-03 ppm1      8.382 ppm2      3.709 CV     1
  ASSI {  581}
    (( segid "    " and resid 7    and name HN  ))
    (( segid "    " and resid 6    and name HB2 ))
       3.100     1.200     1.200 peak   581 spectrum    1 weight  0.10000E+01 volume  0.12943E-02 ppm1      8.384 ppm2      2.288 CV     1
  ASSI {  582}
    (( segid "    " and resid 7    and name HN  ))
    (( segid "    " and resid 6    and name HG2 ))
       5.000     3.100     1.000 peak   582 spectrum    1 weight  0.10000E+01 volume  0.30920E-03 ppm1      8.384 ppm2      2.025 CV     1
  ASSI {  583}
    (( segid "    " and resid 7    and name HN  ))
    (( segid "    " and resid 6    and name HB1 ))
       3.500     1.500     1.500 peak   583 spectrum    1 weight  0.10000E+01 volume  0.14064E-02 ppm1      8.384 ppm2      1.851 CV     1
  ASSI {  584}
    (( segid "    " and resid 7    and name HN  ))
    (  segid "    " and resid 7    and name HB% )
       2.400     0.700     0.700 peak   584 spectrum    1 weight  0.10000E+01 volume  0.77858E-02 ppm1      8.384 ppm2      1.339 CV     1
  ASSI {  586}
    (( segid "    " and resid 83   and name HN  ))
    (( segid "    " and resid 82   and name HA  ))
       4.600     2.700     1.400 peak   586 spectrum    1 weight  0.10000E+01 volume  0.10438E-03 ppm1      8.390 ppm2      4.295 CV     1
  ASSI {  587}
    (( segid "    " and resid 83   and name HN  ))
    (  segid "    " and resid 86   and name HB% )
       5.200     3.300     0.800 peak   587 spectrum    1 weight  0.10000E+01 volume  0.11242E-03 ppm1      8.389 ppm2      0.756 CV     1
  ASSI {  588}
    (( segid "    " and resid 83   and name HN  ))
    (( segid "    " and resid 83   and name HG11))
       2.600     0.900     0.900 peak   588 spectrum    1 weight  0.10000E+01 volume  0.21057E-02 ppm1      8.388 ppm2      0.560 CV     1
  ASSI {  590}
    (( segid "    " and resid 83   and name HN  ))
    (( segid "    " and resid 83   and name HB  ))
       2.700     0.900     0.900 peak   590 spectrum    1 weight  0.10000E+01 volume  0.18102E-02 ppm1      8.386 ppm2      1.589 CV     1
  ASSI {  591}
    (( segid "    " and resid 83   and name HN  ))
    (( segid "    " and resid 83   and name HG12))
       3.300     1.400     1.400 peak   591 spectrum    1 weight  0.10000E+01 volume  0.25090E-02 ppm1      8.386 ppm2      1.404 CV     1
  ASSI {  593}
    (( segid "    " and resid 83   and name HN  ))
    (( segid "    " and resid 84   and name HN  ))
       3.000     1.100     1.100 peak   593 spectrum    1 weight  0.10000E+01 volume  0.13151E-02 ppm1      8.388 ppm2      7.564 CV     1
  ASSI {  594}
    (( segid "    " and resid 83   and name HN  ))
    (( segid "    " and resid 80   and name HA  ))
       3.700     1.700     1.700 peak   594 spectrum    1 weight  0.10000E+01 volume  0.73229E-03 ppm1      8.389 ppm2      3.460 CV     1
  ASSI {  595}
    (( segid "    " and resid 83   and name HN  ))
    (( segid "    " and resid 83   and name HA  ))
       3.100     1.200     1.200 peak   595 spectrum    1 weight  0.10000E+01 volume  0.10942E-02 ppm1      8.389 ppm2      2.902 CV     1
  ASSI {  596}
    (( segid "    " and resid 83   and name HN  ))
    (( segid "    " and resid 82   and name HG2 ))
       4.500     2.500     1.500 peak   596 spectrum    1 weight  0.10000E+01 volume  0.30453E-03 ppm1      8.388 ppm2      2.750 CV     1
  ASSI {  597}
    (( segid "    " and resid 83   and name HN  ))
    (( segid "    " and resid 82   and name HG1 ))
       4.100     2.100     1.900 peak   597 spectrum    1 weight  0.10000E+01 volume  0.45329E-03 ppm1      8.389 ppm2      2.509 CV     1
  ASSI {  598}
    (( segid "    " and resid 83   and name HN  ))
    (  segid "    " and resid 83   and name HG2%)
       3.500     1.600     1.600 peak   598 spectrum    1 weight  0.10000E+01 volume  0.22167E-02 ppm1      8.387 ppm2      0.416 CV     1
  ASSI {  600}
    (( segid "    " and resid 89   and name HN  ))
    (( segid "    " and resid 90   and name HN  ))
       3.100     1.200     1.200 peak   600 spectrum    1 weight  0.10000E+01 volume  0.86628E-03 ppm1      8.385 ppm2      9.183 CV     1
  ASSI {  601}
    (( segid "    " and resid 89   and name HN  ))
    (( segid "    " and resid 88   and name HN  ))
       3.000     1.100     1.100 peak   601 spectrum    1 weight  0.10000E+01 volume  0.13614E-02 ppm1      8.383 ppm2      7.364 CV     1
  ASSI {  602}
    (( segid "    " and resid 89   and name HN  ))
    (( segid "    " and resid 86   and name HA  ))
       4.300     2.300     1.700 peak   602 spectrum    1 weight  0.10000E+01 volume  0.16638E-03 ppm1      8.382 ppm2      4.271 CV     1
  ASSI {  603}
    (( segid "    " and resid 89   and name HN  ))
    (( segid "    " and resid 88   and name HA  ))
       3.500     1.500     1.500 peak   603 spectrum    1 weight  0.10000E+01 volume  0.78017E-03 ppm1      8.386 ppm2      3.668 CV     1
  ASSI {  604}
    (( segid "    " and resid 89   and name HN  ))
    (( segid "    " and resid 88   and name HB  ))
       2.800     1.000     1.000 peak   604 spectrum    1 weight  0.10000E+01 volume  0.13203E-02 ppm1      8.384 ppm2      2.396 CV     1
  ASSI {  605}
    (( segid "    " and resid 89   and name HN  ))
    (  segid "    " and resid 88   and name HG2%)
       4.100     2.100     1.900 peak   605 spectrum    1 weight  0.10000E+01 volume  0.10277E-02 ppm1      8.382 ppm2      1.183 CV     1
  ASSI {  606}
    (( segid "    " and resid 89   and name HN  ))
    (  segid "    " and resid 89   and name HG2%)
       3.300     1.400     1.400 peak   606 spectrum    1 weight  0.10000E+01 volume  0.14160E-02 ppm1      8.382 ppm2      1.076 CV     1
  ASSI {  607}
    (( segid "    " and resid 89   and name HN  ))
    (  segid "    " and resid 85   and name HG1%)
       3.400     3.400     2.600 peak   607 spectrum    1 weight  0.10000E+01 volume  0.34532E-03 ppm1      8.383 ppm2      0.425 CV     1
  ASSI {  608}
    (( segid "    " and resid 89   and name HN  ))
    (  segid "    " and resid 88   and name HG1%)
       3.200     1.300     1.300 peak   608 spectrum    1 weight  0.10000E+01 volume  0.16723E-02 ppm1      8.380 ppm2      1.024 CV     1
  ASSI {  609}
    (( segid "    " and resid 89   and name HN  ))
    (( segid "    " and resid 65   and name HB2 ))
       6.000     5.100     0.000 peak   609 spectrum    1 weight  0.10000E+01 volume  0.65968E-04 ppm1      8.382 ppm2      2.936 CV     1
  ASSI {  610}
    (( segid "    " and resid 89   and name HN  ))
    (( segid "    " and resid 89   and name HA  ))
       3.000     1.100     1.100 peak   610 spectrum    1 weight  0.10000E+01 volume  0.11717E-02 ppm1      8.378 ppm2      3.886 CV     1
  ASSI {  611}
    (( segid "    " and resid 4    and name HN  ))
    (( segid "    " and resid 3    and name HA  ))
       1.900     0.500     0.500 peak   611 spectrum    1 weight  0.10000E+01 volume  0.20390E-01 ppm1      8.359 ppm2      4.108 CV     1
  ASSI {  612}
    (( segid "    " and resid 4    and name HN  ))
    (( segid "    " and resid 4    and name HB  ))
       2.400     0.700     0.700 peak   612 spectrum    1 weight  0.10000E+01 volume  0.63587E-02 ppm1      8.359 ppm2      2.012 CV     1
  ASSI {  613}
    (( segid "    " and resid 4    and name HN  ))
    (  segid "    " and resid 4    and name HG2%)
       2.500     2.500     3.500 peak   613 spectrum    1 weight  0.10000E+01 volume  0.83414E-02 ppm1      8.358 ppm2      0.900 CV     1
  ASSI {  614}
    (( segid "    " and resid 5    and name HN  ))
    (( segid "    " and resid 4    and name HB  ))
       3.400     1.400     1.400 peak   614 spectrum    1 weight  0.10000E+01 volume  0.16290E-02 ppm1      8.347 ppm2      2.013 CV     1
  ASSI {  615}
    (( segid "    " and resid 5    and name HN  ))
    (( segid "    " and resid 5    and name HA  ))
       2.700     0.900     0.900 peak   615 spectrum    1 weight  0.10000E+01 volume  0.25151E-02 ppm1      8.344 ppm2      4.584 CV     1
  ASSI {  616}
    (( segid "    " and resid 5    and name HN  ))
    (( segid "    " and resid 4    and name HA  ))
       1.900     0.500     0.500 peak   616 spectrum    1 weight  0.10000E+01 volume  0.20880E-01 ppm1      8.345 ppm2      4.164 CV     1
  ASSI {  617}
    (( segid "    " and resid 5    and name HN  ))
    (  segid "    " and resid 5    and name HG2%)
       2.900     1.000     1.000 peak   617 spectrum    1 weight  0.10000E+01 volume  0.22338E-02 ppm1      8.346 ppm2      1.233 CV     1
  ASSI {  618}
    (( segid "    " and resid 5    and name HN  ))
    (  segid "    " and resid 4    and name HG1%)
       2.800     1.000     1.000 peak   618 spectrum    1 weight  0.10000E+01 volume  0.31585E-02 ppm1      8.345 ppm2      0.886 CV     1
  ASSI {  619}
    (( segid "    " and resid 5    and name HN  ))
    (( segid "    " and resid 6    and name HD2 ))
       5.200     3.300     0.800 peak   619 spectrum    1 weight  0.10000E+01 volume  0.34678E-03 ppm1      8.346 ppm2      3.872 CV     1
  ASSI {  620}
    (( segid "    " and resid 94   and name HN  ))
    (( segid "    " and resid 93   and name HB1 ))
       5.100     3.300     0.900 peak   620 spectrum    1 weight  0.10000E+01 volume  0.14696E-03 ppm1      8.321 ppm2      1.652 CV     1
  ASSI {  621}
    (( segid "    " and resid 94   and name HN  ))
    (( segid "    " and resid 98   and name HE3 ))
       6.000     5.000     0.000 peak   621 spectrum    1 weight  0.10000E+01 volume  0.52172E-04 ppm1      8.325 ppm2      7.919 CV     1
  ASSI {  622}
    (( segid "    " and resid 94   and name HN  ))
    (( segid "    " and resid 92   and name HN  ))
       3.500     1.500     1.500 peak   622 spectrum    1 weight  0.10000E+01 volume  0.86726E-03 ppm1      8.325 ppm2      7.818 CV     1
  ASSI {  623}
    (( segid "    " and resid 94   and name HN  ))
    (( segid "    " and resid 94   and name HA2 ))
       2.200     0.600     0.600 peak   623 spectrum    1 weight  0.10000E+01 volume  0.64125E-02 ppm1      8.324 ppm2      4.270 CV     1
  ASSI {  624}
    (( segid "    " and resid 94   and name HN  ))
    (( segid "    " and resid 91   and name HA  ))
       4.200     2.200     1.800 peak   624 spectrum    1 weight  0.10000E+01 volume  0.21651E-03 ppm1      8.323 ppm2      4.015 CV     1
  ASSI {  625}
    (( segid "    " and resid 94   and name HN  ))
    (( segid "    " and resid 93   and name HG2 ))
       3.500     1.500     1.500 peak   625 spectrum    1 weight  0.10000E+01 volume  0.40000E-03 ppm1      8.324 ppm2      2.430 CV     1
  ASSI {  626}
    (( segid "    " and resid 94   and name HN  ))
    (( segid "    " and resid 92   and name HB2 ))
       3.400     1.400     1.400 peak   626 spectrum    1 weight  0.10000E+01 volume  0.29306E-02 ppm1      8.324 ppm2      2.007 CV     1
  ASSI {  629}
    (( segid "    " and resid 94   and name HN  ))
    (( segid "    " and resid 95   and name HN  ))
       4.100     2.100     1.900 peak   629 spectrum    1 weight  0.10000E+01 volume  0.26235E-03 ppm1      8.322 ppm2      8.621 CV     1
  ASSI {  631}
    (( segid "    " and resid 94   and name HN  ))
    (( segid "    " and resid 93   and name HA  ))
       3.400     1.400     1.400 peak   631 spectrum    1 weight  0.10000E+01 volume  0.10034E-02 ppm1      8.322 ppm2      4.663 CV     1
  ASSI {  632}
    (( segid "    " and resid 94   and name HN  ))
    (( segid "    " and resid 94   and name HA1 ))
       2.700     0.900     0.900 peak   632 spectrum    1 weight  0.10000E+01 volume  0.46931E-02 ppm1      8.322 ppm2      3.816 CV     1
  ASSI {  633}
    (( segid "    " and resid 94   and name HN  ))
    (( segid "    " and resid 93   and name HB2 ))
       5.000     3.100     1.000 peak   633 spectrum    1 weight  0.10000E+01 volume  0.19352E-03 ppm1      8.320 ppm2      2.190 CV     1
  ASSI {  634}
    (( segid "    " and resid 94   and name HN  ))
    (( segid "    " and resid 91   and name HN  ))
       6.000     4.800     0.000 peak   634 spectrum    1 weight  0.10000E+01 volume  0.26237E-04 ppm1      8.318 ppm2      8.154 CV     1
  ASSI {  635}
    (( segid "    " and resid 3    and name HN  ))
    (( segid "    " and resid 2    and name HN  ))
       3.100     1.200     1.200 peak   635 spectrum    1 weight  0.10000E+01 volume  0.11709E-02 ppm1      8.294 ppm2      8.020 CV     1
  ASSI {  636}
    (( segid "    " and resid 3    and name HN  ))
    (( segid "    " and resid 3    and name HA  ))
       1.900     1.900     4.100 peak   636 spectrum    1 weight  0.10000E+01 volume  0.27276E-01 ppm1      8.297 ppm2      4.099 CV     1
  ASSI {  637}
    (( segid "    " and resid 3    and name HN  ))
    (( segid "    " and resid 3    and name HB  ))
       2.200     0.600     0.600 peak   637 spectrum    1 weight  0.10000E+01 volume  0.90193E-02 ppm1      8.297 ppm2      2.002 CV     1
  ASSI {  638}
    (( segid "    " and resid 3    and name HN  ))
    (  segid "    " and resid 3    and name HG2%)
       2.400     2.400     3.600 peak   638 spectrum    1 weight  0.10000E+01 volume  0.10105E-01 ppm1      8.297 ppm2      0.909 CV     1
  ASSI {  639}
    (( segid "    " and resid 22   and name HN  ))
    (( segid "    " and resid 23   and name HD1 ))
       4.800     2.900     1.200 peak   639 spectrum    1 weight  0.10000E+01 volume  0.29073E-03 ppm1      8.297 ppm2      3.629 CV     1
  ASSI {  641}
    (( segid "    " and resid 22   and name HN  ))
    (( segid "    " and resid 22   and name HA  ))
       2.600     0.900     0.900 peak   641 spectrum    1 weight  0.10000E+01 volume  0.28315E-02 ppm1      8.299 ppm2      4.421 CV     1
  ASSI {  642}
    (( segid "    " and resid 22   and name HN  ))
    (( segid "    " and resid 21   and name HA  ))
       1.900     0.500     0.500 peak   642 spectrum    1 weight  0.10000E+01 volume  0.16232E-01 ppm1      8.299 ppm2      4.341 CV     1
  ASSI {  643}
    (( segid "    " and resid 22   and name HN  ))
    (( segid "    " and resid 22   and name HB  ))
       2.200     0.600     0.600 peak   643 spectrum    1 weight  0.10000E+01 volume  0.94059E-02 ppm1      8.299 ppm2      2.025 CV     1
  ASSI {  644}
    (( segid "    " and resid 22   and name HN  ))
    (  segid "    " and resid 22   and name HG2%)
       2.400     2.400     3.600 peak   644 spectrum    1 weight  0.10000E+01 volume  0.70180E-02 ppm1      8.299 ppm2      0.900 CV     1
  ASSI {  645}
    (( segid "    " and resid 22   and name HN  ))
    (( segid "    " and resid 23   and name HD2 ))
       6.000     6.000     0.000 peak   645 spectrum    1 weight  0.10000E+01 volume  0.34994E-04 ppm1      8.297 ppm2      3.889 CV     1
  ASSI {  646}
    (( segid "    " and resid 22   and name HN  ))
    (( segid "    " and resid 21   and name HG2 ))
       4.300     2.300     1.700 peak   646 spectrum    1 weight  0.10000E+01 volume  0.63894E-03 ppm1      8.296 ppm2      2.262 CV     1
  ASSI {  647}
    (( segid "    " and resid 22   and name HN  ))
    (( segid "    " and resid 21   and name HB1 ))
       3.800     1.800     1.800 peak   647 spectrum    1 weight  0.10000E+01 volume  0.12380E-02 ppm1      8.295 ppm2      1.951 CV     1
  ASSI {  650}
    (( segid "    " and resid 14   and name HN  ))
    (( segid "    " and resid 13   and name HA  ))
       1.900     0.500     0.500 peak   650 spectrum    1 weight  0.10000E+01 volume  0.18356E-01 ppm1      8.290 ppm2      4.403 CV     1
  ASSI {  651}
    (( segid "    " and resid 14   and name HN  ))
    (( segid "    " and resid 14   and name HA  ))
       2.600     0.900     0.900 peak   651 spectrum    1 weight  0.10000E+01 volume  0.34728E-02 ppm1      8.289 ppm2      4.118 CV     1
  ASSI {  652}
    (( segid "    " and resid 14   and name HN  ))
    (( segid "    " and resid 14   and name HB  ))
       2.400     0.700     0.700 peak   652 spectrum    1 weight  0.10000E+01 volume  0.56463E-02 ppm1      8.290 ppm2      2.062 CV     1
  ASSI {  653}
    (( segid "    " and resid 14   and name HN  ))
    (( segid "    " and resid 13   and name HG2 ))
       4.000     2.000     2.000 peak   653 spectrum    1 weight  0.10000E+01 volume  0.89891E-03 ppm1      8.289 ppm2      1.615 CV     1
  ASSI {  654}
    (( segid "    " and resid 14   and name HN  ))
    (  segid "    " and resid 14   and name HG2%)
       2.400     2.400     3.600 peak   654 spectrum    1 weight  0.10000E+01 volume  0.67059E-02 ppm1      8.290 ppm2      0.949 CV     1
  ASSI {  655}
    (( segid "    " and resid 14   and name HN  ))
    (( segid "    " and resid 13   and name HB2 ))
       3.200     1.300     1.300 peak   655 spectrum    1 weight  0.10000E+01 volume  0.26207E-02 ppm1      8.289 ppm2      1.793 CV     1
  ASSI {  656}
    (( segid "    " and resid 14   and name HN  ))
    (( segid "    " and resid 13   and name HG1 ))
       4.300     2.300     1.700 peak   656 spectrum    1 weight  0.10000E+01 volume  0.49042E-03 ppm1      8.289 ppm2      1.578 CV     1
  ASSI {  657}
    (( segid "    " and resid 36   and name HN  ))
    (( segid "    " and resid 37   and name HN  ))
       2.900     1.000     1.000 peak   657 spectrum    1 weight  0.10000E+01 volume  0.15878E-02 ppm1      8.286 ppm2      7.278 CV     1
  ASSI {  660}
    (( segid "    " and resid 36   and name HN  ))
    (( segid "    " and resid 37   and name HB2 ))
       4.800     2.900     1.200 peak   660 spectrum    1 weight  0.10000E+01 volume  0.21358E-03 ppm1      8.276 ppm2      3.209 CV     1
  ASSI {  661}
    (( segid "    " and resid 36   and name HN  ))
    (( segid "    " and resid 34   and name HB  ))
       5.500     3.800     0.500 peak   661 spectrum    1 weight  0.10000E+01 volume  0.11920E-03 ppm1      8.299 ppm2      1.908 CV     1
  ASSI {  663}
    (( segid "    " and resid 36   and name HN  ))
    (( segid "    " and resid 36   and name HA2 ))
       2.700     0.900     0.900 peak   663 spectrum    1 weight  0.10000E+01 volume  0.54223E-02 ppm1      8.285 ppm2      3.834 CV     1
  ASSI {  664}
    (( segid "    " and resid 36   and name HN  ))
    (( segid "    " and resid 36   and name HA1 ))
       2.500     0.800     0.800 peak   664 spectrum    1 weight  0.10000E+01 volume  0.39030E-02 ppm1      8.286 ppm2      3.504 CV     1
  ASSI {  665}
    (( segid "    " and resid 36   and name HN  ))
    (( segid "    " and resid 41   and name HN  ))
       5.300     3.500     0.700 peak   665 spectrum    1 weight  0.10000E+01 volume  0.13057E-03 ppm1      8.283 ppm2      7.901 CV     1
  ASSI {  666}
    (( segid "    " and resid 36   and name HN  ))
    (( segid "    " and resid 35   and name HA  ))
       3.600     1.600     1.600 peak   666 spectrum    1 weight  0.10000E+01 volume  0.66927E-03 ppm1      8.284 ppm2      4.298 CV     1
  ASSI {  667}
    (( segid "    " and resid 36   and name HN  ))
    (( segid "    " and resid 33   and name HA  ))
       3.100     1.200     1.200 peak   667 spectrum    1 weight  0.10000E+01 volume  0.12751E-02 ppm1      8.285 ppm2      4.255 CV     1
  ASSI {  668}
    (( segid "    " and resid 36   and name HN  ))
    (  segid "    " and resid 33   and name HB% )
       4.400     2.400     1.600 peak   668 spectrum    1 weight  0.10000E+01 volume  0.35049E-03 ppm1      8.284 ppm2      1.513 CV     1
  ASSI {  669}
    (( segid "    " and resid 36   and name HN  ))
    (  segid "    " and resid 35   and name HB% )
       2.800     2.800     3.200 peak   669 spectrum    1 weight  0.10000E+01 volume  0.30164E-02 ppm1      8.284 ppm2      0.481 CV     1
  ASSI {  670}
    (( segid "    " and resid 36   and name HN  ))
    (( segid "    " and resid 40   and name HN  ))
       6.000     6.000     0.000 peak   670 spectrum    1 weight  0.10000E+01 volume  0.58240E-05 ppm1      8.284 ppm2      7.722 CV     1
  ASSI {  671}
    (( segid "    " and resid 12   and name HN  ))
    (( segid "    " and resid 13   and name HN  ))
       3.800     1.800     1.800 peak   671 spectrum    1 weight  0.10000E+01 volume  0.12689E-02 ppm1      8.260 ppm2      8.469 CV     1
  ASSI {  672}
    (( segid "    " and resid 12   and name HN  ))
    (( segid "    " and resid 11   and name HN  ))
       2.900     1.000     1.000 peak   672 spectrum    1 weight  0.10000E+01 volume  0.20306E-02 ppm1      8.263 ppm2      8.106 CV     1
  ASSI {  673}
    (( segid "    " and resid 12   and name HN  ))
    (( segid "    " and resid 12   and name HA  ))
       1.800     0.400     0.400 peak   673 spectrum    1 weight  0.10000E+01 volume  0.24874E-01 ppm1      8.262 ppm2      4.078 CV     1
  ASSI {  674}
    (( segid "    " and resid 12   and name HN  ))
    (( segid "    " and resid 12   and name HB  ))
       2.300     0.600     0.600 peak   674 spectrum    1 weight  0.10000E+01 volume  0.10255E-01 ppm1      8.262 ppm2      2.005 CV     1
  ASSI {  675}
    (( segid "    " and resid 12   and name HN  ))
    (  segid "    " and resid 12   and name HG2%)
       2.600     2.600     3.400 peak   675 spectrum    1 weight  0.10000E+01 volume  0.11570E-01 ppm1      8.262 ppm2      0.910 CV     1
  ASSI {  677}
    (( segid "    " and resid 82   and name HE21))
    (( segid "    " and resid 79   and name HA  ))
       4.500     2.500     1.500 peak   677 spectrum    1 weight  0.10000E+01 volume  0.29314E-03 ppm1      8.256 ppm2      3.234 CV     1
  ASSI {  678}
    (( segid "    " and resid 82   and name HE21))
    (( segid "    " and resid 82   and name HG2 ))
       6.000     5.600     0.000 peak   678 spectrum    1 weight  0.10000E+01 volume  0.86452E-05 ppm1      8.250 ppm2      2.749 CV     1
  ASSI {  679}
    (( segid "    " and resid 82   and name HE21))
    (( segid "    " and resid 43   and name HA  ))
       5.400     3.700     0.600 peak   679 spectrum    1 weight  0.10000E+01 volume  0.12069E-03 ppm1      8.259 ppm2      3.852 CV     1
  ASSI {  680}
    (( segid "    " and resid 82   and name HE21))
    (( segid "    " and resid 43   and name HB2 ))
       6.000     5.100     0.000 peak   680 spectrum    1 weight  0.10000E+01 volume  0.13609E-03 ppm1      8.248 ppm2      3.535 CV     1
  ASSI {  682}
    (( segid "    " and resid 25   and name HN  ))
    (( segid "    " and resid 24   and name HA  ))
       2.100     0.600     0.600 peak   682 spectrum    1 weight  0.10000E+01 volume  0.11297E-01 ppm1      8.242 ppm2      4.426 CV     1
  ASSI {  683}
    (( segid "    " and resid 25   and name HN  ))
    (( segid "    " and resid 25   and name HA  ))
       2.800     1.000     1.000 peak   683 spectrum    1 weight  0.10000E+01 volume  0.22105E-02 ppm1      8.241 ppm2      4.071 CV     1
  ASSI {  684}
    (( segid "    " and resid 25   and name HN  ))
    (( segid "    " and resid 24   and name HD2 ))
       3.800     1.800     1.800 peak   684 spectrum    1 weight  0.10000E+01 volume  0.16325E-03 ppm1      8.241 ppm2      3.669 CV     1
  ASSI {  685}
    (( segid "    " and resid 25   and name HN  ))
    (( segid "    " and resid 24   and name HB2 ))
       3.200     1.200     1.200 peak   685 spectrum    1 weight  0.10000E+01 volume  0.14044E-02 ppm1      8.245 ppm2      2.282 CV     1
  ASSI {  686}
    (( segid "    " and resid 25   and name HN  ))
    (( segid "    " and resid 25   and name HB  ))
       2.300     0.600     0.600 peak   686 spectrum    1 weight  0.10000E+01 volume  0.70673E-02 ppm1      8.242 ppm2      2.018 CV     1
  ASSI {  687}
    (( segid "    " and resid 25   and name HN  ))
    (( segid "    " and resid 24   and name HB1 ))
       3.200     1.300     1.300 peak   687 spectrum    1 weight  0.10000E+01 volume  0.25405E-02 ppm1      8.241 ppm2      1.851 CV     1
  ASSI {  688}
    (( segid "    " and resid 25   and name HN  ))
    (  segid "    " and resid 25   and name HG2%)
       2.500     2.500     3.500 peak   688 spectrum    1 weight  0.10000E+01 volume  0.71957E-02 ppm1      8.241 ppm2      0.946 CV     1
  ASSI {  690}
    (( segid "    " and resid 50   and name HN  ))
    (( segid "    " and resid 51   and name HN  ))
       2.500     0.800     0.800 peak   690 spectrum    1 weight  0.10000E+01 volume  0.39837E-02 ppm1      8.209 ppm2      7.543 CV     1
  ASSI {  691}
    (( segid "    " and resid 50   and name HN  ))
    (( segid "    " and resid 49   and name HA  ))
       3.100     1.200     1.200 peak   691 spectrum    1 weight  0.10000E+01 volume  0.16080E-02 ppm1      8.212 ppm2      4.622 CV     1
  ASSI {  692}
    (( segid "    " and resid 50   and name HN  ))
    (( segid "    " and resid 48   and name HA2 ))
       4.000     2.000     2.000 peak   692 spectrum    1 weight  0.10000E+01 volume  0.22369E-03 ppm1      8.212 ppm2      4.228 CV     1
  ASSI {  693}
    (( segid "    " and resid 50   and name HN  ))
    (( segid "    " and resid 50   and name HA1 ))
       2.700     0.900     0.900 peak   693 spectrum    1 weight  0.10000E+01 volume  0.58871E-02 ppm1      8.210 ppm2      3.940 CV     1
  ASSI {  694}
    (( segid "    " and resid 50   and name HN  ))
    (( segid "    " and resid 50   and name HA2 ))
       2.300     0.700     0.700 peak   694 spectrum    1 weight  0.10000E+01 volume  0.56693E-02 ppm1      8.210 ppm2      3.300 CV     1
  ASSI {  696}
    (( segid "    " and resid 50   and name HN  ))
    (  segid "    " and resid 51   and name HD% )
       4.700     2.800     1.300 peak   696 spectrum    1 weight  0.10000E+01 volume  0.33901E-03 ppm1      8.211 ppm2      6.921 CV     1
  ASSI {  697}
    (( segid "    " and resid 50   and name HN  ))
    (( segid "    " and resid 49   and name HB1 ))
       4.400     2.400     1.600 peak   697 spectrum    1 weight  0.10000E+01 volume  0.35919E-03 ppm1      8.212 ppm2      2.710 CV     1
  ASSI {  698}
    (( segid "    " and resid 50   and name HN  ))
    (  segid "    " and resid 52   and name HE% )
       6.000     6.000     0.000 peak   698 spectrum    1 weight  0.10000E+01 volume  0.86337E-05 ppm1      8.207 ppm2      6.742 CV     1
  ASSI {  699}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 79   and name HD1 ))
       5.400     3.600     0.600 peak   699 spectrum    1 weight  0.10000E+01 volume  0.16009E-03 ppm1      8.178 ppm2      2.257 CV     1
  ASSI {  700}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 82   and name HN  ))
       4.300     2.300     1.700 peak   700 spectrum    1 weight  0.10000E+01 volume  0.26978E-03 ppm1      8.173 ppm2      8.635 CV     1
  ASSI {  701}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 81   and name HN  ))
       3.100     1.200     1.200 peak   701 spectrum    1 weight  0.10000E+01 volume  0.97728E-03 ppm1      8.174 ppm2      7.563 CV     1
  ASSI {  702}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 79   and name HB2 ))
       2.700     0.900     0.900 peak   702 spectrum    1 weight  0.10000E+01 volume  0.13941E-02 ppm1      8.176 ppm2      0.968 CV     1
  ASSI {  703}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 79   and name HA  ))
       3.500     1.500     1.500 peak   703 spectrum    1 weight  0.10000E+01 volume  0.75927E-03 ppm1      8.178 ppm2      3.256 CV     1
  ASSI {  705}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 78   and name HB  ))
       3.400     1.500     1.500 peak   705 spectrum    1 weight  0.10000E+01 volume  0.10736E-02 ppm1      8.176 ppm2      4.608 CV     1
  ASSI {  706}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 78   and name HA  ))
       6.000     6.000     0.000 peak   706 spectrum    1 weight  0.10000E+01 volume  0.39374E-05 ppm1      8.174 ppm2      4.218 CV     1
  ASSI {  707}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 80   and name HA  ))
       2.900     1.000     1.000 peak   707 spectrum    1 weight  0.10000E+01 volume  0.16134E-02 ppm1      8.174 ppm2      3.460 CV     1
  ASSI {  708}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 79   and name HD2 ))
       5.500     3.800     0.500 peak   708 spectrum    1 weight  0.10000E+01 volume  0.17861E-04 ppm1      8.173 ppm2      2.631 CV     1
  ASSI {  709}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 80   and name HG1 ))
       3.500     1.500     1.500 peak   709 spectrum    1 weight  0.10000E+01 volume  0.16500E-02 ppm1      8.174 ppm2      2.408 CV     1
  ASSI {  710}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 80   and name HB2 ))
       3.200     1.300     1.300 peak   710 spectrum    1 weight  0.10000E+01 volume  0.38385E-02 ppm1      8.175 ppm2      1.934 CV     1
  ASSI {  711}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 80   and name HB1 ))
       2.700     0.900     0.900 peak   711 spectrum    1 weight  0.10000E+01 volume  0.19321E-02 ppm1      8.175 ppm2      1.746 CV     1
  ASSI {  712}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 79   and name HG1 ))
       3.600     1.600     1.600 peak   712 spectrum    1 weight  0.10000E+01 volume  0.14951E-02 ppm1      8.175 ppm2      0.570 CV     1
  ASSI {  714}
    (( segid "    " and resid 80   and name HN  ))
    (( segid "    " and resid 43   and name HH2 ))
       6.000     6.000     0.000 peak   714 spectrum    1 weight  0.10000E+01 volume  0.16114E-05 ppm1      8.168 ppm2      6.787 CV     1
  ASSI {  715}
    (( segid "    " and resid 80   and name HN  ))
    (  segid "    " and resid 78   and name HG2%)
       4.300     2.300     1.700 peak   715 spectrum    1 weight  0.10000E+01 volume  0.72905E-03 ppm1      8.173 ppm2      1.316 CV     1
  ASSI {  716}
    (( segid "    " and resid 91   and name HN  ))
    (( segid "    " and resid 98   and name HZ3 ))
       5.300     3.500     0.700 peak   716 spectrum    1 weight  0.10000E+01 volume  0.15651E-03 ppm1      8.177 ppm2      7.075 CV     1
  ASSI {  717}
    (( segid "    " and resid 91   and name HN  ))
    (( segid "    " and resid 92   and name HN  ))
       2.700     0.900     0.900 peak   717 spectrum    1 weight  0.10000E+01 volume  0.16365E-02 ppm1      8.169 ppm2      7.809 CV     1
  ASSI {  718}
    (( segid "    " and resid 91   and name HN  ))
    (( segid "    " and resid 90   and name HA  ))
       3.200     1.300     1.300 peak   718 spectrum    1 weight  0.10000E+01 volume  0.84949E-03 ppm1      8.169 ppm2      4.239 CV     1
  ASSI {  719}
    (( segid "    " and resid 91   and name HN  ))
    (( segid "    " and resid 91   and name HA  ))
       2.800     1.000     1.000 peak   719 spectrum    1 weight  0.10000E+01 volume  0.22076E-02 ppm1      8.165 ppm2      4.026 CV     1
  ASSI {  720}
    (( segid "    " and resid 91   and name HN  ))
    (( segid "    " and resid 91   and name HB1 ))
       2.300     0.700     0.700 peak   720 spectrum    1 weight  0.10000E+01 volume  0.50551E-02 ppm1      8.166 ppm2      1.986 CV     1
  ASSI {  721}
    (( segid "    " and resid 91   and name HN  ))
    (( segid "    " and resid 90   and name HG2 ))
       3.000     1.100     1.100 peak   721 spectrum    1 weight  0.10000E+01 volume  0.32939E-02 ppm1      8.167 ppm2      1.798 CV     1
  ASSI {  723}
    (( segid "    " and resid 91   and name HN  ))
    (  segid "    " and resid 91   and name HD2%)
       3.500     1.500     1.500 peak   723 spectrum    1 weight  0.10000E+01 volume  0.12301E-02 ppm1      8.167 ppm2      0.910 CV     1
  ASSI {  725}
    (( segid "    " and resid 91   and name HN  ))
    (( segid "    " and resid 88   and name HA  ))
       3.400     1.400     1.400 peak   725 spectrum    1 weight  0.10000E+01 volume  0.74200E-03 ppm1      8.163 ppm2      3.677 CV     1
  ASSI {  728}
    (( segid "    " and resid 91   and name HN  ))
    (( segid "    " and resid 90   and name HG1 ))
       2.300     2.300     3.700 peak   728 spectrum    1 weight  0.10000E+01 volume  0.38809E-02 ppm1      8.165 ppm2      1.641 CV     1
  ASSI {  729}
    (( segid "    " and resid 91   and name HN  ))
    (  segid "    " and resid 91   and name HD1%)
       3.400     1.400     1.400 peak   729 spectrum    1 weight  0.10000E+01 volume  0.27180E-02 ppm1      8.166 ppm2      0.949 CV     1
  ASSI {  730}
    (( segid "    " and resid 91   and name HN  ))
    (( segid "    " and resid 93   and name HN  ))
       6.000     5.200     0.000 peak   730 spectrum    1 weight  0.10000E+01 volume  0.35008E-04 ppm1      8.163 ppm2      8.818 CV     1
  ASSI {  731}
    (( segid "    " and resid 91   and name HN  ))
    (( segid "    " and resid 90   and name HD2 ))
       4.700     2.800     1.300 peak   731 spectrum    1 weight  0.10000E+01 volume  0.21518E-03 ppm1      8.163 ppm2      2.467 CV     1
  ASSI {  733}
    (( segid "    " and resid 62   and name HN  ))
    (( segid "    " and resid 62   and name HE3 ))
       6.000     6.000     0.000 peak   733 spectrum    1 weight  0.10000E+01 volume  0.18091E-04 ppm1      8.132 ppm2      6.158 CV     1
  ASSI {  734}
    (( segid "    " and resid 62   and name HN  ))
    (( segid "    " and resid 62   and name HB1 ))
       2.500     0.800     0.800 peak   734 spectrum    1 weight  0.10000E+01 volume  0.31703E-02 ppm1      8.130 ppm2      3.086 CV     1
  ASSI {  735}
    (( segid "    " and resid 62   and name HN  ))
    (( segid "    " and resid 63   and name HB1 ))
       4.800     2.900     1.200 peak   735 spectrum    1 weight  0.10000E+01 volume  0.28231E-03 ppm1      8.128 ppm2      2.081 CV     1
  ASSI {  736}
    (( segid "    " and resid 62   and name HN  ))
    (  segid "    " and resid 61   and name HG2%)
       3.600     1.600     1.600 peak   736 spectrum    1 weight  0.10000E+01 volume  0.91037E-03 ppm1      8.131 ppm2      1.412 CV     1
  ASSI {  737}
    (( segid "    " and resid 62   and name HN  ))
    (  segid "    " and resid 85   and name HG1%)
       6.000     5.200     0.000 peak   737 spectrum    1 weight  0.10000E+01 volume  0.64130E-04 ppm1      8.129 ppm2      0.413 CV     1
  ASSI {  738}
    (( segid "    " and resid 62   and name HN  ))
    (( segid "    " and resid 62   and name HD1 ))
       5.300     3.600     0.700 peak   738 spectrum    1 weight  0.10000E+01 volume  0.18873E-03 ppm1      8.122 ppm2      6.746 CV     1
  ASSI {  739}
    (( segid "    " and resid 62   and name HN  ))
    (( segid "    " and resid 61   and name HB  ))
       3.400     1.400     1.400 peak   739 spectrum    1 weight  0.10000E+01 volume  0.59013E-03 ppm1      8.129 ppm2      4.454 CV     1
  ASSI {  740}
    (( segid "    " and resid 62   and name HN  ))
    (( segid "    " and resid 59   and name HA  ))
       3.700     1.800     1.800 peak   740 spectrum    1 weight  0.10000E+01 volume  0.67454E-03 ppm1      8.130 ppm2      4.133 CV     1
  ASSI {  742}
    (( segid "    " and resid 62   and name HN  ))
    (( segid "    " and resid 62   and name HA  ))
       2.800     1.000     1.000 peak   742 spectrum    1 weight  0.10000E+01 volume  0.20001E-02 ppm1      8.129 ppm2      3.834 CV     1
  ASSI {  743}
    (( segid "    " and resid 62   and name HN  ))
    (( segid "    " and resid 62   and name HB2 ))
       2.700     0.900     0.900 peak   743 spectrum    1 weight  0.10000E+01 volume  0.23389E-02 ppm1      8.129 ppm2      3.480 CV     1
  ASSI {  747}
    (( segid "    " and resid 11   and name HN  ))
    (( segid "    " and resid 9    and name HG2 ))
       3.000     3.000     3.000 peak   747 spectrum    1 weight  0.10000E+01 volume  0.65414E-03 ppm1      8.118 ppm2      2.235 CV     1
  ASSI {  750}
    (( segid "    " and resid 11   and name HN  ))
    (( segid "    " and resid 10   and name HA  ))
       2.000     0.500     0.500 peak   750 spectrum    1 weight  0.10000E+01 volume  0.15627E-01 ppm1      8.106 ppm2      4.318 CV     1
  ASSI {  751}
    (( segid "    " and resid 11   and name HN  ))
    (( segid "    " and resid 11   and name HA  ))
       2.600     0.900     0.900 peak   751 spectrum    1 weight  0.10000E+01 volume  0.40671E-02 ppm1      8.106 ppm2      4.079 CV     1
  ASSI {  752}
    (( segid "    " and resid 11   and name HN  ))
    (( segid "    " and resid 11   and name HB  ))
       2.200     0.600     0.600 peak   752 spectrum    1 weight  0.10000E+01 volume  0.87785E-02 ppm1      8.106 ppm2      2.012 CV     1
  ASSI {  753}
    (( segid "    " and resid 11   and name HN  ))
    (  segid "    " and resid 10   and name HB% )
       3.300     1.300     1.300 peak   753 spectrum    1 weight  0.10000E+01 volume  0.38187E-02 ppm1      8.106 ppm2      1.370 CV     1
  ASSI {  754}
    (( segid "    " and resid 11   and name HN  ))
    (  segid "    " and resid 11   and name HG2%)
       2.500     0.800     0.800 peak   754 spectrum    1 weight  0.10000E+01 volume  0.82821E-02 ppm1      8.106 ppm2      0.929 CV     1
  ASSI {  755}
    (( segid "    " and resid 67   and name HN  ))
    (( segid "    " and resid 62   and name HE1 ))
       5.800     4.200     0.200 peak   755 spectrum    1 weight  0.10000E+01 volume  0.60159E-04 ppm1      8.104 ppm2      9.413 CV     1
  ASSI {  756}
    (( segid "    " and resid 67   and name HN  ))
    (( segid "    " and resid 66   and name HN  ))
       2.900     1.000     1.000 peak   756 spectrum    1 weight  0.10000E+01 volume  0.15116E-02 ppm1      8.107 ppm2      7.021 CV     1
  ASSI {  757}
    (( segid "    " and resid 67   and name HN  ))
    (( segid "    " and resid 63   and name HB1 ))
       5.400     3.600     0.600 peak   757 spectrum    1 weight  0.10000E+01 volume  0.25433E-03 ppm1      8.110 ppm2      2.092 CV     1
  ASSI {  758}
    (( segid "    " and resid 67   and name HN  ))
    (  segid "    " and resid 85   and name HG2%)
       3.800     1.800     1.800 peak   758 spectrum    1 weight  0.10000E+01 volume  0.12353E-02 ppm1      8.108 ppm2      0.525 CV     1
  ASSI {  759}
    (( segid "    " and resid 67   and name HN  ))
    (  segid "    " and resid 85   and name HG1%)
       3.300     1.300     1.300 peak   759 spectrum    1 weight  0.10000E+01 volume  0.91575E-03 ppm1      8.107 ppm2      0.420 CV     1
  ASSI {  761}
    (( segid "    " and resid 67   and name HN  ))
    (( segid "    " and resid 69   and name HN  ))
       3.300     1.400     1.400 peak   761 spectrum    1 weight  0.10000E+01 volume  0.18426E-02 ppm1      8.106 ppm2      7.102 CV     1
  ASSI {  763}
    (( segid "    " and resid 67   and name HN  ))
    (( segid "    " and resid 66   and name HA2 ))
       3.100     1.200     1.200 peak   763 spectrum    1 weight  0.10000E+01 volume  0.97657E-03 ppm1      8.105 ppm2      4.003 CV     1
  ASSI {  764}
    (( segid "    " and resid 67   and name HN  ))
    (( segid "    " and resid 66   and name HA1 ))
       3.400     1.400     1.400 peak   764 spectrum    1 weight  0.10000E+01 volume  0.21077E-02 ppm1      8.106 ppm2      3.674 CV     1
  ASSI {  765}
    (( segid "    " and resid 67   and name HN  ))
    (( segid "    " and resid 67   and name HA2 ))
       2.700     0.900     0.900 peak   765 spectrum    1 weight  0.10000E+01 volume  0.26270E-02 ppm1      8.104 ppm2      2.377 CV     1
  ASSI {  766}
    (( segid "    " and resid 67   and name HN  ))
    (  segid "    " and resid 68   and name HD1%)
       4.100     2.100     1.900 peak   766 spectrum    1 weight  0.10000E+01 volume  0.47971E-03 ppm1      8.104 ppm2      0.989 CV     1
  ASSI {  768}
    (( segid "    " and resid 67   and name HN  ))
    (( segid "    " and resid 68   and name HA  ))
       6.000     5.500     0.000 peak   768 spectrum    1 weight  0.10000E+01 volume  0.41494E-04 ppm1      8.115 ppm2      4.319 CV     1
  ASSI {  769}
    (( segid "    " and resid 67   and name HN  ))
    (( segid "    " and resid 65   and name HB2 ))
       6.000     6.000     0.000 peak   769 spectrum    1 weight  0.10000E+01 volume  0.14402E-05 ppm1      8.101 ppm2      2.923 CV     1
  ASSI {  773}
    (( segid "    " and resid 16   and name HN  ))
    (( segid "    " and resid 16   and name HA  ))
       2.700     0.900     0.900 peak   773 spectrum    1 weight  0.10000E+01 volume  0.35498E-02 ppm1      8.057 ppm2      4.308 CV     1
  ASSI {  774}
    (( segid "    " and resid 16   and name HN  ))
    (( segid "    " and resid 16   and name HB  ))
       2.500     0.800     0.800 peak   774 spectrum    1 weight  0.10000E+01 volume  0.41804E-02 ppm1      8.057 ppm2      4.156 CV     1
  ASSI {  775}
    (( segid "    " and resid 16   and name HN  ))
    (( segid "    " and resid 15   and name HA2 ))
       2.000     0.500     0.500 peak   775 spectrum    1 weight  0.10000E+01 volume  0.14599E-01 ppm1      8.057 ppm2      4.006 CV     1
  ASSI {  776}
    (( segid "    " and resid 16   and name HN  ))
    (  segid "    " and resid 16   and name HG2%)
       3.400     1.400     1.400 peak   776 spectrum    1 weight  0.10000E+01 volume  0.28691E-02 ppm1      8.057 ppm2      1.178 CV     1
  ASSI {  777}
    (( segid "    " and resid 16   and name HN  ))
    (  segid "    " and resid 14   and name HG1%)
       4.400     2.400     1.600 peak   777 spectrum    1 weight  0.10000E+01 volume  0.32614E-03 ppm1      8.050 ppm2      0.940 CV     1
  ASSI {  778}
    (( segid "    " and resid 30   and name HN  ))
    (  segid "    " and resid 33   and name HB% )
       5.500     3.800     0.500 peak   778 spectrum    1 weight  0.10000E+01 volume  0.88388E-04 ppm1      8.024 ppm2      1.519 CV     1
  ASSI {  779}
    (( segid "    " and resid 30   and name HN  ))
    (( segid "    " and resid 30   and name HG12))
       2.600     0.800     0.800 peak   779 spectrum    1 weight  0.10000E+01 volume  0.10743E-02 ppm1      8.023 ppm2      1.152 CV     1
  ASSI {  780}
    (( segid "    " and resid 30   and name HN  ))
    (  segid "    " and resid 30   and name HD1%)
       3.600     1.600     1.600 peak   780 spectrum    1 weight  0.10000E+01 volume  0.81149E-03 ppm1      8.024 ppm2      0.510 CV     1
  ASSI {  782}
    (( segid "    " and resid 30   and name HN  ))
    (( segid "    " and resid 31   and name HN  ))
       2.600     0.900     0.900 peak   782 spectrum    1 weight  0.10000E+01 volume  0.18386E-02 ppm1      8.022 ppm2      7.208 CV     1
  ASSI {  783}
    (( segid "    " and resid 30   and name HN  ))
    (( segid "    " and resid 29   and name HA  ))
       2.900     1.100     1.100 peak   783 spectrum    1 weight  0.10000E+01 volume  0.20842E-02 ppm1      8.023 ppm2      4.417 CV     1
  ASSI {  784}
    (( segid "    " and resid 30   and name HN  ))
    (( segid "    " and resid 29   and name HB2 ))
       2.500     2.500     3.500 peak   784 spectrum    1 weight  0.10000E+01 volume  0.22894E-02 ppm1      8.022 ppm2      3.988 CV     1
  ASSI {  785}
    (( segid "    " and resid 30   and name HN  ))
    (( segid "    " and resid 30   and name HA  ))
       2.600     0.800     0.800 peak   785 spectrum    1 weight  0.10000E+01 volume  0.23040E-02 ppm1      8.022 ppm2      3.870 CV     1
  ASSI {  786}
    (( segid "    " and resid 30   and name HN  ))
    (( segid "    " and resid 32   and name HB1 ))
       6.000     6.000     0.000 peak   786 spectrum    1 weight  0.10000E+01 volume  0.17742E-04 ppm1      8.024 ppm2      2.788 CV     1
  ASSI {  787}
    (( segid "    " and resid 30   and name HN  ))
    (( segid "    " and resid 30   and name HB  ))
       2.800     1.000     1.000 peak   787 spectrum    1 weight  0.10000E+01 volume  0.30135E-02 ppm1      8.023 ppm2      1.646 CV     1
  ASSI {  788}
    (( segid "    " and resid 30   and name HN  ))
    (( segid "    " and resid 30   and name HG11))
       3.800     1.800     1.800 peak   788 spectrum    1 weight  0.10000E+01 volume  0.98079E-03 ppm1      8.022 ppm2      0.846 CV     1
  ASSI {  789}
    (( segid "    " and resid 30   and name HN  ))
    (  segid "    " and resid 30   and name HG2%)
       3.200     1.300     1.300 peak   789 spectrum    1 weight  0.10000E+01 volume  0.22636E-02 ppm1      8.022 ppm2      0.090 CV     1
  ASSI {  791}
    (( segid "    " and resid 2    and name HN  ))
    (( segid "    " and resid 1    and name HA  ))
       2.200     0.600     0.600 peak   791 spectrum    1 weight  0.10000E+01 volume  0.82728E-02 ppm1      8.018 ppm2      4.735 CV     1
  ASSI {  792}
    (( segid "    " and resid 2    and name HN  ))
    (( segid "    " and resid 2    and name HA  ))
       2.700     0.900     0.900 peak   792 spectrum    1 weight  0.10000E+01 volume  0.32429E-02 ppm1      8.018 ppm2      4.100 CV     1
  ASSI {  793}
    (( segid "    " and resid 2    and name HN  ))
    (( segid "    " and resid 2    and name HB  ))
       2.400     0.700     0.700 peak   793 spectrum    1 weight  0.10000E+01 volume  0.55585E-02 ppm1      8.018 ppm2      2.019 CV     1
  ASSI {  794}
    (( segid "    " and resid 2    and name HN  ))
    (  segid "    " and resid 2    and name HG2%)
       2.600     2.600     3.400 peak   794 spectrum    1 weight  0.10000E+01 volume  0.58574E-02 ppm1      8.018 ppm2      0.903 CV     1
  ASSI {  797}
    (( segid "    " and resid 2    and name HN  ))
    (( segid "    " and resid 1    and name HB2 ))
       3.700     1.700     1.700 peak   797 spectrum    1 weight  0.10000E+01 volume  0.15637E-02 ppm1      8.017 ppm2      2.786 CV     1
  ASSI {  798}
    (( segid "    " and resid 44   and name HN  ))
    (( segid "    " and resid 43   and name HA  ))
       2.800     1.000     1.000 peak   798 spectrum    1 weight  0.10000E+01 volume  0.16315E-02 ppm1      7.995 ppm2      3.848 CV     1
  ASSI {  800}
    (( segid "    " and resid 44   and name HN  ))
    (( segid "    " and resid 42   and name HB2 ))
       4.300     2.300     1.700 peak   800 spectrum    1 weight  0.10000E+01 volume  0.66999E-03 ppm1      7.991 ppm2      3.221 CV     1
  ASSI {  802}
    (( segid "    " and resid 44   and name HN  ))
    (( segid "    " and resid 43   and name HD1 ))
       5.200     3.300     0.800 peak   802 spectrum    1 weight  0.10000E+01 volume  0.37385E-03 ppm1      7.986 ppm2      7.482 CV     1
  ASSI {  803}
    (( segid "    " and resid 44   and name HN  ))
    (( segid "    " and resid 43   and name HB2 ))
       3.500     1.500     1.500 peak   803 spectrum    1 weight  0.10000E+01 volume  0.64635E-03 ppm1      8.003 ppm2      3.518 CV     1
  ASSI {  804}
    (( segid "    " and resid 44   and name HN  ))
    (( segid "    " and resid 45   and name HB  ))
       3.800     1.800     1.800 peak   804 spectrum    1 weight  0.10000E+01 volume  0.11941E-02 ppm1      7.996 ppm2      1.829 CV     1
  ASSI {  805}
    (( segid "    " and resid 44   and name HN  ))
    (( segid "    " and resid 43   and name HN  ))
       2.500     0.800     0.800 peak   805 spectrum    1 weight  0.10000E+01 volume  0.28489E-02 ppm1      7.988 ppm2      8.575 CV     1
  ASSI {  806}
    (( segid "    " and resid 44   and name HN  ))
    (( segid "    " and resid 42   and name HD22))
       4.400     2.400     1.600 peak   806 spectrum    1 weight  0.10000E+01 volume  0.75790E-03 ppm1      7.988 ppm2      7.083 CV     1
  ASSI {  807}
    (( segid "    " and resid 44   and name HN  ))
    (( segid "    " and resid 45   and name HN  ))
       2.400     0.700     0.700 peak   807 spectrum    1 weight  0.10000E+01 volume  0.34250E-02 ppm1      7.990 ppm2      6.821 CV     1
  ASSI {  808}
    (( segid "    " and resid 44   and name HN  ))
    (( segid "    " and resid 44   and name HA  ))
       2.700     0.900     0.900 peak   808 spectrum    1 weight  0.10000E+01 volume  0.23857E-02 ppm1      7.989 ppm2      5.112 CV     1
  ASSI {  809}
    (( segid "    " and resid 44   and name HN  ))
    (( segid "    " and resid 42   and name HA  ))
       3.000     1.100     1.100 peak   809 spectrum    1 weight  0.10000E+01 volume  0.18728E-02 ppm1      7.989 ppm2      4.876 CV     1
  ASSI {  810}
    (( segid "    " and resid 44   and name HN  ))
    (( segid "    " and resid 43   and name HB1 ))
       3.500     1.500     1.500 peak   810 spectrum    1 weight  0.10000E+01 volume  0.13359E-02 ppm1      7.990 ppm2      3.114 CV     1
  ASSI {  811}
    (( segid "    " and resid 44   and name HN  ))
    (( segid "    " and resid 54   and name HA1 ))
       6.000     4.800     0.000 peak   811 spectrum    1 weight  0.10000E+01 volume  0.88591E-04 ppm1      7.987 ppm2      2.666 CV     1
  ASSI {  812}
    (( segid "    " and resid 44   and name HN  ))
    (  segid "    " and resid 44   and name HB% )
       2.300     0.600     0.600 peak   812 spectrum    1 weight  0.10000E+01 volume  0.85849E-02 ppm1      7.990 ppm2      1.509 CV     1
  ASSI {  813}
    (( segid "    " and resid 44   and name HN  ))
    (  segid "    " and resid 45   and name HG2%)
       4.200     2.200     1.800 peak   813 spectrum    1 weight  0.10000E+01 volume  0.10081E-02 ppm1      7.990 ppm2      0.769 CV     1
  ASSI {  814}
    (( segid "    " and resid 100  and name HN  ))
    (( segid "    " and resid 99   and name HA  ))
       3.300     1.300     1.300 peak   814 spectrum    1 weight  0.10000E+01 volume  0.13171E-02 ppm1      7.993 ppm2      4.352 CV     1
  ASSI {  815}
    (( segid "    " and resid 100  and name HN  ))
    (( segid "    " and resid 99   and name HB1 ))
       3.000     1.200     1.200 peak   815 spectrum    1 weight  0.10000E+01 volume  0.11236E-02 ppm1      7.995 ppm2      2.014 CV     1
  ASSI {  816}
    (( segid "    " and resid 100  and name HN  ))
    (  segid "    " and resid 100  and name HG2%)
       2.700     0.900     0.900 peak   816 spectrum    1 weight  0.10000E+01 volume  0.19064E-02 ppm1      7.996 ppm2      0.963 CV     1
  ASSI {  818}
    (( segid "    " and resid 100  and name HN  ))
    (( segid "    " and resid 100  and name HA  ))
       3.000     1.100     1.100 peak   818 spectrum    1 weight  0.10000E+01 volume  0.12573E-02 ppm1      7.995 ppm2      3.865 CV     1
  ASSI {  819}
    (( segid "    " and resid 100  and name HN  ))
    (( segid "    " and resid 100  and name HB  ))
       3.100     1.200     1.200 peak   819 spectrum    1 weight  0.10000E+01 volume  0.11351E-02 ppm1      7.992 ppm2      2.150 CV     1
  ASSI {  820}
    (( segid "    " and resid 100  and name HN  ))
    (  segid "    " and resid 100  and name HG1%)
       3.800     1.800     1.800 peak   820 spectrum    1 weight  0.10000E+01 volume  0.91026E-03 ppm1      7.990 ppm2      0.821 CV     1
  ASSI {  821}
    (( segid "    " and resid 20   and name HN  ))
    (( segid "    " and resid 21   and name HN  ))
       2.400     0.700     0.700 peak   821 spectrum    1 weight  0.10000E+01 volume  0.67202E-02 ppm1      7.981 ppm2      8.627 CV     1
  ASSI {  822}
    (( segid "    " and resid 20   and name HN  ))
    (( segid "    " and resid 20   and name HA  ))
       2.700     0.900     0.900 peak   822 spectrum    1 weight  0.10000E+01 volume  0.34988E-02 ppm1      7.981 ppm2      4.355 CV     1
  ASSI {  823}
    (( segid "    " and resid 20   and name HN  ))
    (( segid "    " and resid 20   and name HB  ))
       2.700     0.900     0.900 peak   823 spectrum    1 weight  0.10000E+01 volume  0.31284E-02 ppm1      7.981 ppm2      4.235 CV     1
  ASSI {  824}
    (( segid "    " and resid 20   and name HN  ))
    (( segid "    " and resid 19   and name HA2 ))
       2.200     0.600     0.600 peak   824 spectrum    1 weight  0.10000E+01 volume  0.10231E-01 ppm1      7.980 ppm2      4.018 CV     1
  ASSI {  825}
    (( segid "    " and resid 20   and name HN  ))
    (( segid "    " and resid 18   and name HA  ))
       4.100     2.100     1.900 peak   825 spectrum    1 weight  0.10000E+01 volume  0.67103E-03 ppm1      7.979 ppm2      4.443 CV     1
  ASSI {  826}
    (( segid "    " and resid 20   and name HN  ))
    (  segid "    " and resid 20   and name HG2%)
       3.200     1.300     1.300 peak   826 spectrum    1 weight  0.10000E+01 volume  0.40562E-02 ppm1      7.978 ppm2      1.192 CV     1
  ASSI {  827}
    (( segid "    " and resid 41   and name HN  ))
    (( segid "    " and resid 41   and name HA1 ))
       2.800     1.000     1.000 peak   827 spectrum    1 weight  0.10000E+01 volume  0.39127E-02 ppm1      7.898 ppm2      4.132 CV     1
  ASSI {  828}
    (( segid "    " and resid 41   and name HN  ))
    (( segid "    " and resid 36   and name HA2 ))
       2.600     0.800     0.800 peak   828 spectrum    1 weight  0.10000E+01 volume  0.24666E-02 ppm1      7.898 ppm2      3.836 CV     1
  ASSI {  829}
    (( segid "    " and resid 41   and name HN  ))
    (( segid "    " and resid 40   and name HN  ))
       2.800     1.000     1.000 peak   829 spectrum    1 weight  0.10000E+01 volume  0.14010E-02 ppm1      7.894 ppm2      7.710 CV     1
  ASSI {  830}
    (( segid "    " and resid 41   and name HN  ))
    (( segid "    " and resid 35   and name HA  ))
       6.000     6.000     0.000 peak   830 spectrum    1 weight  0.10000E+01 volume  0.28871E-05 ppm1      7.897 ppm2      4.323 CV     1
  ASSI {  831}
    (( segid "    " and resid 41   and name HN  ))
    (( segid "    " and resid 40   and name HA2 ))
       2.900     1.100     1.100 peak   831 spectrum    1 weight  0.10000E+01 volume  0.23995E-02 ppm1      7.899 ppm2      3.891 CV     1
  ASSI {  832}
    (( segid "    " and resid 41   and name HN  ))
    (( segid "    " and resid 36   and name HA1 ))
       4.100     2.100     1.900 peak   832 spectrum    1 weight  0.10000E+01 volume  0.17124E-02 ppm1      7.898 ppm2      3.503 CV     1
  ASSI {  833}
    (( segid "    " and resid 41   and name HN  ))
    (  segid "    " and resid 39   and name HB% )
       3.000     1.200     1.200 peak   833 spectrum    1 weight  0.10000E+01 volume  0.12062E-02 ppm1      7.898 ppm2      1.352 CV     1
  ASSI {  834}
    (( segid "    " and resid 41   and name HN  ))
    (( segid "    " and resid 39   and name HN  ))
       4.200     2.200     1.800 peak   834 spectrum    1 weight  0.10000E+01 volume  0.42402E-03 ppm1      7.896 ppm2      7.815 CV     1
  ASSI {  836}
    (( segid "    " and resid 41   and name HN  ))
    (( segid "    " and resid 41   and name HA2 ))
       2.400     0.700     0.700 peak   836 spectrum    1 weight  0.10000E+01 volume  0.36908E-02 ppm1      7.897 ppm2      3.122 CV     1
  ASSI {  837}
    (( segid "    " and resid 41   and name HN  ))
    (  segid "    " and resid 35   and name HB% )
       4.300     2.300     1.700 peak   837 spectrum    1 weight  0.10000E+01 volume  0.29523E-03 ppm1      7.896 ppm2      0.485 CV     1
  ASSI {  842}
    (( segid "    " and resid 49   and name HN  ))
    (( segid "    " and resid 48   and name HN  ))
       2.400     0.700     0.700 peak   842 spectrum    1 weight  0.10000E+01 volume  0.31744E-02 ppm1      7.885 ppm2      8.593 CV     1
  ASSI {  844}
    (( segid "    " and resid 49   and name HN  ))
    (( segid "    " and resid 49   and name HA  ))
       2.800     1.000     1.000 peak   844 spectrum    1 weight  0.10000E+01 volume  0.24096E-02 ppm1      7.885 ppm2      4.624 CV     1
  ASSI {  845}
    (( segid "    " and resid 49   and name HN  ))
    (( segid "    " and resid 48   and name HA2 ))
       3.200     1.300     1.300 peak   845 spectrum    1 weight  0.10000E+01 volume  0.15946E-02 ppm1      7.885 ppm2      4.230 CV     1
  ASSI {  846}
    (( segid "    " and resid 49   and name HN  ))
    (( segid "    " and resid 49   and name HB2 ))
       3.000     1.100     1.100 peak   846 spectrum    1 weight  0.10000E+01 volume  0.21784E-02 ppm1      7.886 ppm2      3.310 CV     1
  ASSI {  847}
    (( segid "    " and resid 49   and name HN  ))
    (( segid "    " and resid 47   and name HN  ))
       4.300     2.300     1.700 peak   847 spectrum    1 weight  0.10000E+01 volume  0.50135E-03 ppm1      7.882 ppm2      9.046 CV     1
  ASSI {  848}
    (( segid "    " and resid 49   and name HN  ))
    (( segid "    " and resid 50   and name HN  ))
       2.500     0.800     0.800 peak   848 spectrum    1 weight  0.10000E+01 volume  0.37940E-02 ppm1      7.884 ppm2      8.216 CV     1
  ASSI {  849}
    (( segid "    " and resid 49   and name HN  ))
    (( segid "    " and resid 46   and name HA  ))
       6.000     6.000     0.000 peak   849 spectrum    1 weight  0.10000E+01 volume  0.25635E-04 ppm1      7.884 ppm2      4.773 CV     1
  ASSI {  850}
    (( segid "    " and resid 49   and name HN  ))
    (( segid "    " and resid 47   and name HA  ))
       6.000     5.800     0.000 peak   850 spectrum    1 weight  0.10000E+01 volume  0.37258E-04 ppm1      7.880 ppm2      4.380 CV     1
  ASSI {  851}
    (( segid "    " and resid 49   and name HN  ))
    (( segid "    " and resid 48   and name HA1 ))
       3.000     1.100     1.100 peak   851 spectrum    1 weight  0.10000E+01 volume  0.31947E-02 ppm1      7.884 ppm2      3.930 CV     1
  ASSI {  852}
    (( segid "    " and resid 49   and name HN  ))
    (( segid "    " and resid 49   and name HB1 ))
       2.900     1.000     1.000 peak   852 spectrum    1 weight  0.10000E+01 volume  0.18110E-02 ppm1      7.886 ppm2      2.712 CV     1
  ASSI {  853}
    (( segid "    " and resid 49   and name HN  ))
    (  segid "    " and resid 47   and name HG2%)
       4.100     2.100     1.900 peak   853 spectrum    1 weight  0.10000E+01 volume  0.10622E-03 ppm1      7.885 ppm2      1.232 CV     1
  ASSI {  854}
    (( segid "    " and resid 98   and name HN  ))
    (  segid "    " and resid 102  and name HB% )
       4.500     2.500     1.500 peak   854 spectrum    1 weight  0.10000E+01 volume  0.47258E-03 ppm1      7.881 ppm2      1.472 CV     1
  ASSI {  855}
    (( segid "    " and resid 98   and name HN  ))
    (( segid "    " and resid 99   and name HA  ))
       5.300     3.500     0.700 peak   855 spectrum    1 weight  0.10000E+01 volume  0.58755E-04 ppm1      7.874 ppm2      4.344 CV     1
  ASSI {  856}
    (( segid "    " and resid 98   and name HN  ))
    (( segid "    " and resid 97   and name HN  ))
       2.600     0.800     0.800 peak   856 spectrum    1 weight  0.10000E+01 volume  0.27158E-02 ppm1      7.879 ppm2      7.630 CV     1
  ASSI {  857}
    (( segid "    " and resid 98   and name HN  ))
    (( segid "    " and resid 98   and name HZ3 ))
       4.400     2.500     1.600 peak   857 spectrum    1 weight  0.10000E+01 volume  0.41561E-03 ppm1      7.880 ppm2      7.074 CV     1
  ASSI {  858}
    (( segid "    " and resid 98   and name HN  ))
    (( segid "    " and resid 98   and name HA  ))
       2.800     1.000     1.000 peak   858 spectrum    1 weight  0.10000E+01 volume  0.19471E-02 ppm1      7.880 ppm2      4.991 CV     1
  ASSI {  859}
    (( segid "    " and resid 98   and name HN  ))
    (( segid "    " and resid 97   and name HA  ))
       2.900     1.100     1.100 peak   859 spectrum    1 weight  0.10000E+01 volume  0.24347E-02 ppm1      7.880 ppm2      3.918 CV     1
  ASSI {  860}
    (( segid "    " and resid 98   and name HN  ))
    (( segid "    " and resid 96   and name HA2 ))
       3.600     1.700     1.700 peak   860 spectrum    1 weight  0.10000E+01 volume  0.61481E-03 ppm1      7.880 ppm2      3.816 CV     1
  ASSI {  861}
    (( segid "    " and resid 98   and name HN  ))
    (( segid "    " and resid 99   and name HD1 ))
       3.200     1.300     1.300 peak   861 spectrum    1 weight  0.10000E+01 volume  0.22651E-02 ppm1      7.879 ppm2      3.535 CV     1
  ASSI {  862}
    (( segid "    " and resid 98   and name HN  ))
    (( segid "    " and resid 98   and name HB1 ))
       3.800     1.800     1.800 peak   862 spectrum    1 weight  0.10000E+01 volume  0.13311E-02 ppm1      7.881 ppm2      3.417 CV     1
  ASSI {  863}
    (( segid "    " and resid 98   and name HN  ))
    (( segid "    " and resid 98   and name HB2 ))
       2.900     1.000     1.000 peak   863 spectrum    1 weight  0.10000E+01 volume  0.11929E-02 ppm1      7.881 ppm2      3.133 CV     1
  ASSI {  864}
    (( segid "    " and resid 98   and name HN  ))
    (  segid "    " and resid 97   and name HB% )
       3.100     1.200     1.200 peak   864 spectrum    1 weight  0.10000E+01 volume  0.17835E-02 ppm1      7.880 ppm2      0.165 CV     1
  ASSI {  866}
    (( segid "    " and resid 104  and name HN  ))
    (( segid "    " and resid 103  and name HN  ))
       2.600     0.800     0.800 peak   866 spectrum    1 weight  0.10000E+01 volume  0.32292E-02 ppm1      7.840 ppm2      7.602 CV     1
  ASSI {  867}
    (( segid "    " and resid 104  and name HN  ))
    (( segid "    " and resid 105  and name HN  ))
       2.600     0.800     0.800 peak   867 spectrum    1 weight  0.10000E+01 volume  0.29156E-02 ppm1      7.840 ppm2      7.530 CV     1
  ASSI {  868}
    (( segid "    " and resid 104  and name HN  ))
    (( segid "    " and resid 101  and name HA  ))
       3.200     1.300     1.300 peak   868 spectrum    1 weight  0.10000E+01 volume  0.13621E-02 ppm1      7.838 ppm2      4.549 CV     1
  ASSI {  869}
    (( segid "    " and resid 104  and name HN  ))
    (( segid "    " and resid 103  and name HA  ))
       2.700     0.900     0.900 peak   869 spectrum    1 weight  0.10000E+01 volume  0.33808E-02 ppm1      7.838 ppm2      4.078 CV     1
  ASSI {  870}
    (( segid "    " and resid 104  and name HN  ))
    (( segid "    " and resid 104  and name HA  ))
       2.700     0.900     0.900 peak   870 spectrum    1 weight  0.10000E+01 volume  0.32874E-02 ppm1      7.839 ppm2      4.008 CV     1
  ASSI {  871}
    (( segid "    " and resid 104  and name HN  ))
    (( segid "    " and resid 104  and name HB1 ))
       2.900     1.000     1.000 peak   871 spectrum    1 weight  0.10000E+01 volume  0.75072E-02 ppm1      7.839 ppm2      1.841 CV     1
  ASSI {  872}
    (( segid "    " and resid 104  and name HN  ))
    (( segid "    " and resid 104  and name HG2 ))
       3.000     1.100     1.100 peak   872 spectrum    1 weight  0.10000E+01 volume  0.28176E-02 ppm1      7.837 ppm2      1.732 CV     1
  ASSI {  873}
    (( segid "    " and resid 104  and name HN  ))
    (( segid "    " and resid 104  and name HG1 ))
       3.300     1.400     1.400 peak   873 spectrum    1 weight  0.10000E+01 volume  0.14946E-02 ppm1      7.839 ppm2      1.663 CV     1
  ASSI {  874}
    (( segid "    " and resid 104  and name HN  ))
    (  segid "    " and resid 103  and name HB% )
       2.400     2.400     3.600 peak   874 spectrum    1 weight  0.10000E+01 volume  0.61191E-02 ppm1      7.839 ppm2      1.419 CV     1
  ASSI {  875}
    (( segid "    " and resid 104  and name HN  ))
    (  segid "    " and resid 105  and name HB% )
       4.100     2.100     1.900 peak   875 spectrum    1 weight  0.10000E+01 volume  0.65556E-03 ppm1      7.839 ppm2      1.194 CV     1
  ASSI {  876}
    (( segid "    " and resid 104  and name HN  ))
    (( segid "    " and resid 104  and name HD2 ))
       3.400     1.400     1.400 peak   876 spectrum    1 weight  0.10000E+01 volume  0.12670E-02 ppm1      7.833 ppm2      3.115 CV     1
  ASSI {  877}
    (( segid "    " and resid 92   and name HN  ))
    (( segid "    " and resid 93   and name HA  ))
       6.000     6.000     0.000 peak   877 spectrum    1 weight  0.10000E+01 volume  0.11410E-04 ppm1      7.810 ppm2      4.662 CV     1
  ASSI {  881}
    (( segid "    " and resid 92   and name HN  ))
    (( segid "    " and resid 92   and name HA  ))
       2.700     0.900     0.900 peak   881 spectrum    1 weight  0.10000E+01 volume  0.29079E-02 ppm1      7.804 ppm2      4.274 CV     1
  ASSI {  882}
    (( segid "    " and resid 92   and name HN  ))
    (( segid "    " and resid 91   and name HA  ))
       3.500     1.500     1.500 peak   882 spectrum    1 weight  0.10000E+01 volume  0.59441E-03 ppm1      7.804 ppm2      4.026 CV     1
  ASSI {  883}
    (( segid "    " and resid 92   and name HN  ))
    (( segid "    " and resid 92   and name HB1 ))
       2.800     1.000     1.000 peak   883 spectrum    1 weight  0.10000E+01 volume  0.76706E-02 ppm1      7.805 ppm2      1.986 CV     1
  ASSI {  884}
    (( segid "    " and resid 92   and name HN  ))
    (( segid "    " and resid 92   and name HG1 ))
       2.300     0.600     0.600 peak   884 spectrum    1 weight  0.10000E+01 volume  0.21854E-02 ppm1      7.806 ppm2      1.895 CV     1
  ASSI {  886}
    (( segid "    " and resid 92   and name HN  ))
    (  segid "    " and resid 91   and name HD1%)
       3.800     1.800     1.800 peak   886 spectrum    1 weight  0.10000E+01 volume  0.82629E-03 ppm1      7.806 ppm2      0.959 CV     1
  ASSI {  887}
    (( segid "    " and resid 92   and name HN  ))
    (  segid "    " and resid 91   and name HD2%)
       4.400     2.400     1.600 peak   887 spectrum    1 weight  0.10000E+01 volume  0.48495E-03 ppm1      7.806 ppm2      0.900 CV     1
  ASSI {  888}
    (( segid "    " and resid 92   and name HN  ))
    (( segid "    " and resid 89   and name HA  ))
       3.800     1.800     1.800 peak   888 spectrum    1 weight  0.10000E+01 volume  0.52771E-03 ppm1      7.804 ppm2      3.881 CV     1
  ASSI {  889}
    (( segid "    " and resid 92   and name HN  ))
    (( segid "    " and resid 90   and name HG2 ))
       3.300     1.400     1.400 peak   889 spectrum    1 weight  0.10000E+01 volume  0.35767E-03 ppm1      7.805 ppm2      1.795 CV     1
  ASSI {  890}
    (( segid "    " and resid 92   and name HN  ))
    (( segid "    " and resid 88   and name HA  ))
       6.000     6.000     0.000 peak   890 spectrum    1 weight  0.10000E+01 volume  0.58317E-05 ppm1      7.795 ppm2      3.677 CV     1
  ASSI {  895}
    (( segid "    " and resid 70   and name HN  ))
    (( segid "    " and resid 62   and name HZ2 ))
       4.000     2.000     2.000 peak   895 spectrum    1 weight  0.10000E+01 volume  0.73728E-03 ppm1      7.758 ppm2      7.175 CV     1
  ASSI {  896}
    (( segid "    " and resid 70   and name HN  ))
    (( segid "    " and resid 69   and name HN  ))
       2.300     0.700     0.700 peak   896 spectrum    1 weight  0.10000E+01 volume  0.45955E-02 ppm1      7.759 ppm2      7.105 CV     1
  ASSI {  897}
    (( segid "    " and resid 70   and name HN  ))
    (  segid "    " and resid 70   and name HD% )
       2.400     2.400     3.600 peak   897 spectrum    1 weight  0.10000E+01 volume  0.27704E-02 ppm1      7.758 ppm2      6.889 CV     1
  ASSI {  898}
    (( segid "    " and resid 70   and name HN  ))
    (  segid "    " and resid 70   and name HE% )
       4.000     2.000     2.000 peak   898 spectrum    1 weight  0.10000E+01 volume  0.10398E-02 ppm1      7.759 ppm2      6.650 CV     1
  ASSI {  899}
    (( segid "    " and resid 70   and name HN  ))
    (( segid "    " and resid 70   and name HA  ))
       2.800     1.000     1.000 peak   899 spectrum    1 weight  0.10000E+01 volume  0.21995E-02 ppm1      7.760 ppm2      4.751 CV     1
  ASSI {  900}
    (( segid "    " and resid 70   and name HN  ))
    (( segid "    " and resid 68   and name HA  ))
       3.400     1.400     1.400 peak   900 spectrum    1 weight  0.10000E+01 volume  0.87867E-03 ppm1      7.762 ppm2      4.314 CV     1
  ASSI {  901}
    (( segid "    " and resid 70   and name HN  ))
    (( segid "    " and resid 69   and name HA  ))
       3.000     1.100     1.100 peak   901 spectrum    1 weight  0.10000E+01 volume  0.17402E-02 ppm1      7.758 ppm2      3.781 CV     1
  ASSI {  902}
    (( segid "    " and resid 70   and name HN  ))
    (( segid "    " and resid 70   and name HB1 ))
       3.300     1.400     1.400 peak   902 spectrum    1 weight  0.10000E+01 volume  0.24473E-02 ppm1      7.763 ppm2      3.217 CV     1
  ASSI {  903}
    (( segid "    " and resid 70   and name HN  ))
    (( segid "    " and resid 70   and name HB2 ))
       2.500     0.800     0.800 peak   903 spectrum    1 weight  0.10000E+01 volume  0.22338E-02 ppm1      7.759 ppm2      2.921 CV     1
  ASSI {  904}
    (( segid "    " and resid 70   and name HN  ))
    (( segid "    " and resid 69   and name HB2 ))
       3.200     1.300     1.300 peak   904 spectrum    1 weight  0.10000E+01 volume  0.19807E-02 ppm1      7.759 ppm2      1.302 CV     1
  ASSI {  905}
    (( segid "    " and resid 70   and name HN  ))
    (( segid "    " and resid 69   and name HG2 ))
       2.500     0.800     0.800 peak   905 spectrum    1 weight  0.10000E+01 volume  0.47696E-02 ppm1      7.757 ppm2      1.036 CV     1
  ASSI {  907}
    (( segid "    " and resid 70   and name HN  ))
    (( segid "    " and resid 67   and name HA2 ))
       5.400     3.600     0.600 peak   907 spectrum    1 weight  0.10000E+01 volume  0.82465E-04 ppm1      7.758 ppm2      2.372 CV     1
  ASSI {  908}
    (( segid "    " and resid 70   and name HN  ))
    (  segid "    " and resid 85   and name HG2%)
       6.000     5.400     0.000 peak   908 spectrum    1 weight  0.10000E+01 volume  0.61136E-04 ppm1      7.763 ppm2      0.528 CV     1
  ASSI {  910}
    (( segid "    " and resid 104  and name HN  ))
    (  segid "    " and resid 100  and name HG1%)
       4.700     2.700     1.300 peak   910 spectrum    1 weight  0.10000E+01 volume  0.13586E-03 ppm1      7.836 ppm2      0.808 CV     1
  ASSI {  913}
    (( segid "    " and resid 39   and name HN  ))
    (( segid "    " and resid 38   and name HA  ))
       3.000     1.100     1.100 peak   913 spectrum    1 weight  0.10000E+01 volume  0.20809E-02 ppm1      7.792 ppm2      4.106 CV     1
  ASSI {  914}
    (( segid "    " and resid 39   and name HN  ))
    (( segid "    " and resid 38   and name HB2 ))
       3.600     1.600     1.600 peak   914 spectrum    1 weight  0.10000E+01 volume  0.75236E-03 ppm1      7.791 ppm2      2.086 CV     1
  ASSI {  916}
    (( segid "    " and resid 39   and name HN  ))
    (( segid "    " and resid 38   and name HB1 ))
       3.100     1.200     1.200 peak   916 spectrum    1 weight  0.10000E+01 volume  0.11728E-02 ppm1      7.790 ppm2      1.760 CV     1
  ASSI {  917}
    (( segid "    " and resid 39   and name HN  ))
    (  segid "    " and resid 39   and name HB% )
       2.400     0.700     0.700 peak   917 spectrum    1 weight  0.10000E+01 volume  0.43256E-02 ppm1      7.790 ppm2      1.352 CV     1
  ASSI {  919}
    (( segid "    " and resid 39   and name HN  ))
    (( segid "    " and resid 39   and name HA  ))
       3.100     1.200     1.200 peak   919 spectrum    1 weight  0.10000E+01 volume  0.12985E-02 ppm1      7.789 ppm2      4.586 CV     1
  ASSI {  920}
    (( segid "    " and resid 39   and name HN  ))
    (( segid "    " and resid 35   and name HA  ))
       3.100     1.200     1.200 peak   920 spectrum    1 weight  0.10000E+01 volume  0.11474E-02 ppm1      7.789 ppm2      4.304 CV     1
  ASSI {  921}
    (( segid "    " and resid 39   and name HN  ))
    (( segid "    " and resid 40   and name HA2 ))
       5.700     4.000     0.300 peak   921 spectrum    1 weight  0.10000E+01 volume  0.23096E-03 ppm1      7.789 ppm2      3.876 CV     1
  ASSI {  922}
    (( segid "    " and resid 39   and name HN  ))
    (( segid "    " and resid 37   and name HB2 ))
       3.600     1.600     1.600 peak   922 spectrum    1 weight  0.10000E+01 volume  0.25190E-03 ppm1      7.785 ppm2      3.196 CV     1
  ASSI {  923}
    (( segid "    " and resid 39   and name HN  ))
    (( segid "    " and resid 42   and name HN  ))
       6.000     6.000     0.000 peak   923 spectrum    1 weight  0.10000E+01 volume  0.37650E-04 ppm1      7.799 ppm2      7.088 CV     1
  ASSI {  924}
    (( segid "    " and resid 39   and name HN  ))
    (  segid "    " and resid 35   and name HB% )
       4.300     2.300     1.700 peak   924 spectrum    1 weight  0.10000E+01 volume  0.40953E-03 ppm1      7.778 ppm2      0.504 CV     1
  ASSI {  925}
    (( segid "    " and resid 70   and name HN  ))
    (( segid "    " and resid 71   and name HA  ))
       5.400     3.600     0.600 peak   925 spectrum    1 weight  0.10000E+01 volume  0.17167E-03 ppm1      7.748 ppm2      4.826 CV     1
  ASSI {  926}
    (( segid "    " and resid 42   and name HD21))
    (( segid "    " and resid 42   and name HA  ))
       4.700     2.800     1.300 peak   926 spectrum    1 weight  0.10000E+01 volume  0.79514E-04 ppm1      7.748 ppm2      4.866 CV     1
  ASSI {  927}
    (( segid "    " and resid 42   and name HD21))
    (( segid "    " and resid 45   and name HB  ))
       4.200     2.200     1.800 peak   927 spectrum    1 weight  0.10000E+01 volume  0.15978E-03 ppm1      7.746 ppm2      1.822 CV     1
  ASSI {  928}
    (( segid "    " and resid 42   and name HD21))
    (  segid "    " and resid 45   and name HG2%)
       5.200     3.400     0.800 peak   928 spectrum    1 weight  0.10000E+01 volume  0.19593E-03 ppm1      7.745 ppm2      0.771 CV     1
  ASSI {  929}
    (( segid "    " and resid 42   and name HD21))
    (( segid "    " and resid 45   and name HN  ))
       3.000     1.100     1.100 peak   929 spectrum    1 weight  0.10000E+01 volume  0.11090E-02 ppm1      7.740 ppm2      6.832 CV     1
  ASSI {  930}
    (( segid "    " and resid 42   and name HD21))
    (( segid "    " and resid 42   and name HB1 ))
       2.700     0.900     0.900 peak   930 spectrum    1 weight  0.10000E+01 volume  0.15658E-02 ppm1      7.742 ppm2      2.746 CV     1
  ASSI {  931}
    (( segid "    " and resid 42   and name HD21))
    (  segid "    " and resid 44   and name HB% )
       4.000     2.000     2.000 peak   931 spectrum    1 weight  0.10000E+01 volume  0.41166E-03 ppm1      7.744 ppm2      1.506 CV     1
  ASSI {  932}
    (( segid "    " and resid 42   and name HD21))
    (  segid "    " and resid 45   and name HD1%)
       4.100     2.100     1.900 peak   932 spectrum    1 weight  0.10000E+01 volume  0.72467E-03 ppm1      7.743 ppm2      0.906 CV     1
  ASSI {  933}
    (( segid "    " and resid 42   and name HD21))
    (( segid "    " and resid 45   and name HA  ))
       4.200     2.200     1.800 peak   933 spectrum    1 weight  0.10000E+01 volume  0.24126E-03 ppm1      7.745 ppm2      3.783 CV     1
  ASSI {  934}
    (( segid "    " and resid 42   and name HD21))
    (( segid "    " and resid 42   and name HB2 ))
       3.400     1.500     1.500 peak   934 spectrum    1 weight  0.10000E+01 volume  0.13502E-02 ppm1      7.742 ppm2      3.218 CV     1
  ASSI {  937}
    (( segid "    " and resid 56   and name HN  ))
    (  segid "    " and resid 39   and name HB% )
       5.800     4.200     0.200 peak   937 spectrum    1 weight  0.10000E+01 volume  0.33585E-04 ppm1      7.741 ppm2      1.341 CV     1
  ASSI {  939}
    (( segid "    " and resid 56   and name HN  ))
    (( segid "    " and resid 57   and name HN  ))
       3.400     1.400     1.400 peak   939 spectrum    1 weight  0.10000E+01 volume  0.69160E-03 ppm1      7.732 ppm2      7.564 CV     1
  ASSI {  941}
    (( segid "    " and resid 56   and name HN  ))
    (( segid "    " and resid 55   and name HA  ))
       3.800     1.800     1.800 peak   941 spectrum    1 weight  0.10000E+01 volume  0.37387E-03 ppm1      7.732 ppm2      4.284 CV     1
  ASSI {  942}
    (( segid "    " and resid 56   and name HN  ))
    (( segid "    " and resid 56   and name HA  ))
       2.700     0.900     0.900 peak   942 spectrum    1 weight  0.10000E+01 volume  0.21045E-02 ppm1      7.734 ppm2      3.475 CV     1
  ASSI {  943}
    (( segid "    " and resid 56   and name HN  ))
    (( segid "    " and resid 55   and name HB  ))
       3.100     1.200     1.200 peak   943 spectrum    1 weight  0.10000E+01 volume  0.16494E-02 ppm1      7.734 ppm2      2.218 CV     1
  ASSI {  944}
    (( segid "    " and resid 56   and name HN  ))
    (( segid "    " and resid 56   and name HB1 ))
       4.000     2.000     2.000 peak   944 spectrum    1 weight  0.10000E+01 volume  0.60412E-03 ppm1      7.735 ppm2      1.722 CV     1
  ASSI {  945}
    (( segid "    " and resid 56   and name HN  ))
    (  segid "    " and resid 55   and name HG1%)
       3.700     1.700     1.700 peak   945 spectrum    1 weight  0.10000E+01 volume  0.11238E-02 ppm1      7.733 ppm2      0.627 CV     1
  ASSI {  946}
    (( segid "    " and resid 56   and name HN  ))
    (( segid "    " and resid 56   and name HG1 ))
       4.000     2.000     2.000 peak   946 spectrum    1 weight  0.10000E+01 volume  0.63911E-03 ppm1      7.731 ppm2      2.108 CV     1
  ASSI {  948}
    (( segid "    " and resid 56   and name HN  ))
    (( segid "    " and resid 56   and name HB2 ))
       3.400     1.400     1.400 peak   948 spectrum    1 weight  0.10000E+01 volume  0.98979E-03 ppm1      7.732 ppm2      1.894 CV     1
  ASSI {  949}
    (( segid "    " and resid 85   and name HN  ))
    (( segid "    " and resid 87   and name HN  ))
       5.500     3.800     0.500 peak   949 spectrum    1 weight  0.10000E+01 volume  0.48445E-04 ppm1      7.708 ppm2      8.808 CV     1
  ASSI {  950}
    (( segid "    " and resid 85   and name HN  ))
    (( segid "    " and resid 84   and name HA  ))
       4.300     2.300     1.700 peak   950 spectrum    1 weight  0.10000E+01 volume  0.22893E-03 ppm1      7.704 ppm2      3.949 CV     1
  ASSI {  951}
    (( segid "    " and resid 85   and name HN  ))
    (( segid "    " and resid 57   and name HZ  ))
       5.200     3.400     0.800 peak   951 spectrum    1 weight  0.10000E+01 volume  0.24038E-03 ppm1      7.708 ppm2      7.158 CV     1
  ASSI {  953}
    (( segid "    " and resid 85   and name HN  ))
    (  segid "    " and resid 70   and name HE% )
       4.600     2.600     1.400 peak   953 spectrum    1 weight  0.10000E+01 volume  0.37941E-03 ppm1      7.709 ppm2      6.640 CV     1
  ASSI {  954}
    (( segid "    " and resid 85   and name HN  ))
    (( segid "    " and resid 87   and name HG2 ))
       6.000     4.500     0.000 peak   954 spectrum    1 weight  0.10000E+01 volume  0.51154E-04 ppm1      7.710 ppm2      2.491 CV     1
  ASSI {  958}
    (( segid "    " and resid 85   and name HN  ))
    (( segid "    " and resid 85   and name HA  ))
       2.900     1.100     1.100 peak   958 spectrum    1 weight  0.10000E+01 volume  0.16451E-02 ppm1      7.705 ppm2      3.637 CV     1
  ASSI {  960}
    (( segid "    " and resid 85   and name HN  ))
    (( segid "    " and resid 85   and name HB  ))
       2.600     0.900     0.900 peak   960 spectrum    1 weight  0.10000E+01 volume  0.23113E-02 ppm1      7.705 ppm2      2.074 CV     1
  ASSI {  961}
    (( segid "    " and resid 85   and name HN  ))
    (  segid "    " and resid 84   and name HB% )
       2.700     0.900     0.900 peak   961 spectrum    1 weight  0.10000E+01 volume  0.28784E-02 ppm1      7.704 ppm2      1.469 CV     1
  ASSI {  962}
    (( segid "    " and resid 85   and name HN  ))
    (  segid "    " and resid 85   and name HG2%)
       2.300     0.600     0.600 peak   962 spectrum    1 weight  0.10000E+01 volume  0.49362E-02 ppm1      7.704 ppm2      0.523 CV     1
  ASSI {  963}
    (( segid "    " and resid 85   and name HN  ))
    (  segid "    " and resid 85   and name HG1%)
       3.700     1.700     1.700 peak   963 spectrum    1 weight  0.10000E+01 volume  0.17870E-02 ppm1      7.704 ppm2      0.421 CV     1
  ASSI {  964}
    (( segid "    " and resid 85   and name HN  ))
    (( segid "    " and resid 67   and name HA2 ))
       6.000     6.000     0.000 peak   964 spectrum    1 weight  0.10000E+01 volume  0.25499E-04 ppm1      7.697 ppm2      2.367 CV     1
  ASSI {  965}
    (( segid "    " and resid 85   and name HN  ))
    (  segid "    " and resid 86   and name HB% )
       5.400     3.700     0.600 peak   965 spectrum    1 weight  0.10000E+01 volume  0.14338E-03 ppm1      7.699 ppm2      0.759 CV     1
  ASSI {  966}
    (( segid "    " and resid 40   and name HN  ))
    (( segid "    " and resid 38   and name HB2 ))
       5.200     3.400     0.800 peak   966 spectrum    1 weight  0.10000E+01 volume  0.25756E-04 ppm1      7.702 ppm2      2.077 CV     1
  ASSI {  967}
    (( segid "    " and resid 40   and name HN  ))
    (( segid "    " and resid 42   and name HN  ))
       4.800     2.900     1.200 peak   967 spectrum    1 weight  0.10000E+01 volume  0.38485E-03 ppm1      7.715 ppm2      7.069 CV     1
  ASSI {  970}
    (( segid "    " and resid 40   and name HN  ))
    (( segid "    " and resid 39   and name HA  ))
       3.300     1.300     1.300 peak   970 spectrum    1 weight  0.10000E+01 volume  0.12944E-02 ppm1      7.707 ppm2      4.585 CV     1
  ASSI {  971}
    (( segid "    " and resid 40   and name HN  ))
    (( segid "    " and resid 37   and name HA  ))
       4.000     2.000     2.000 peak   971 spectrum    1 weight  0.10000E+01 volume  0.35312E-03 ppm1      7.710 ppm2      4.319 CV     1
  ASSI {  972}
    (( segid "    " and resid 40   and name HN  ))
    (( segid "    " and resid 40   and name HA1 ))
       2.700     0.900     0.900 peak   972 spectrum    1 weight  0.10000E+01 volume  0.53162E-02 ppm1      7.707 ppm2      4.137 CV     1
  ASSI {  973}
    (( segid "    " and resid 40   and name HN  ))
    (( segid "    " and resid 36   and name HA1 ))
       4.700     2.800     1.300 peak   973 spectrum    1 weight  0.10000E+01 volume  0.53115E-03 ppm1      7.708 ppm2      3.518 CV     1
  ASSI {  974}
    (( segid "    " and resid 40   and name HN  ))
    (( segid "    " and resid 39   and name HN  ))
       2.000     0.500     0.500 peak   974 spectrum    1 weight  0.10000E+01 volume  0.82937E-02 ppm1      7.706 ppm2      7.791 CV     1
  ASSI {  975}
    (( segid "    " and resid 40   and name HN  ))
    (( segid "    " and resid 40   and name HA2 ))
       2.300     0.600     0.600 peak   975 spectrum    1 weight  0.10000E+01 volume  0.52855E-02 ppm1      7.706 ppm2      3.897 CV     1
  ASSI {  976}
    (( segid "    " and resid 40   and name HN  ))
    (( segid "    " and resid 41   and name HA2 ))
       4.400     2.400     1.600 peak   976 spectrum    1 weight  0.10000E+01 volume  0.62660E-03 ppm1      7.702 ppm2      3.133 CV     1
  ASSI {  977}
    (( segid "    " and resid 40   and name HN  ))
    (  segid "    " and resid 39   and name HB% )
       3.300     1.400     1.400 peak   977 spectrum    1 weight  0.10000E+01 volume  0.14564E-02 ppm1      7.706 ppm2      1.351 CV     1
  ASSI {  979}
    (( segid "    " and resid 65   and name HD21))
    (( segid "    " and resid 65   and name HB2 ))
       3.900     1.900     1.900 peak   979 spectrum    1 weight  0.10000E+01 volume  0.26597E-03 ppm1      7.687 ppm2      2.919 CV     1
  ASSI {  980}
    (( segid "    " and resid 65   and name HD21))
    (  segid "    " and resid 89   and name HG2%)
       4.500     2.500     1.500 peak   980 spectrum    1 weight  0.10000E+01 volume  0.77693E-03 ppm1      7.687 ppm2      1.074 CV     1
  ASSI {  981}
    (( segid "    " and resid 65   and name HD21))
    (( segid "    " and resid 61   and name HA  ))
       4.800     2.900     1.200 peak   981 spectrum    1 weight  0.10000E+01 volume  0.22849E-03 ppm1      7.679 ppm2      3.986 CV     1
  ASSI {  982}
    (( segid "    " and resid 65   and name HD21))
    (( segid "    " and resid 65   and name HB1 ))
       3.300     1.400     1.400 peak   982 spectrum    1 weight  0.10000E+01 volume  0.62117E-03 ppm1      7.680 ppm2      2.282 CV     1
  ASSI {  983}
    (( segid "    " and resid 65   and name HD21))
    (  segid "    " and resid 64   and name HB% )
       3.100     1.200     1.200 peak   983 spectrum    1 weight  0.10000E+01 volume  0.17824E-02 ppm1      7.684 ppm2      1.487 CV     1
  ASSI {  984}
    (( segid "    " and resid 65   and name HD21))
    (  segid "    " and resid 61   and name HG2%)
       3.700     1.700     1.700 peak   984 spectrum    1 weight  0.10000E+01 volume  0.14765E-02 ppm1      7.684 ppm2      1.415 CV     1
  ASSI {  985}
    (( segid "    " and resid 33   and name HN  ))
    (( segid "    " and resid 29   and name HB2 ))
       5.200     3.400     0.800 peak   985 spectrum    1 weight  0.10000E+01 volume  0.24614E-04 ppm1      7.663 ppm2      3.995 CV     1
  ASSI {  986}
    (( segid "    " and resid 33   and name HN  ))
    (( segid "    " and resid 34   and name HN  ))
       2.700     0.900     0.900 peak   986 spectrum    1 weight  0.10000E+01 volume  0.20451E-02 ppm1      7.659 ppm2      8.521 CV     1
  ASSI {  987}
    (( segid "    " and resid 33   and name HN  ))
    (( segid "    " and resid 32   and name HN  ))
       2.600     0.900     0.900 peak   987 spectrum    1 weight  0.10000E+01 volume  0.25746E-02 ppm1      7.658 ppm2      8.418 CV     1
  ASSI {  989}
    (( segid "    " and resid 33   and name HN  ))
    (( segid "    " and resid 32   and name HA  ))
       3.500     1.500     1.500 peak   989 spectrum    1 weight  0.10000E+01 volume  0.59507E-03 ppm1      7.657 ppm2      4.840 CV     1
  ASSI {  990}
    (( segid "    " and resid 33   and name HN  ))
    (( segid "    " and resid 33   and name HA  ))
       2.700     0.900     0.900 peak   990 spectrum    1 weight  0.10000E+01 volume  0.34463E-02 ppm1      7.658 ppm2      4.247 CV     1
  ASSI {  991}
    (( segid "    " and resid 33   and name HN  ))
    (( segid "    " and resid 105  and name HA  ))
       6.000     5.300     0.000 peak   991 spectrum    1 weight  0.10000E+01 volume  0.93149E-04 ppm1      7.656 ppm2      4.120 CV     1
  ASSI {  992}
    (( segid "    " and resid 33   and name HN  ))
    (( segid "    " and resid 30   and name HA  ))
       3.300     1.300     1.300 peak   992 spectrum    1 weight  0.10000E+01 volume  0.92776E-03 ppm1      7.657 ppm2      3.871 CV     1
  ASSI {  993}
    (( segid "    " and resid 33   and name HN  ))
    (( segid "    " and resid 31   and name HB2 ))
       6.000     6.000     0.000 peak   993 spectrum    1 weight  0.10000E+01 volume  0.43232E-05 ppm1      7.659 ppm2      3.132 CV     1
  ASSI {  994}
    (( segid "    " and resid 33   and name HN  ))
    (( segid "    " and resid 32   and name HB1 ))
       2.600     0.800     0.800 peak   994 spectrum    1 weight  0.10000E+01 volume  0.33676E-02 ppm1      7.658 ppm2      2.782 CV     1
  ASSI {  995}
    (( segid "    " and resid 33   and name HN  ))
    (  segid "    " and resid 33   and name HB% )
       2.200     0.600     0.600 peak   995 spectrum    1 weight  0.10000E+01 volume  0.85152E-02 ppm1      7.658 ppm2      1.518 CV     1
  ASSI {  996}
    (( segid "    " and resid 33   and name HN  ))
    (  segid "    " and resid 105  and name HB% )
       4.300     2.300     1.700 peak   996 spectrum    1 weight  0.10000E+01 volume  0.41043E-03 ppm1      7.661 ppm2      1.192 CV     1
  ASSI {  998}
    (( segid "    " and resid 33   and name HN  ))
    (( segid "    " and resid 31   and name HN  ))
       4.600     2.600     1.400 peak   998 spectrum    1 weight  0.10000E+01 volume  0.20743E-03 ppm1      7.654 ppm2      7.209 CV     1
  ASSI { 1000}
    (( segid "    " and resid 33   and name HN  ))
    (( segid "    " and resid 35   and name HN  ))
       5.600     3.900     0.400 peak  1000 spectrum    1 weight  0.10000E+01 volume  0.65436E-04 ppm1      7.664 ppm2      8.812 CV     1
  ASSI { 1005}
    (( segid "    " and resid 97   and name HN  ))
    (( segid "    " and resid 96   and name HN  ))
       2.900     1.100     1.100 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.13677E-02 ppm1      7.629 ppm2      8.442 CV     1
  ASSI { 1006}
    (( segid "    " and resid 97   and name HN  ))
    (( segid "    " and resid 95   and name HA  ))
       4.000     2.000     2.000 peak  1006 spectrum    1 weight  0.10000E+01 volume  0.43826E-03 ppm1      7.629 ppm2      4.995 CV     1
  ASSI { 1007}
    (( segid "    " and resid 97   and name HN  ))
    (( segid "    " and resid 96   and name HA2 ))
       3.400     1.500     1.500 peak  1007 spectrum    1 weight  0.10000E+01 volume  0.13995E-02 ppm1      7.629 ppm2      3.818 CV     1
  ASSI { 1010}
    (( segid "    " and resid 97   and name HN  ))
    (( segid "    " and resid 93   and name HE21))
       4.700     2.700     1.300 peak  1010 spectrum    1 weight  0.10000E+01 volume  0.16576E-03 ppm1      7.629 ppm2      7.312 CV     1
  ASSI { 1011}
    (( segid "    " and resid 97   and name HN  ))
    (( segid "    " and resid 97   and name HA  ))
       2.500     0.800     0.800 peak  1011 spectrum    1 weight  0.10000E+01 volume  0.43907E-02 ppm1      7.630 ppm2      3.918 CV     1
  ASSI { 1013}
    (( segid "    " and resid 97   and name HN  ))
    (  segid "    " and resid 97   and name HB% )
       2.400     0.700     0.700 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.55476E-02 ppm1      7.629 ppm2      0.167 CV     1
  ASSI { 1014}
    (( segid "    " and resid 103  and name HN  ))
    (( segid "    " and resid 99   and name HA  ))
       6.000     6.000     0.000 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.14661E-05 ppm1      7.612 ppm2      4.347 CV     1
  ASSI { 1017}
    (( segid "    " and resid 103  and name HN  ))
    (( segid "    " and resid 103  and name HA  ))
       2.900     1.100     1.100 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.17144E-02 ppm1      7.606 ppm2      4.074 CV     1
  ASSI { 1018}
    (( segid "    " and resid 103  and name HN  ))
    (( segid "    " and resid 102  and name HA  ))
       4.100     2.100     1.900 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.28352E-03 ppm1      7.605 ppm2      3.804 CV     1
  ASSI { 1019}
    (( segid "    " and resid 103  and name HN  ))
    (  segid "    " and resid 103  and name HB% )
       2.300     0.700     0.700 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.80809E-02 ppm1      7.606 ppm2      1.422 CV     1
  ASSI { 1020}
    (( segid "    " and resid 1    and name HD21))
    (( segid "    " and resid 1    and name HB1 ))
       2.800     1.000     1.000 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.20215E-02 ppm1      7.578 ppm2      2.782 CV     1
  ASSI { 1021}
    (( segid "    " and resid 106  and name HN  ))
    (( segid "    " and resid 105  and name HA  ))
       3.300     1.400     1.400 peak  1021 spectrum    1 weight  0.10000E+01 volume  0.99807E-03 ppm1      7.583 ppm2      4.103 CV     1
  ASSI { 1022}
    (( segid "    " and resid 106  and name HN  ))
    (  segid "    " and resid 105  and name HB% )
       3.400     1.500     1.500 peak  1022 spectrum    1 weight  0.10000E+01 volume  0.83041E-03 ppm1      7.583 ppm2      1.195 CV     1
  ASSI { 1023}
    (( segid "    " and resid 106  and name HN  ))
    (( segid "    " and resid 106  and name HA1 ))
       2.900     1.100     1.100 peak  1023 spectrum    1 weight  0.10000E+01 volume  0.32394E-02 ppm1      7.585 ppm2      3.922 CV     1
  ASSI { 1024}
    (( segid "    " and resid 106  and name HN  ))
    (( segid "    " and resid 106  and name HA2 ))
       2.500     0.800     0.800 peak  1024 spectrum    1 weight  0.10000E+01 volume  0.34519E-02 ppm1      7.584 ppm2      3.627 CV     1
  ASSI { 1025}
    (( segid "    " and resid 107  and name HN  ))
    (( segid "    " and resid 103  and name HA  ))
       3.000     1.100     1.100 peak  1025 spectrum    1 weight  0.10000E+01 volume  0.12643E-02 ppm1      7.561 ppm2      4.083 CV     1
  ASSI { 1026}
    (( segid "    " and resid 107  and name HN  ))
    (( segid "    " and resid 106  and name HA1 ))
       3.700     1.700     1.700 peak  1026 spectrum    1 weight  0.10000E+01 volume  0.13972E-02 ppm1      7.561 ppm2      3.924 CV     1
  ASSI { 1027}
    (( segid "    " and resid 107  and name HN  ))
    (( segid "    " and resid 107  and name HA  ))
       2.700     0.900     0.900 peak  1027 spectrum    1 weight  0.10000E+01 volume  0.24461E-02 ppm1      7.564 ppm2      3.790 CV     1
  ASSI { 1028}
    (( segid "    " and resid 107  and name HN  ))
    (( segid "    " and resid 106  and name HA2 ))
       2.900     1.000     1.000 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.16000E-02 ppm1      7.564 ppm2      3.627 CV     1
  ASSI { 1029}
    (( segid "    " and resid 107  and name HN  ))
    (( segid "    " and resid 108  and name HG1 ))
       3.300     1.400     1.400 peak  1029 spectrum    1 weight  0.10000E+01 volume  0.10529E-02 ppm1      7.561 ppm2      1.457 CV     1
  ASSI { 1030}
    (( segid "    " and resid 107  and name HN  ))
    (  segid "    " and resid 105  and name HB% )
       2.800     2.800     3.200 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.95233E-03 ppm1      7.563 ppm2      1.193 CV     1
  ASSI { 1032}
    (( segid "    " and resid 107  and name HN  ))
    (  segid "    " and resid 107  and name HB% )
       2.500     0.800     0.800 peak  1032 spectrum    1 weight  0.10000E+01 volume  0.42321E-02 ppm1      7.562 ppm2      0.088 CV     1
  ASSI { 1033}
    (( segid "    " and resid 57   and name HN  ))
    (  segid "    " and resid 57   and name HE% )
       5.200     3.400     0.800 peak  1033 spectrum    1 weight  0.10000E+01 volume  0.24879E-03 ppm1      7.563 ppm2      7.654 CV     1
  ASSI { 1034}
    (( segid "    " and resid 57   and name HN  ))
    (( segid "    " and resid 51   and name HB1 ))
       4.400     2.400     1.600 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.11089E-03 ppm1      7.566 ppm2      2.126 CV     1
  ASSI { 1035}
    (( segid "    " and resid 57   and name HN  ))
    (  segid "    " and resid 74   and name HB% )
       3.600     1.700     1.700 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.48200E-03 ppm1      7.560 ppm2      0.829 CV     1
  ASSI { 1036}
    (( segid "    " and resid 57   and name HN  ))
    (( segid "    " and resid 52   and name HN  ))
       3.600     1.600     1.600 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.44736E-03 ppm1      7.569 ppm2      9.248 CV     1
  ASSI { 1037}
    (( segid "    " and resid 57   and name HN  ))
    (( segid "    " and resid 58   and name HN  ))
       6.000     6.000     0.000 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.17590E-04 ppm1      7.561 ppm2      9.015 CV     1
  ASSI { 1038}
    (( segid "    " and resid 57   and name HN  ))
    (  segid "    " and resid 57   and name HD% )
       2.700     2.700     3.300 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.15337E-02 ppm1      7.563 ppm2      7.757 CV     1
  ASSI { 1040}
    (( segid "    " and resid 57   and name HN  ))
    (( segid "    " and resid 57   and name HA  ))
       3.100     1.200     1.200 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.10981E-02 ppm1      7.561 ppm2      4.943 CV     1
  ASSI { 1041}
    (( segid "    " and resid 57   and name HN  ))
    (( segid "    " and resid 57   and name HB2 ))
       3.900     1.900     1.900 peak  1041 spectrum    1 weight  0.10000E+01 volume  0.97300E-03 ppm1      7.564 ppm2      3.785 CV     1
  ASSI { 1042}
    (( segid "    " and resid 57   and name HN  ))
    (( segid "    " and resid 56   and name HA  ))
       2.800     1.000     1.000 peak  1042 spectrum    1 weight  0.10000E+01 volume  0.19306E-02 ppm1      7.563 ppm2      3.475 CV     1
  ASSI { 1043}
    (( segid "    " and resid 57   and name HN  ))
    (( segid "    " and resid 57   and name HB1 ))
       3.100     1.200     1.200 peak  1043 spectrum    1 weight  0.10000E+01 volume  0.19526E-02 ppm1      7.563 ppm2      2.793 CV     1
  ASSI { 1044}
    (( segid "    " and resid 57   and name HN  ))
    (( segid "    " and resid 56   and name HB1 ))
       6.000     6.000     0.000 peak  1044 spectrum    1 weight  0.10000E+01 volume  0.12330E-04 ppm1      7.560 ppm2      1.719 CV     1
  ASSI { 1045}
    (( segid "    " and resid 57   and name HN  ))
    (  segid "    " and resid 55   and name HG1%)
       5.500     3.800     0.500 peak  1045 spectrum    1 weight  0.10000E+01 volume  0.15726E-03 ppm1      7.559 ppm2      0.625 CV     1
  ASSI { 1047}
    (( segid "    " and resid 84   and name HN  ))
    (( segid "    " and resid 87   and name HG2 ))
       4.700     2.800     1.300 peak  1047 spectrum    1 weight  0.10000E+01 volume  0.22458E-03 ppm1      7.566 ppm2      2.476 CV     1
  ASSI { 1048}
    (( segid "    " and resid 84   and name HN  ))
    (( segid "    " and resid 87   and name HB1 ))
       5.200     3.300     0.800 peak  1048 spectrum    1 weight  0.10000E+01 volume  0.16566E-03 ppm1      7.564 ppm2      2.156 CV     1
  ASSI { 1050}
    (( segid "    " and resid 84   and name HN  ))
    (( segid "    " and resid 85   and name HN  ))
       2.600     0.900     0.900 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.26172E-02 ppm1      7.561 ppm2      7.704 CV     1
  ASSI { 1052}
    (( segid "    " and resid 84   and name HN  ))
    (( segid "    " and resid 81   and name HG1 ))
       3.600     3.600     2.400 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.22862E-03 ppm1      7.562 ppm2      2.112 CV     1
  ASSI { 1054}
    (( segid "    " and resid 84   and name HN  ))
    (( segid "    " and resid 83   and name HB  ))
       3.600     1.600     1.600 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.40038E-03 ppm1      7.563 ppm2      1.587 CV     1
  ASSI { 1057}
    (( segid "    " and resid 84   and name HN  ))
    (  segid "    " and resid 83   and name HG2%)
       3.000     1.100     1.100 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.18624E-02 ppm1      7.561 ppm2      0.418 CV     1
  ASSI { 1058}
    (( segid "    " and resid 84   and name HN  ))
    (( segid "    " and resid 87   and name HN  ))
       6.000     6.000     0.000 peak  1058 spectrum    1 weight  0.10000E+01 volume  0.57982E-05 ppm1      7.555 ppm2      8.799 CV     1
  ASSI { 1059}
    (( segid "    " and resid 84   and name HN  ))
    (( segid "    " and resid 82   and name HN  ))
       5.600     3.900     0.400 peak  1059 spectrum    1 weight  0.10000E+01 volume  0.64207E-04 ppm1      7.560 ppm2      8.637 CV     1
  ASSI { 1061}
    (( segid "    " and resid 84   and name HN  ))
    (( segid "    " and resid 84   and name HA  ))
       2.700     0.900     0.900 peak  1061 spectrum    1 weight  0.10000E+01 volume  0.29417E-02 ppm1      7.559 ppm2      3.954 CV     1
  ASSI { 1062}
    (( segid "    " and resid 84   and name HN  ))
    (( segid "    " and resid 85   and name HA  ))
       6.000     6.000     0.000 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.15511E-05 ppm1      7.560 ppm2      3.640 CV     1
  ASSI { 1063}
    (( segid "    " and resid 84   and name HN  ))
    (( segid "    " and resid 80   and name HA  ))
       4.400     2.400     1.600 peak  1063 spectrum    1 weight  0.10000E+01 volume  0.28386E-03 ppm1      7.559 ppm2      3.452 CV     1
  ASSI { 1064}
    (( segid "    " and resid 84   and name HN  ))
    (( segid "    " and resid 81   and name HA  ))
       3.100     1.200     1.200 peak  1064 spectrum    1 weight  0.10000E+01 volume  0.11462E-02 ppm1      7.560 ppm2      3.284 CV     1
  ASSI { 1065}
    (( segid "    " and resid 84   and name HN  ))
    (( segid "    " and resid 83   and name HA  ))
       3.700     1.700     1.700 peak  1065 spectrum    1 weight  0.10000E+01 volume  0.52822E-03 ppm1      7.559 ppm2      2.902 CV     1
  ASSI { 1066}
    (( segid "    " and resid 84   and name HN  ))
    (  segid "    " and resid 84   and name HB% )
       2.200     0.600     0.600 peak  1066 spectrum    1 weight  0.10000E+01 volume  0.95864E-02 ppm1      7.560 ppm2      1.468 CV     1
  ASSI { 1068}
    (( segid "    " and resid 84   and name HN  ))
    (  segid "    " and resid 83   and name HD1%)
       4.100     2.100     1.900 peak  1068 spectrum    1 weight  0.10000E+01 volume  0.11055E-03 ppm1      7.560 ppm2      0.331 CV     1
  ASSI { 1069}
    (( segid "    " and resid 84   and name HN  ))
    (  segid "    " and resid 86   and name HB% )
       6.000     6.000     0.000 peak  1069 spectrum    1 weight  0.10000E+01 volume  0.11796E-04 ppm1      7.566 ppm2      0.766 CV     1
  ASSI { 1071}
    (( segid "    " and resid 84   and name HN  ))
    (( segid "    " and resid 81   and name HB1 ))
       5.000     3.100     1.000 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.95891E-04 ppm1      7.560 ppm2      1.795 CV     1
  ASSI { 1072}
    (( segid "    " and resid 74   and name HN  ))
    (( segid "    " and resid 59   and name HE21))
       6.000     6.000     0.000 peak  1072 spectrum    1 weight  0.10000E+01 volume  0.86458E-05 ppm1      7.506 ppm2      8.853 CV     1
  ASSI { 1075}
    (( segid "    " and resid 81   and name HN  ))
    (( segid "    " and resid 81   and name HB1 ))
       3.300     1.300     1.300 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.17174E-02 ppm1      7.563 ppm2      1.806 CV     1
  ASSI { 1076}
    (( segid "    " and resid 81   and name HN  ))
    (( segid "    " and resid 81   and name HG1 ))
       3.000     1.100     1.100 peak  1076 spectrum    1 weight  0.10000E+01 volume  0.18976E-02 ppm1      7.558 ppm2      2.122 CV     1
  ASSI { 1077}
    (( segid "    " and resid 81   and name HN  ))
    (( segid "    " and resid 83   and name HN  ))
       4.200     2.200     1.800 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.21986E-03 ppm1      7.568 ppm2      8.378 CV     1
  ASSI { 1080}
    (( segid "    " and resid 81   and name HN  ))
    (( segid "    " and resid 80   and name HA  ))
       4.300     2.300     1.700 peak  1080 spectrum    1 weight  0.10000E+01 volume  0.19356E-03 ppm1      7.561 ppm2      3.458 CV     1
  ASSI { 1081}
    (( segid "    " and resid 81   and name HN  ))
    (( segid "    " and resid 81   and name HA  ))
       2.900     1.100     1.100 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.15363E-02 ppm1      7.561 ppm2      3.279 CV     1
  ASSI { 1082}
    (( segid "    " and resid 81   and name HN  ))
    (( segid "    " and resid 81   and name HB2 ))
       2.700     0.900     0.900 peak  1082 spectrum    1 weight  0.10000E+01 volume  0.14750E-02 ppm1      7.562 ppm2      1.925 CV     1
  ASSI { 1083}
    (( segid "    " and resid 81   and name HN  ))
    (  segid "    " and resid 84   and name HB% )
       4.300     2.300     1.700 peak  1083 spectrum    1 weight  0.10000E+01 volume  0.43104E-03 ppm1      7.561 ppm2      1.477 CV     1
  ASSI { 1084}
    (( segid "    " and resid 81   and name HN  ))
    (  segid "    " and resid 78   and name HG2%)
       2.500     2.500     3.500 peak  1084 spectrum    1 weight  0.10000E+01 volume  0.22886E-02 ppm1      7.562 ppm2      1.298 CV     1
  ASSI { 1085}
    (( segid "    " and resid 81   and name HN  ))
    (( segid "    " and resid 81   and name HG2 ))
       2.700     0.900     0.900 peak  1085 spectrum    1 weight  0.10000E+01 volume  0.35762E-02 ppm1      7.559 ppm2      2.382 CV     1
  ASSI { 1090}
    (( segid "    " and resid 51   and name HN  ))
    (( segid "    " and resid 58   and name HA  ))
       5.200     3.400     0.800 peak  1090 spectrum    1 weight  0.10000E+01 volume  0.17675E-03 ppm1      7.529 ppm2      5.381 CV     1
  ASSI { 1094}
    (( segid "    " and resid 51   and name HN  ))
    (( segid "    " and resid 58   and name HB1 ))
       6.000     6.000     0.000 peak  1094 spectrum    1 weight  0.10000E+01 volume  0.25452E-04 ppm1      7.544 ppm2      2.810 CV     1
  ASSI { 1095}
    (( segid "    " and resid 51   and name HN  ))
    (( segid "    " and resid 51   and name HB2 ))
       2.800     1.000     1.000 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.19350E-02 ppm1      7.542 ppm2      2.473 CV     1
  ASSI { 1096}
    (( segid "    " and resid 51   and name HN  ))
    (( segid "    " and resid 49   and name HN  ))
       3.000     1.200     1.200 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.17412E-02 ppm1      7.540 ppm2      7.897 CV     1
  ASSI { 1097}
    (( segid "    " and resid 51   and name HN  ))
    (  segid "    " and resid 51   and name HD% )
       2.700     0.900     0.900 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.30382E-02 ppm1      7.539 ppm2      6.913 CV     1
  ASSI { 1098}
    (( segid "    " and resid 51   and name HN  ))
    (( segid "    " and resid 51   and name HA  ))
       2.900     1.000     1.000 peak  1098 spectrum    1 weight  0.10000E+01 volume  0.15046E-02 ppm1      7.540 ppm2      4.869 CV     1
  ASSI { 1099}
    (( segid "    " and resid 51   and name HN  ))
    (( segid "    " and resid 49   and name HA  ))
       4.500     2.500     1.500 peak  1099 spectrum    1 weight  0.10000E+01 volume  0.28404E-03 ppm1      7.537 ppm2      4.623 CV     1
  ASSI { 1100}
    (( segid "    " and resid 51   and name HN  ))
    (( segid "    " and resid 50   and name HA1 ))
       3.100     1.200     1.200 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.14110E-02 ppm1      7.540 ppm2      3.943 CV     1
  ASSI { 1101}
    (( segid "    " and resid 51   and name HN  ))
    (( segid "    " and resid 49   and name HB1 ))
       5.900     4.300     0.100 peak  1101 spectrum    1 weight  0.10000E+01 volume  0.50407E-04 ppm1      7.540 ppm2      2.714 CV     1
  ASSI { 1102}
    (( segid "    " and resid 51   and name HN  ))
    (( segid "    " and resid 51   and name HB1 ))
       3.500     1.500     1.500 peak  1102 spectrum    1 weight  0.10000E+01 volume  0.17536E-02 ppm1      7.538 ppm2      2.123 CV     1
  ASSI { 1103}
    (( segid "    " and resid 108  and name HN  ))
    (( segid "    " and resid 95   and name HD1 ))
       4.200     2.200     1.800 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.20597E-03 ppm1      7.530 ppm2      7.199 CV     1
  ASSI { 1104}
    (( segid "    " and resid 108  and name HN  ))
    (( segid "    " and resid 94   and name HA2 ))
       3.600     3.600     2.400 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.23743E-03 ppm1      7.533 ppm2      4.296 CV     1
  ASSI { 1105}
    (( segid "    " and resid 108  and name HN  ))
    (( segid "    " and resid 108  and name HA  ))
       2.700     0.900     0.900 peak  1105 spectrum    1 weight  0.10000E+01 volume  0.28599E-02 ppm1      7.531 ppm2      4.105 CV     1
  ASSI { 1106}
    (( segid "    " and resid 108  and name HN  ))
    (( segid "    " and resid 107  and name HA  ))
       2.200     0.600     0.600 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.81472E-02 ppm1      7.531 ppm2      3.789 CV     1
  ASSI { 1107}
    (( segid "    " and resid 108  and name HN  ))
    (( segid "    " and resid 108  and name HD1 ))
       4.500     2.500     1.500 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.24998E-03 ppm1      7.531 ppm2      3.124 CV     1
  ASSI { 1108}
    (( segid "    " and resid 108  and name HN  ))
    (( segid "    " and resid 108  and name HB1 ))
       3.400     1.400     1.400 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.18057E-02 ppm1      7.530 ppm2      1.647 CV     1
  ASSI { 1109}
    (( segid "    " and resid 108  and name HN  ))
    (( segid "    " and resid 108  and name HG1 ))
       2.700     0.900     0.900 peak  1109 spectrum    1 weight  0.10000E+01 volume  0.20452E-02 ppm1      7.532 ppm2      1.468 CV     1
  ASSI { 1111}
    (( segid "    " and resid 108  and name HN  ))
    (  segid "    " and resid 107  and name HB% )
       3.000     1.100     1.100 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.20956E-02 ppm1      7.532 ppm2      0.088 CV     1
  ASSI { 1112}
    (( segid "    " and resid 108  and name HN  ))
    (( segid "    " and resid 108  and name HB2 ))
       3.400     1.500     1.500 peak  1112 spectrum    1 weight  0.10000E+01 volume  0.84417E-03 ppm1      7.530 ppm2      1.757 CV     1
  ASSI { 1113}
    (( segid "    " and resid 105  and name HN  ))
    (( segid "    " and resid 102  and name HA  ))
       5.300     3.500     0.700 peak  1113 spectrum    1 weight  0.10000E+01 volume  0.45988E-04 ppm1      7.534 ppm2      3.800 CV     1
  ASSI { 1116}
    (( segid "    " and resid 105  and name HN  ))
    (( segid "    " and resid 104  and name HB2 ))
       3.100     1.200     1.200 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.14239E-02 ppm1      7.528 ppm2      1.847 CV     1
  ASSI { 1117}
    (( segid "    " and resid 105  and name HN  ))
    (( segid "    " and resid 105  and name HA  ))
       2.900     1.100     1.100 peak  1117 spectrum    1 weight  0.10000E+01 volume  0.17648E-02 ppm1      7.526 ppm2      4.115 CV     1
  ASSI { 1118}
    (( segid "    " and resid 105  and name HN  ))
    (( segid "    " and resid 104  and name HA  ))
       3.800     1.800     1.800 peak  1118 spectrum    1 weight  0.10000E+01 volume  0.42299E-03 ppm1      7.522 ppm2      4.012 CV     1
  ASSI { 1119}
    (( segid "    " and resid 105  and name HN  ))
    (  segid "    " and resid 105  and name HB% )
       2.500     0.800     0.800 peak  1119 spectrum    1 weight  0.10000E+01 volume  0.36912E-02 ppm1      7.526 ppm2      1.195 CV     1
  ASSI { 1121}
    (( segid "    " and resid 74   and name HN  ))
    (( segid "    " and resid 73   and name HN  ))
       3.600     1.600     1.600 peak  1121 spectrum    1 weight  0.10000E+01 volume  0.11041E-02 ppm1      7.498 ppm2      6.738 CV     1
  ASSI { 1122}
    (( segid "    " and resid 74   and name HN  ))
    (( segid "    " and resid 73   and name HB1 ))
       3.700     1.700     1.700 peak  1122 spectrum    1 weight  0.10000E+01 volume  0.21445E-02 ppm1      7.501 ppm2      1.260 CV     1
  ASSI { 1124}
    (( segid "    " and resid 74   and name HN  ))
    (( segid "    " and resid 74   and name HA  ))
       2.700     0.900     0.900 peak  1124 spectrum    1 weight  0.10000E+01 volume  0.25669E-02 ppm1      7.499 ppm2      3.959 CV     1
  ASSI { 1125}
    (( segid "    " and resid 74   and name HN  ))
    (( segid "    " and resid 52   and name HB1 ))
       6.000     4.900     0.000 peak  1125 spectrum    1 weight  0.10000E+01 volume  0.42960E-04 ppm1      7.499 ppm2      3.278 CV     1
  ASSI { 1126}
    (( segid "    " and resid 74   and name HN  ))
    (( segid "    " and resid 52   and name HB2 ))
       3.700     1.700     1.700 peak  1126 spectrum    1 weight  0.10000E+01 volume  0.26084E-03 ppm1      7.501 ppm2      2.727 CV     1
  ASSI { 1127}
    (( segid "    " and resid 74   and name HN  ))
    (( segid "    " and resid 76   and name HB1 ))
       6.000     6.000     0.000 peak  1127 spectrum    1 weight  0.10000E+01 volume  0.61163E-05 ppm1      7.500 ppm2      1.728 CV     1
  ASSI { 1128}
    (( segid "    " and resid 74   and name HN  ))
    (( segid "    " and resid 73   and name HG1 ))
       3.200     1.300     1.300 peak  1128 spectrum    1 weight  0.10000E+01 volume  0.15132E-02 ppm1      7.497 ppm2      1.106 CV     1
  ASSI { 1129}
    (( segid "    " and resid 74   and name HN  ))
    (  segid "    " and resid 74   and name HB% )
       2.500     0.800     0.800 peak  1129 spectrum    1 weight  0.10000E+01 volume  0.38052E-02 ppm1      7.500 ppm2      0.826 CV     1
  ASSI { 1130}
    (( segid "    " and resid 49   and name HD21))
    (( segid "    " and resid 49   and name HA  ))
       4.000     2.000     2.000 peak  1130 spectrum    1 weight  0.10000E+01 volume  0.46361E-03 ppm1      7.505 ppm2      4.623 CV     1
  ASSI { 1132}
    (( segid "    " and resid 49   and name HD21))
    (( segid "    " and resid 49   and name HB1 ))
       3.000     1.100     1.100 peak  1132 spectrum    1 weight  0.10000E+01 volume  0.15925E-02 ppm1      7.503 ppm2      2.715 CV     1
  ASSI { 1133}
    (( segid "    " and resid 49   and name HD21))
    (( segid "    " and resid 51   and name HB2 ))
       6.000     6.000     0.000 peak  1133 spectrum    1 weight  0.10000E+01 volume  0.28845E-05 ppm1      7.498 ppm2      2.458 CV     1
  ASSI { 1134}
    (( segid "    " and resid 49   and name HD21))
    (( segid "    " and resid 49   and name HB2 ))
       2.900     1.000     1.000 peak  1134 spectrum    1 weight  0.10000E+01 volume  0.17701E-02 ppm1      7.500 ppm2      3.310 CV     1
  ASSI { 1135}
    (( segid "    " and resid 59   and name HE22))
    (( segid "    " and resid 73   and name HG1 ))
       6.000     6.000     0.000 peak  1135 spectrum    1 weight  0.10000E+01 volume  0.58372E-05 ppm1      7.494 ppm2      1.122 CV     1
  ASSI { 1136}
    (( segid "    " and resid 59   and name HE22))
    (( segid "    " and resid 62   and name HB1 ))
       3.700     1.700     1.700 peak  1136 spectrum    1 weight  0.10000E+01 volume  0.59726E-03 ppm1      7.490 ppm2      3.077 CV     1
  ASSI { 1137}
    (( segid "    " and resid 59   and name HE22))
    (( segid "    " and resid 63   and name HB1 ))
       4.100     2.100     1.900 peak  1137 spectrum    1 weight  0.10000E+01 volume  0.82618E-03 ppm1      7.482 ppm2      2.090 CV     1
  ASSI { 1139}
    (( segid "    " and resid 59   and name HE22))
    (( segid "    " and resid 73   and name HA  ))
       3.200     1.300     1.300 peak  1139 spectrum    1 weight  0.10000E+01 volume  0.59457E-03 ppm1      7.485 ppm2      3.960 CV     1
  ASSI { 1140}
    (( segid "    " and resid 59   and name HE22))
    (( segid "    " and resid 59   and name HG1 ))
       3.200     1.300     1.300 peak  1140 spectrum    1 weight  0.10000E+01 volume  0.25225E-02 ppm1      7.486 ppm2      2.455 CV     1
  ASSI { 1141}
    (( segid "    " and resid 59   and name HE22))
    (  segid "    " and resid 68   and name HD1%)
       3.400     1.400     1.400 peak  1141 spectrum    1 weight  0.10000E+01 volume  0.12298E-02 ppm1      7.488 ppm2      0.996 CV     1
  ASSI { 1142}
    (( segid "    " and resid 59   and name HE22))
    (( segid "    " and resid 59   and name HN  ))
       6.000     6.000     0.000 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.17225E-04 ppm1      7.481 ppm2      9.425 CV     1
  ASSI { 1146}
    (( segid "    " and resid 88   and name HN  ))
    (( segid "    " and resid 89   and name HA  ))
       6.000     6.000     0.000 peak  1146 spectrum    1 weight  0.10000E+01 volume  0.18554E-05 ppm1      7.361 ppm2      3.888 CV     1
  ASSI { 1147}
    (( segid "    " and resid 88   and name HN  ))
    (( segid "    " and resid 65   and name HB1 ))
       5.400     3.600     0.600 peak  1147 spectrum    1 weight  0.10000E+01 volume  0.18555E-03 ppm1      7.361 ppm2      2.271 CV     1
  ASSI { 1148}
    (( segid "    " and resid 88   and name HN  ))
    (( segid "    " and resid 87   and name HB1 ))
       2.900     1.100     1.100 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.24155E-02 ppm1      7.362 ppm2      2.159 CV     1
  ASSI { 1153}
    (( segid "    " and resid 88   and name HN  ))
    (( segid "    " and resid 87   and name HA  ))
       3.500     1.500     1.500 peak  1153 spectrum    1 weight  0.10000E+01 volume  0.57801E-03 ppm1      7.362 ppm2      4.456 CV     1
  ASSI { 1154}
    (( segid "    " and resid 88   and name HN  ))
    (( segid "    " and resid 88   and name HA  ))
       2.500     0.800     0.800 peak  1154 spectrum    1 weight  0.10000E+01 volume  0.40745E-02 ppm1      7.362 ppm2      3.670 CV     1
  ASSI { 1155}
    (( segid "    " and resid 88   and name HN  ))
    (( segid "    " and resid 88   and name HB  ))
       2.200     0.600     0.600 peak  1155 spectrum    1 weight  0.10000E+01 volume  0.63346E-02 ppm1      7.361 ppm2      2.395 CV     1
  ASSI { 1156}
    (( segid "    " and resid 88   and name HN  ))
    (  segid "    " and resid 88   and name HG2%)
       2.400     2.400     3.600 peak  1156 spectrum    1 weight  0.10000E+01 volume  0.62101E-02 ppm1      7.362 ppm2      1.181 CV     1
  ASSI { 1157}
    (( segid "    " and resid 88   and name HN  ))
    (  segid "    " and resid 88   and name HG1%)
       3.300     1.400     1.400 peak  1157 spectrum    1 weight  0.10000E+01 volume  0.35735E-02 ppm1      7.361 ppm2      1.024 CV     1
  ASSI { 1159}
    (( segid "    " and resid 88   and name HN  ))
    (  segid "    " and resid 85   and name HG1%)
       4.400     2.400     1.600 peak  1159 spectrum    1 weight  0.10000E+01 volume  0.34771E-03 ppm1      7.360 ppm2      0.415 CV     1
  ASSI { 1160}
    (( segid "    " and resid 93   and name HE21))
    (( segid "    " and resid 98   and name HZ2 ))
       5.100     3.200     0.900 peak  1160 spectrum    1 weight  0.10000E+01 volume  0.23242E-03 ppm1      7.301 ppm2      6.934 CV     1
  ASSI { 1161}
    (( segid "    " and resid 93   and name HE21))
    (( segid "    " and resid 92   and name HE  ))
       2.900     1.100     1.100 peak  1161 spectrum    1 weight  0.10000E+01 volume  0.16658E-02 ppm1      7.307 ppm2      7.212 CV     1
  ASSI { 1162}
    (( segid "    " and resid 93   and name HE21))
    (( segid "    " and resid 93   and name HG1 ))
       3.000     1.100     1.100 peak  1162 spectrum    1 weight  0.10000E+01 volume  0.85959E-03 ppm1      7.308 ppm2      2.430 CV     1
  ASSI { 1163}
    (( segid "    " and resid 93   and name HE21))
    (( segid "    " and resid 93   and name HB2 ))
       3.400     1.500     1.500 peak  1163 spectrum    1 weight  0.10000E+01 volume  0.18428E-02 ppm1      7.307 ppm2      2.185 CV     1
  ASSI { 1164}
    (( segid "    " and resid 93   and name HE21))
    (( segid "    " and resid 90   and name HB2 ))
       3.700     3.700     2.300 peak  1164 spectrum    1 weight  0.10000E+01 volume  0.19938E-02 ppm1      7.308 ppm2      2.020 CV     1
  ASSI { 1165}
    (( segid "    " and resid 93   and name HE21))
    (  segid "    " and resid 89   and name HG2%)
       3.600     1.600     1.600 peak  1165 spectrum    1 weight  0.10000E+01 volume  0.66384E-03 ppm1      7.308 ppm2      1.081 CV     1
  ASSI { 1167}
    (( segid "    " and resid 93   and name HE21))
    (( segid "    " and resid 90   and name HB1 ))
       4.000     2.000     2.000 peak  1167 spectrum    1 weight  0.10000E+01 volume  0.80134E-03 ppm1      7.304 ppm2      1.952 CV     1
  ASSI { 1168}
    (( segid "    " and resid 93   and name HE21))
    (  segid "    " and resid 97   and name HB% )
       5.000     3.100     1.000 peak  1168 spectrum    1 weight  0.10000E+01 volume  0.82048E-04 ppm1      7.302 ppm2      0.169 CV     1
  ASSI { 1169}
    (( segid "    " and resid 93   and name HE21))
    (( segid "    " and resid 93   and name HA  ))
       6.000     6.000     0.000 peak  1169 spectrum    1 weight  0.10000E+01 volume  0.57648E-05 ppm1      7.304 ppm2      4.666 CV     1
  ASSI { 1171}
    (( segid "    " and resid 77   and name HN  ))
    (( segid "    " and resid 76   and name HN  ))
       2.300     0.600     0.600 peak  1171 spectrum    1 weight  0.10000E+01 volume  0.44869E-02 ppm1      7.294 ppm2      6.699 CV     1
  ASSI { 1172}
    (( segid "    " and resid 77   and name HN  ))
    (( segid "    " and resid 81   and name HB2 ))
       6.000     6.000     0.000 peak  1172 spectrum    1 weight  0.10000E+01 volume  0.50196E-04 ppm1      7.294 ppm2      1.944 CV     1
  ASSI { 1173}
    (( segid "    " and resid 77   and name HN  ))
    (  segid "    " and resid 77   and name HB% )
       2.200     2.200     3.800 peak  1173 spectrum    1 weight  0.10000E+01 volume  0.63944E-02 ppm1      7.294 ppm2      1.805 CV     1
  ASSI { 1174}
    (( segid "    " and resid 77   and name HN  ))
    (( segid "    " and resid 76   and name HG  ))
       3.400     1.400     1.400 peak  1174 spectrum    1 weight  0.10000E+01 volume  0.11144E-02 ppm1      7.294 ppm2      1.392 CV     1
  ASSI { 1176}
    (( segid "    " and resid 77   and name HN  ))
    (( segid "    " and resid 78   and name HN  ))
       5.700     4.100     0.300 peak  1176 spectrum    1 weight  0.10000E+01 volume  0.10590E-03 ppm1      7.293 ppm2      8.778 CV     1
  ASSI { 1177}
    (( segid "    " and resid 77   and name HN  ))
    (( segid "    " and resid 62   and name HZ2 ))
       4.100     2.100     1.900 peak  1177 spectrum    1 weight  0.10000E+01 volume  0.54174E-03 ppm1      7.291 ppm2      7.201 CV     1
  ASSI { 1179}
    (( segid "    " and resid 77   and name HN  ))
    (  segid "    " and resid 76   and name HD2%)
       2.500     2.500     3.500 peak  1179 spectrum    1 weight  0.10000E+01 volume  0.23299E-02 ppm1      7.292 ppm2      0.803 CV     1
  ASSI { 1180}
    (( segid "    " and resid 77   and name HN  ))
    (( segid "    " and resid 77   and name HA  ))
       4.100     2.100     1.900 peak  1180 spectrum    1 weight  0.10000E+01 volume  0.23681E-03 ppm1      7.297 ppm2      4.826 CV     1
  ASSI { 1181}
    (( segid "    " and resid 77   and name HN  ))
    (  segid "    " and resid 71   and name HB% )
       2.600     0.800     0.800 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.36997E-02 ppm1      7.292 ppm2      1.520 CV     1
  ASSI { 1182}
    (( segid "    " and resid 65   and name HD22))
    (( segid "    " and resid 65   and name HN  ))
       4.000     2.000     2.000 peak  1182 spectrum    1 weight  0.10000E+01 volume  0.53777E-03 ppm1      7.294 ppm2      7.116 CV     1
  ASSI { 1183}
    (( segid "    " and resid 65   and name HD22))
    (( segid "    " and resid 65   and name HB1 ))
       3.800     1.800     1.800 peak  1183 spectrum    1 weight  0.10000E+01 volume  0.81637E-03 ppm1      7.295 ppm2      2.288 CV     1
  ASSI { 1184}
    (( segid "    " and resid 65   and name HD22))
    (( segid "    " and resid 61   and name HA  ))
       4.000     2.000     2.000 peak  1184 spectrum    1 weight  0.10000E+01 volume  0.38826E-03 ppm1      7.292 ppm2      3.997 CV     1
  ASSI { 1185}
    (( segid "    " and resid 65   and name HD22))
    (( segid "    " and resid 89   and name HA  ))
       4.200     2.200     1.800 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.17108E-03 ppm1      7.292 ppm2      3.883 CV     1
  ASSI { 1186}
    (( segid "    " and resid 65   and name HD22))
    (  segid "    " and resid 64   and name HB% )
       3.200     1.300     1.300 peak  1186 spectrum    1 weight  0.10000E+01 volume  0.13247E-02 ppm1      7.287 ppm2      1.486 CV     1
  ASSI { 1187}
    (( segid "    " and resid 65   and name HD22))
    (  segid "    " and resid 61   and name HG2%)
       2.800     0.900     0.900 peak  1187 spectrum    1 weight  0.10000E+01 volume  0.20199E-02 ppm1      7.292 ppm2      1.413 CV     1
  ASSI { 1188}
    (( segid "    " and resid 65   and name HD22))
    (  segid "    " and resid 89   and name HG2%)
       3.100     1.200     1.200 peak  1188 spectrum    1 weight  0.10000E+01 volume  0.90291E-03 ppm1      7.291 ppm2      1.079 CV     1
  ASSI { 1189}
    (( segid "    " and resid 65   and name HD22))
    (( segid "    " and resid 65   and name HB2 ))
       4.200     2.200     1.800 peak  1189 spectrum    1 weight  0.10000E+01 volume  0.44295E-03 ppm1      7.293 ppm2      2.917 CV     1
  ASSI { 1191}
    (( segid "    " and resid 37   and name HN  ))
    (( segid "    " and resid 37   and name HA  ))
       2.700     0.900     0.900 peak  1191 spectrum    1 weight  0.10000E+01 volume  0.29286E-02 ppm1      7.276 ppm2      4.317 CV     1
  ASSI { 1192}
    (( segid "    " and resid 37   and name HN  ))
    (( segid "    " and resid 34   and name HA  ))
       3.900     1.900     1.900 peak  1192 spectrum    1 weight  0.10000E+01 volume  0.39295E-03 ppm1      7.278 ppm2      3.398 CV     1
  ASSI { 1194}
    (( segid "    " and resid 37   and name HN  ))
    (( segid "    " and resid 101  and name HB1 ))
       4.000     2.000     2.000 peak  1194 spectrum    1 weight  0.10000E+01 volume  0.77414E-03 ppm1      7.278 ppm2      3.018 CV     1
  ASSI { 1196}
    (( segid "    " and resid 37   and name HN  ))
    (( segid "    " and resid 36   and name HA2 ))
       3.200     1.300     1.300 peak  1196 spectrum    1 weight  0.10000E+01 volume  0.10483E-02 ppm1      7.274 ppm2      3.836 CV     1
  ASSI { 1197}
    (( segid "    " and resid 37   and name HN  ))
    (( segid "    " and resid 36   and name HA1 ))
       3.700     1.700     1.700 peak  1197 spectrum    1 weight  0.10000E+01 volume  0.65019E-03 ppm1      7.270 ppm2      3.511 CV     1
  ASSI { 1198}
    (( segid "    " and resid 37   and name HN  ))
    (( segid "    " and resid 37   and name HB2 ))
       2.900     1.100     1.100 peak  1198 spectrum    1 weight  0.10000E+01 volume  0.37325E-02 ppm1      7.270 ppm2      3.207 CV     1
  ASSI { 1199}
    (( segid "    " and resid 37   and name HN  ))
    (  segid "    " and resid 35   and name HB% )
       6.000     4.900     0.000 peak  1199 spectrum    1 weight  0.10000E+01 volume  0.44316E-04 ppm1      7.273 ppm2      0.502 CV     1
  ASSI { 1200}
    (( segid "    " and resid 46   and name HD21))
    (  segid "    " and resid 52   and name HE% )
       3.700     1.700     1.700 peak  1200 spectrum    1 weight  0.10000E+01 volume  0.65156E-03 ppm1      7.274 ppm2      6.743 CV     1
  ASSI { 1202}
    (( segid "    " and resid 46   and name HD21))
    (( segid "    " and resid 46   and name HB1 ))
       3.300     1.300     1.300 peak  1202 spectrum    1 weight  0.10000E+01 volume  0.12664E-02 ppm1      7.272 ppm2      2.925 CV     1
  ASSI { 1203}
    (( segid "    " and resid 31   and name HN  ))
    (( segid "    " and resid 30   and name HG12))
       4.400     2.500     1.600 peak  1203 spectrum    1 weight  0.10000E+01 volume  0.20889E-03 ppm1      7.219 ppm2      1.135 CV     1
  ASSI { 1204}
    (( segid "    " and resid 31   and name HD1 ))
    (( segid "    " and resid 30   and name HG11))
       4.400     2.400     1.600 peak  1204 spectrum    1 weight  0.10000E+01 volume  0.25064E-03 ppm1      7.211 ppm2      0.829 CV     1
  ASSI { 1207}
    (( segid "    " and resid 31   and name HN  ))
    (( segid "    " and resid 31   and name HA  ))
       2.700     0.900     0.900 peak  1207 spectrum    1 weight  0.10000E+01 volume  0.18571E-02 ppm1      7.206 ppm2      4.435 CV     1
  ASSI { 1208}
    (( segid "    " and resid 31   and name HN  ))
    (( segid "    " and resid 29   and name HB2 ))
       4.300     2.300     1.700 peak  1208 spectrum    1 weight  0.10000E+01 volume  0.62211E-03 ppm1      7.207 ppm2      3.986 CV     1
  ASSI { 1209}
    (( segid "    " and resid 31   and name HN  ))
    (( segid "    " and resid 30   and name HA  ))
       3.400     1.400     1.400 peak  1209 spectrum    1 weight  0.10000E+01 volume  0.69746E-03 ppm1      7.206 ppm2      3.873 CV     1
  ASSI { 1210}
    (( segid "    " and resid 31   and name HN  ))
    (( segid "    " and resid 31   and name HB2 ))
       2.900     1.000     1.000 peak  1210 spectrum    1 weight  0.10000E+01 volume  0.89266E-03 ppm1      7.206 ppm2      3.131 CV     1
  ASSI { 1211}
    (( segid "    " and resid 31   and name HN  ))
    (( segid "    " and resid 32   and name HB1 ))
       4.400     2.500     1.600 peak  1211 spectrum    1 weight  0.10000E+01 volume  0.58059E-03 ppm1      7.206 ppm2      2.786 CV     1
  ASSI { 1212}
    (( segid "    " and resid 31   and name HN  ))
    (( segid "    " and resid 30   and name HB  ))
       2.800     1.000     1.000 peak  1212 spectrum    1 weight  0.10000E+01 volume  0.16588E-02 ppm1      7.209 ppm2      1.643 CV     1
  ASSI { 1213}
    (( segid "    " and resid 31   and name HN  ))
    (  segid "    " and resid 30   and name HD1%)
       4.000     2.000     2.000 peak  1213 spectrum    1 weight  0.10000E+01 volume  0.93061E-03 ppm1      7.209 ppm2      0.526 CV     1
  ASSI { 1214}
    (( segid "    " and resid 31   and name HN  ))
    (  segid "    " and resid 30   and name HG2%)
       3.400     3.400     2.600 peak  1214 spectrum    1 weight  0.10000E+01 volume  0.20306E-02 ppm1      7.206 ppm2      0.094 CV     1
  ASSI { 1215}
    (( segid "    " and resid 31   and name HN  ))
    (( segid "    " and resid 31   and name HB1 ))
       4.100     2.100     1.900 peak  1215 spectrum    1 weight  0.10000E+01 volume  0.74342E-03 ppm1      7.203 ppm2      3.391 CV     1
  ASSI { 1218}
    (( segid "    " and resid 46   and name HD22))
    (  segid "    " and resid 52   and name HE% )
       3.200     3.200     2.800 peak  1218 spectrum    1 weight  0.10000E+01 volume  0.11486E-02 ppm1      7.209 ppm2      6.740 CV     1
  ASSI { 1219}
    (( segid "    " and resid 46   and name HD22))
    (( segid "    " and resid 46   and name HB2 ))
       4.700     2.800     1.300 peak  1219 spectrum    1 weight  0.10000E+01 volume  0.39694E-03 ppm1      7.209 ppm2      3.076 CV     1
  ASSI { 1220}
    (( segid "    " and resid 46   and name HD22))
    (( segid "    " and resid 46   and name HB1 ))
       4.100     2.100     1.900 peak  1220 spectrum    1 weight  0.10000E+01 volume  0.91756E-03 ppm1      7.209 ppm2      2.925 CV     1
  ASSI { 1221}
    (( segid "    " and resid 65   and name HN  ))
    (( segid "    " and resid 67   and name HN  ))
       4.400     2.400     1.600 peak  1221 spectrum    1 weight  0.10000E+01 volume  0.36928E-03 ppm1      7.115 ppm2      8.110 CV     1
  ASSI { 1223}
    (( segid "    " and resid 65   and name HN  ))
    (( segid "    " and resid 65   and name HA  ))
       6.000     5.000     0.000 peak  1223 spectrum    1 weight  0.10000E+01 volume  0.17890E-04 ppm1      7.113 ppm2      4.823 CV     1
  ASSI { 1224}
    (( segid "    " and resid 65   and name HN  ))
    (( segid "    " and resid 61   and name HA  ))
       3.900     1.900     1.900 peak  1224 spectrum    1 weight  0.10000E+01 volume  0.66615E-03 ppm1      7.112 ppm2      3.995 CV     1
  ASSI { 1226}
    (( segid "    " and resid 65   and name HN  ))
    (( segid "    " and resid 65   and name HB2 ))
       2.700     0.900     0.900 peak  1226 spectrum    1 weight  0.10000E+01 volume  0.18630E-02 ppm1      7.113 ppm2      2.918 CV     1
  ASSI { 1227}
    (( segid "    " and resid 65   and name HN  ))
    (( segid "    " and resid 65   and name HB1 ))
       3.200     1.300     1.300 peak  1227 spectrum    1 weight  0.10000E+01 volume  0.25102E-02 ppm1      7.111 ppm2      2.283 CV     1
  ASSI { 1228}
    (( segid "    " and resid 65   and name HN  ))
    (  segid "    " and resid 64   and name HB% )
       2.600     2.600     3.400 peak  1228 spectrum    1 weight  0.10000E+01 volume  0.39986E-02 ppm1      7.112 ppm2      1.486 CV     1
  ASSI { 1229}
    (( segid "    " and resid 65   and name HN  ))
    (  segid "    " and resid 61   and name HG2%)
       4.400     2.500     1.600 peak  1229 spectrum    1 weight  0.10000E+01 volume  0.19011E-03 ppm1      7.112 ppm2      1.417 CV     1
  ASSI { 1230}
    (( segid "    " and resid 65   and name HN  ))
    (  segid "    " and resid 88   and name HG1%)
       4.400     2.400     1.600 peak  1230 spectrum    1 weight  0.10000E+01 volume  0.58816E-03 ppm1      7.109 ppm2      1.018 CV     1
  ASSI { 1231}
    (( segid "    " and resid 65   and name HN  ))
    (  segid "    " and resid 85   and name HG1%)
       4.000     2.000     2.000 peak  1231 spectrum    1 weight  0.10000E+01 volume  0.54427E-03 ppm1      7.113 ppm2      0.423 CV     1
  ASSI { 1232}
    (( segid "    " and resid 65   and name HN  ))
    (( segid "    " and resid 65   and name HD21))
       3.000     1.100     1.100 peak  1232 spectrum    1 weight  0.10000E+01 volume  0.13635E-02 ppm1      7.108 ppm2      7.688 CV     1
  ASSI { 1233}
    (( segid "    " and resid 65   and name HN  ))
    (( segid "    " and resid 88   and name HB  ))
       5.400     3.600     0.600 peak  1233 spectrum    1 weight  0.10000E+01 volume  0.25095E-03 ppm1      7.120 ppm2      2.385 CV     1
  ASSI { 1236}
    (( segid "    " and resid 65   and name HN  ))
    (( segid "    " and resid 64   and name HA  ))
       3.400     1.400     1.400 peak  1236 spectrum    1 weight  0.10000E+01 volume  0.11481E-02 ppm1      7.114 ppm2      4.132 CV     1
  ASSI { 1237}
    (( segid "    " and resid 69   and name HN  ))
    (( segid "    " and resid 66   and name HA1 ))
       4.500     2.600     1.500 peak  1237 spectrum    1 weight  0.10000E+01 volume  0.20001E-03 ppm1      7.112 ppm2      3.666 CV     1
  ASSI { 1238}
    (( segid "    " and resid 69   and name HN  ))
    (( segid "    " and resid 70   and name HA  ))
       6.000     6.000     0.000 peak  1238 spectrum    1 weight  0.10000E+01 volume  0.24463E-05 ppm1      7.100 ppm2      4.754 CV     1
  ASSI { 1240}
    (( segid "    " and resid 69   and name HN  ))
    (( segid "    " and resid 68   and name HA  ))
       2.900     1.100     1.100 peak  1240 spectrum    1 weight  0.10000E+01 volume  0.15607E-02 ppm1      7.104 ppm2      4.315 CV     1
  ASSI { 1247}
    (( segid "    " and resid 69   and name HN  ))
    (( segid "    " and resid 69   and name HA  ))
       2.400     0.700     0.700 peak  1247 spectrum    1 weight  0.10000E+01 volume  0.64986E-02 ppm1      7.101 ppm2      3.780 CV     1
  ASSI { 1248}
    (( segid "    " and resid 69   and name HN  ))
    (( segid "    " and resid 70   and name HB2 ))
       4.800     2.900     1.200 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.31972E-03 ppm1      7.102 ppm2      2.919 CV     1
  ASSI { 1249}
    (( segid "    " and resid 69   and name HN  ))
    (( segid "    " and resid 67   and name HA2 ))
       4.300     2.300     1.700 peak  1249 spectrum    1 weight  0.10000E+01 volume  0.19016E-03 ppm1      7.102 ppm2      2.382 CV     1
  ASSI { 1250}
    (( segid "    " and resid 69   and name HN  ))
    (( segid "    " and resid 68   and name HB2 ))
       2.800     1.000     1.000 peak  1250 spectrum    1 weight  0.10000E+01 volume  0.15830E-02 ppm1      7.101 ppm2      1.650 CV     1
  ASSI { 1251}
    (( segid "    " and resid 69   and name HN  ))
    (( segid "    " and resid 68   and name HB1 ))
       3.400     1.500     1.500 peak  1251 spectrum    1 weight  0.10000E+01 volume  0.13552E-02 ppm1      7.100 ppm2      1.525 CV     1
  ASSI { 1252}
    (( segid "    " and resid 69   and name HN  ))
    (( segid "    " and resid 69   and name HB1 ))
       2.100     0.500     0.500 peak  1252 spectrum    1 weight  0.10000E+01 volume  0.93845E-02 ppm1      7.102 ppm2      1.311 CV     1
  ASSI { 1253}
    (( segid "    " and resid 69   and name HN  ))
    (( segid "    " and resid 69   and name HG1 ))
       2.400     0.700     0.700 peak  1253 spectrum    1 weight  0.10000E+01 volume  0.13493E-01 ppm1      7.102 ppm2      1.036 CV     1
  ASSI { 1254}
    (( segid "    " and resid 69   and name HN  ))
    (  segid "    " and resid 68   and name HD2%)
       3.800     3.800     2.200 peak  1254 spectrum    1 weight  0.10000E+01 volume  0.16315E-02 ppm1      7.102 ppm2      0.845 CV     1
  ASSI { 1255}
    (( segid "    " and resid 42   and name HN  ))
    (( segid "    " and resid 39   and name HA  ))
       5.900     4.300     0.100 peak  1255 spectrum    1 weight  0.10000E+01 volume  0.14777E-03 ppm1      7.091 ppm2      4.593 CV     1
  ASSI { 1257}
    (( segid "    " and resid 42   and name HN  ))
    (( segid "    " and resid 41   and name HN  ))
       2.800     1.000     1.000 peak  1257 spectrum    1 weight  0.10000E+01 volume  0.17479E-02 ppm1      7.086 ppm2      7.897 CV     1
  ASSI { 1258}
    (( segid "    " and resid 42   and name HN  ))
    (( segid "    " and resid 42   and name HA  ))
       2.800     1.000     1.000 peak  1258 spectrum    1 weight  0.10000E+01 volume  0.19716E-02 ppm1      7.089 ppm2      4.875 CV     1
  ASSI { 1259}
    (( segid "    " and resid 42   and name HN  ))
    (( segid "    " and resid 41   and name HA1 ))
       3.700     1.700     1.700 peak  1259 spectrum    1 weight  0.10000E+01 volume  0.16326E-02 ppm1      7.088 ppm2      4.125 CV     1
  ASSI { 1261}
    (( segid "    " and resid 42   and name HN  ))
    (( segid "    " and resid 41   and name HA2 ))
       2.900     1.100     1.100 peak  1261 spectrum    1 weight  0.10000E+01 volume  0.12832E-02 ppm1      7.087 ppm2      3.125 CV     1
  ASSI { 1262}
    (( segid "    " and resid 42   and name HN  ))
    (( segid "    " and resid 42   and name HB1 ))
       2.600     0.800     0.800 peak  1262 spectrum    1 weight  0.10000E+01 volume  0.38713E-02 ppm1      7.089 ppm2      2.745 CV     1
  ASSI { 1263}
    (( segid "    " and resid 42   and name HN  ))
    (( segid "    " and resid 43   and name HB2 ))
       5.500     3.800     0.500 peak  1263 spectrum    1 weight  0.10000E+01 volume  0.11404E-03 ppm1      7.074 ppm2      3.513 CV     1
  ASSI { 1264}
    (( segid "    " and resid 42   and name HD22))
    (( segid "    " and resid 42   and name HB1 ))
       3.600     1.600     1.600 peak  1264 spectrum    1 weight  0.10000E+01 volume  0.13842E-02 ppm1      7.060 ppm2      2.745 CV     1
  ASSI { 1267}
    (( segid "    " and resid 42   and name HD22))
    (( segid "    " and resid 45   and name HA  ))
       3.900     1.900     1.900 peak  1267 spectrum    1 weight  0.10000E+01 volume  0.52652E-03 ppm1      7.058 ppm2      3.782 CV     1
  ASSI { 1268}
    (( segid "    " and resid 42   and name HD22))
    (( segid "    " and resid 45   and name HG11))
       4.700     2.700     1.300 peak  1268 spectrum    1 weight  0.10000E+01 volume  0.13246E-03 ppm1      7.056 ppm2      1.348 CV     1
  ASSI { 1269}
    (( segid "    " and resid 42   and name HD22))
    (  segid "    " and resid 44   and name HB% )
       3.700     1.700     1.700 peak  1269 spectrum    1 weight  0.10000E+01 volume  0.64130E-03 ppm1      7.059 ppm2      1.504 CV     1
  ASSI { 1270}
    (( segid "    " and resid 93   and name HE22))
    (( segid "    " and resid 92   and name HE  ))
       4.000     2.000     2.000 peak  1270 spectrum    1 weight  0.10000E+01 volume  0.39577E-03 ppm1      7.021 ppm2      7.213 CV     1
  ASSI { 1272}
    (( segid "    " and resid 93   and name HE22))
    (  segid "    " and resid 89   and name HG2%)
       3.300     1.400     1.400 peak  1272 spectrum    1 weight  0.10000E+01 volume  0.49703E-03 ppm1      7.021 ppm2      1.077 CV     1
  ASSI { 1273}
    (( segid "    " and resid 93   and name HE22))
    (( segid "    " and resid 97   and name HA  ))
       6.000     6.000     0.000 peak  1273 spectrum    1 weight  0.10000E+01 volume  0.28932E-05 ppm1      7.019 ppm2      3.919 CV     1
  ASSI { 1274}
    (( segid "    " and resid 93   and name HE22))
    (( segid "    " and resid 93   and name HG1 ))
       4.400     2.400     1.600 peak  1274 spectrum    1 weight  0.10000E+01 volume  0.35611E-03 ppm1      7.019 ppm2      2.428 CV     1
  ASSI { 1275}
    (( segid "    " and resid 93   and name HE22))
    (( segid "    " and resid 93   and name HB2 ))
       4.400     2.400     1.600 peak  1275 spectrum    1 weight  0.10000E+01 volume  0.61234E-03 ppm1      7.019 ppm2      2.182 CV     1
  ASSI { 1276}
    (( segid "    " and resid 93   and name HE22))
    (( segid "    " and resid 97   and name HN  ))
       4.500     2.500     1.500 peak  1276 spectrum    1 weight  0.10000E+01 volume  0.23686E-03 ppm1      7.023 ppm2      7.645 CV     1
  ASSI { 1277}
    (( segid "    " and resid 93   and name HE22))
    (  segid "    " and resid 61   and name HG2%)
       3.200     3.200     2.800 peak  1277 spectrum    1 weight  0.10000E+01 volume  0.43598E-03 ppm1      7.020 ppm2      1.408 CV     1
  ASSI { 1278}
    (( segid "    " and resid 93   and name HE22))
    (  segid "    " and resid 97   and name HB% )
       4.000     2.000     2.000 peak  1278 spectrum    1 weight  0.10000E+01 volume  0.25275E-03 ppm1      7.022 ppm2      0.175 CV     1
  ASSI { 1279}
    (( segid "    " and resid 49   and name HD22))
    (( segid "    " and resid 49   and name HA  ))
       6.000     4.700     0.000 peak  1279 spectrum    1 weight  0.10000E+01 volume  0.85300E-04 ppm1      6.995 ppm2      4.623 CV     1
  ASSI { 1280}
    (( segid "    " and resid 49   and name HD22))
    (( segid "    " and resid 49   and name HB1 ))
       3.900     1.900     1.900 peak  1280 spectrum    1 weight  0.10000E+01 volume  0.94416E-03 ppm1      6.998 ppm2      2.715 CV     1
  ASSI { 1281}
    (( segid "    " and resid 49   and name HD22))
    (( segid "    " and resid 49   and name HB2 ))
       3.900     1.900     1.900 peak  1281 spectrum    1 weight  0.10000E+01 volume  0.97300E-03 ppm1      6.997 ppm2      3.303 CV     1
  ASSI { 1282}
    (( segid "    " and resid 82   and name HE22))
    (( segid "    " and resid 56   and name HN  ))
       3.800     1.800     1.800 peak  1282 spectrum    1 weight  0.10000E+01 volume  0.16813E-03 ppm1      6.985 ppm2      7.718 CV     1
  ASSI { 1283}
    (( segid "    " and resid 82   and name HE22))
    (( segid "    " and resid 43   and name HB2 ))
       6.000     6.000     0.000 peak  1283 spectrum    1 weight  0.10000E+01 volume  0.14619E-05 ppm1      6.977 ppm2      3.505 CV     1
  ASSI { 1284}
    (( segid "    " and resid 1    and name HD22))
    (( segid "    " and resid 1    and name HB1 ))
       4.000     2.000     2.000 peak  1284 spectrum    1 weight  0.10000E+01 volume  0.10294E-02 ppm1      6.871 ppm2      2.784 CV     1
  ASSI { 1289}
    (( segid "    " and resid 45   and name HN  ))
    (( segid "    " and resid 44   and name HA  ))
       3.400     1.500     1.500 peak  1289 spectrum    1 weight  0.10000E+01 volume  0.61322E-03 ppm1      6.817 ppm2      5.111 CV     1
  ASSI { 1290}
    (( segid "    " and resid 45   and name HN  ))
    (( segid "    " and resid 53   and name HA2 ))
       4.900     2.900     1.100 peak  1290 spectrum    1 weight  0.10000E+01 volume  0.13114E-03 ppm1      6.818 ppm2      4.030 CV     1
  ASSI { 1291}
    (( segid "    " and resid 45   and name HN  ))
    (( segid "    " and resid 45   and name HA  ))
       2.800     1.000     1.000 peak  1291 spectrum    1 weight  0.10000E+01 volume  0.16857E-02 ppm1      6.818 ppm2      3.783 CV     1
  ASSI { 1292}
    (( segid "    " and resid 45   and name HN  ))
    (( segid "    " and resid 42   and name HB1 ))
       4.700     2.700     1.300 peak  1292 spectrum    1 weight  0.10000E+01 volume  0.14514E-03 ppm1      6.819 ppm2      2.739 CV     1
  ASSI { 1293}
    (( segid "    " and resid 45   and name HN  ))
    (( segid "    " and resid 45   and name HB  ))
       2.400     0.700     0.700 peak  1293 spectrum    1 weight  0.10000E+01 volume  0.26814E-02 ppm1      6.818 ppm2      1.830 CV     1
  ASSI { 1294}
    (( segid "    " and resid 45   and name HN  ))
    (  segid "    " and resid 44   and name HB% )
       3.300     1.300     1.300 peak  1294 spectrum    1 weight  0.10000E+01 volume  0.18640E-02 ppm1      6.818 ppm2      1.505 CV     1
  ASSI { 1295}
    (( segid "    " and resid 45   and name HN  ))
    (( segid "    " and resid 45   and name HG11))
       3.700     1.700     1.700 peak  1295 spectrum    1 weight  0.10000E+01 volume  0.11950E-02 ppm1      6.819 ppm2      1.350 CV     1
  ASSI { 1297}
    (( segid "    " and resid 45   and name HN  ))
    (  segid "    " and resid 45   and name HD1%)
       4.500     2.500     1.500 peak  1297 spectrum    1 weight  0.10000E+01 volume  0.88608E-03 ppm1      6.818 ppm2      0.902 CV     1
  ASSI { 1298}
    (( segid "    " and resid 45   and name HN  ))
    (  segid "    " and resid 45   and name HG2%)
       2.700     0.900     0.900 peak  1298 spectrum    1 weight  0.10000E+01 volume  0.38374E-02 ppm1      6.817 ppm2      0.763 CV     1
  ASSI { 1299}
    (( segid "    " and resid 45   and name HN  ))
    (( segid "    " and resid 53   and name HN  ))
       6.000     6.000     0.000 peak  1299 spectrum    1 weight  0.10000E+01 volume  0.11244E-04 ppm1      6.812 ppm2      9.182 CV     1
  ASSI { 1300}
    (( segid "    " and resid 45   and name HN  ))
    (( segid "    " and resid 42   and name HA  ))
       6.000     4.500     0.000 peak  1300 spectrum    1 weight  0.10000E+01 volume  0.68496E-04 ppm1      6.810 ppm2      4.875 CV     1
  ASSI { 1301}
    (( segid "    " and resid 45   and name HN  ))
    (( segid "    " and resid 42   and name HB2 ))
       4.600     2.700     1.400 peak  1301 spectrum    1 weight  0.10000E+01 volume  0.82547E-03 ppm1      6.814 ppm2      3.214 CV     1
  ASSI { 1302}
    (( segid "    " and resid 56   and name HE22))
    (( segid "    " and resid 56   and name HN  ))
       4.400     2.400     1.600 peak  1302 spectrum    1 weight  0.10000E+01 volume  0.53872E-03 ppm1      6.831 ppm2      7.733 CV     1
  ASSI { 1304}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 62   and name HE1 ))
       3.600     1.600     1.600 peak  1304 spectrum    1 weight  0.10000E+01 volume  0.53287E-03 ppm1      6.730 ppm2      9.410 CV     1
  ASSI { 1305}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 72   and name HA  ))
       2.700     0.900     0.900 peak  1305 spectrum    1 weight  0.10000E+01 volume  0.18227E-02 ppm1      6.729 ppm2      4.323 CV     1
  ASSI { 1306}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 73   and name HA  ))
       2.800     1.000     1.000 peak  1306 spectrum    1 weight  0.10000E+01 volume  0.20293E-02 ppm1      6.728 ppm2      3.952 CV     1
  ASSI { 1307}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 72   and name HB2 ))
       3.400     1.400     1.400 peak  1307 spectrum    1 weight  0.10000E+01 volume  0.82860E-03 ppm1      6.729 ppm2      2.447 CV     1
  ASSI { 1309}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 72   and name HB1 ))
       3.100     3.100     2.900 peak  1309 spectrum    1 weight  0.10000E+01 volume  0.26049E-02 ppm1      6.729 ppm2      1.698 CV     1
  ASSI { 1310}
    (( segid "    " and resid 73   and name HN  ))
    (  segid "    " and resid 71   and name HB% )
       2.300     0.700     0.700 peak  1310 spectrum    1 weight  0.10000E+01 volume  0.60686E-02 ppm1      6.729 ppm2      1.518 CV     1
  ASSI { 1311}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 73   and name HG1 ))
       3.600     1.600     1.600 peak  1311 spectrum    1 weight  0.10000E+01 volume  0.13084E-02 ppm1      6.729 ppm2      1.108 CV     1
  ASSI { 1312}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 73   and name HG2 ))
       2.200     0.600     0.600 peak  1312 spectrum    1 weight  0.10000E+01 volume  0.47839E-02 ppm1      6.729 ppm2      0.804 CV     1
  ASSI { 1314}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 72   and name HD1 ))
       3.700     1.700     1.700 peak  1314 spectrum    1 weight  0.10000E+01 volume  0.94619E-03 ppm1      6.726 ppm2      3.548 CV     1
  ASSI { 1315}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 72   and name HG2 ))
       3.200     3.200     2.800 peak  1315 spectrum    1 weight  0.10000E+01 volume  0.10132E-02 ppm1      6.726 ppm2      2.035 CV     1
  ASSI { 1316}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 71   and name HA  ))
       4.100     2.100     1.900 peak  1316 spectrum    1 weight  0.10000E+01 volume  0.33684E-03 ppm1      6.730 ppm2      4.840 CV     1
  ASSI { 1317}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 73   and name HB2 ))
       3.900     1.900     1.900 peak  1317 spectrum    1 weight  0.10000E+01 volume  0.82893E-03 ppm1      6.728 ppm2      1.372 CV     1
  ASSI { 1318}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 73   and name HB1 ))
       3.200     1.200     1.200 peak  1318 spectrum    1 weight  0.10000E+01 volume  0.12341E-02 ppm1      6.729 ppm2      1.268 CV     1
  ASSI { 1319}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 72   and name HG1 ))
       4.300     2.400     1.700 peak  1319 spectrum    1 weight  0.10000E+01 volume  0.59841E-03 ppm1      6.727 ppm2      1.984 CV     1
  ASSI { 1320}
    (( segid "    " and resid 73   and name HN  ))
    (( segid "    " and resid 73   and name HD1 ))
       6.000     5.400     0.000 peak  1320 spectrum    1 weight  0.10000E+01 volume  0.49350E-04 ppm1      6.723 ppm2      2.922 CV     1
  ASSI { 1323}
    (( segid "    " and resid 76   and name HN  ))
    (( segid "    " and resid 76   and name HA  ))
       2.700     0.900     0.900 peak  1323 spectrum    1 weight  0.10000E+01 volume  0.24397E-02 ppm1      6.696 ppm2      4.353 CV     1
  ASSI { 1324}
    (( segid "    " and resid 76   and name HN  ))
    (( segid "    " and resid 76   and name HB2 ))
       2.600     0.900     0.900 peak  1324 spectrum    1 weight  0.10000E+01 volume  0.29568E-02 ppm1      6.698 ppm2      1.781 CV     1
  ASSI { 1326}
    (( segid "    " and resid 76   and name HN  ))
    (  segid "    " and resid 76   and name HD1%)
       6.000     5.000     0.000 peak  1326 spectrum    1 weight  0.10000E+01 volume  0.84182E-04 ppm1      6.701 ppm2      1.108 CV     1
  ASSI { 1327}
    (( segid "    " and resid 76   and name HN  ))
    (  segid "    " and resid 76   and name HD2%)
       3.300     1.400     1.400 peak  1327 spectrum    1 weight  0.10000E+01 volume  0.46949E-02 ppm1      6.697 ppm2      0.802 CV     1
  ASSI { 1328}
    (( segid "    " and resid 76   and name HN  ))
    (  segid "    " and resid 71   and name HB% )
       3.200     1.300     1.300 peak  1328 spectrum    1 weight  0.10000E+01 volume  0.37315E-02 ppm1      6.695 ppm2      1.525 CV     1
  ASSI { 1330}
    (( segid "    " and resid 76   and name HN  ))
    (( segid "    " and resid 73   and name HB1 ))
       5.600     3.900     0.400 peak  1330 spectrum    1 weight  0.10000E+01 volume  0.26434E-03 ppm1      6.698 ppm2      1.276 CV     1
  ASSI { 1331}
    (( segid "    " and resid 73   and name HE  ))
    (( segid "    " and resid 46   and name HD21))
       3.900     1.900     1.900 peak  1331 spectrum    1 weight  0.10000E+01 volume  0.26934E-03 ppm1      9.191 ppm2      7.245 CV     1
  ASSI { 1333}
    (( segid "    " and resid 73   and name HE  ))
    (( segid "    " and resid 73   and name HG1 ))
       2.600     0.900     0.900 peak  1333 spectrum    1 weight  0.10000E+01 volume  0.16545E-02 ppm1      9.189 ppm2      1.110 CV     1
  ASSI { 1334}
    (( segid "    " and resid 73   and name HE  ))
    (( segid "    " and resid 73   and name HD1 ))
       3.200     1.300     1.300 peak  1334 spectrum    1 weight  0.10000E+01 volume  0.90933E-03 ppm1      9.187 ppm2      2.917 CV     1
  ASSI { 1335}
    (( segid "    " and resid 73   and name HE  ))
    (( segid "    " and resid 76   and name HB2 ))
       3.000     1.100     1.100 peak  1335 spectrum    1 weight  0.10000E+01 volume  0.13860E-02 ppm1      9.186 ppm2      1.785 CV     1
  ASSI { 1336}
    (( segid "    " and resid 73   and name HE  ))
    (( segid "    " and resid 73   and name HB2 ))
       4.400     2.500     1.600 peak  1336 spectrum    1 weight  0.10000E+01 volume  0.20666E-03 ppm1      9.186 ppm2      1.377 CV     1
  ASSI { 1337}
    (( segid "    " and resid 73   and name HE  ))
    (( segid "    " and resid 73   and name HG2 ))
       3.400     1.500     1.500 peak  1337 spectrum    1 weight  0.10000E+01 volume  0.12793E-02 ppm1      9.184 ppm2      0.800 CV     1
  ASSI { 1339}
    (( segid "    " and resid 73   and name HE  ))
    (( segid "    " and resid 73   and name HB1 ))
       3.400     1.400     1.400 peak  1339 spectrum    1 weight  0.10000E+01 volume  0.19716E-02 ppm1      9.191 ppm2      1.268 CV     1
  ASSI { 1340}
    (( segid "    " and resid 79   and name HE  ))
    (( segid "    " and resid 43   and name HZ2 ))
       3.100     1.200     1.200 peak  1340 spectrum    1 weight  0.10000E+01 volume  0.68293E-03 ppm1      8.358 ppm2      7.558 CV     1
  ASSI { 1341}
    (( segid "    " and resid 79   and name HE  ))
    (  segid "    " and resid 83   and name HD1%)
       3.500     3.500     2.500 peak  1341 spectrum    1 weight  0.10000E+01 volume  0.78406E-03 ppm1      8.359 ppm2      0.296 CV     1
  ASSI { 1342}
    (( segid "    " and resid 79   and name HE  ))
    (( segid "    " and resid 43   and name HH2 ))
       2.700     0.900     0.900 peak  1342 spectrum    1 weight  0.10000E+01 volume  0.36471E-02 ppm1      8.353 ppm2      6.775 CV     1
  ASSI { 1343}
    (( segid "    " and resid 79   and name HE  ))
    (( segid "    " and resid 79   and name HD2 ))
       3.600     1.600     1.600 peak  1343 spectrum    1 weight  0.10000E+01 volume  0.40917E-03 ppm1      8.349 ppm2      2.635 CV     1
  ASSI { 1344}
    (( segid "    " and resid 79   and name HE  ))
    (( segid "    " and resid 79   and name HD1 ))
       3.000     1.100     1.100 peak  1344 spectrum    1 weight  0.10000E+01 volume  0.13475E-02 ppm1      8.354 ppm2      2.257 CV     1
  ASSI { 1345}
    (( segid "    " and resid 90   and name HE  ))
    (( segid "    " and resid 87   and name HA  ))
       5.300     3.500     0.700 peak  1345 spectrum    1 weight  0.10000E+01 volume  0.11848E-03 ppm1      7.311 ppm2      4.456 CV     1
  ASSI { 1346}
    (( segid "    " and resid 90   and name HE  ))
    (( segid "    " and resid 90   and name HD1 ))
       3.100     1.200     1.200 peak  1346 spectrum    1 weight  0.10000E+01 volume  0.10213E-02 ppm1      7.309 ppm2      2.325 CV     1
  ASSI { 1348}
    (( segid "    " and resid 90   and name HE  ))
    (( segid "    " and resid 90   and name HD2 ))
       3.300     1.300     1.300 peak  1348 spectrum    1 weight  0.10000E+01 volume  0.90105E-03 ppm1      7.305 ppm2      2.474 CV     1
  ASSI { 1350}
    (( segid "    " and resid 13   and name HE  ))
    (( segid "    " and resid 13   and name HD1 ))
       2.300     0.700     0.700 peak  1350 spectrum    1 weight  0.10000E+01 volume  0.74600E-02 ppm1      7.232 ppm2      3.173 CV     1
  ASSI { 1351}
    (( segid "    " and resid 13   and name HE  ))
    (( segid "    " and resid 13   and name HN  ))
       5.100     3.300     0.900 peak  1351 spectrum    1 weight  0.10000E+01 volume  0.88767E-04 ppm1      7.230 ppm2      8.473 CV     1
  ASSI { 1353}
    (( segid "    " and resid 92   and name HE  ))
    (( segid "    " and resid 92   and name HA  ))
       5.800     4.200     0.200 peak  1353 spectrum    1 weight  0.10000E+01 volume  0.22277E-03 ppm1      7.226 ppm2      4.282 CV     1
  ASSI { 1354}
    (( segid "    " and resid 92   and name HE  ))
    (( segid "    " and resid 92   and name HD1 ))
       2.100     0.600     0.600 peak  1354 spectrum    1 weight  0.10000E+01 volume  0.82514E-02 ppm1      7.226 ppm2      3.226 CV     1
  ASSI { 1355}
    (( segid "    " and resid 92   and name HE  ))
    (( segid "    " and resid 92   and name HG1 ))
       2.300     0.700     0.700 peak  1355 spectrum    1 weight  0.10000E+01 volume  0.51288E-02 ppm1      7.229 ppm2      1.905 CV     1
  ASSI { 1356}
    (( segid "    " and resid 92   and name HE  ))
    (( segid "    " and resid 93   and name HB1 ))
       2.600     2.600     3.400 peak  1356 spectrum    1 weight  0.10000E+01 volume  0.29871E-02 ppm1      7.226 ppm2      1.655 CV     1
  ASSI { 1358}
    (( segid "    " and resid 92   and name HE  ))
    (  segid "    " and resid 88   and name HG1%)
       3.700     1.800     1.800 peak  1358 spectrum    1 weight  0.10000E+01 volume  0.13296E-02 ppm1      7.228 ppm2      1.022 CV     1
  ASSI { 1359}
    (( segid "    " and resid 104  and name HE  ))
    (( segid "    " and resid 104  and name HD1 ))
       2.400     0.700     0.700 peak  1359 spectrum    1 weight  0.10000E+01 volume  0.58339E-02 ppm1      7.175 ppm2      3.097 CV     1
  ASSI { 1360}
    (( segid "    " and resid 104  and name HE  ))
    (( segid "    " and resid 104  and name HB1 ))
       3.100     1.200     1.200 peak  1360 spectrum    1 weight  0.10000E+01 volume  0.14868E-02 ppm1      7.173 ppm2      1.840 CV     1
  ASSI { 1361}
    (( segid "    " and resid 104  and name HE  ))
    (  segid "    " and resid 100  and name HG1%)
       3.500     1.500     1.500 peak  1361 spectrum    1 weight  0.10000E+01 volume  0.88838E-03 ppm1      7.175 ppm2      0.816 CV     1
  ASSI { 1363}
    (( segid "    " and resid 104  and name HE  ))
    (( segid "    " and resid 104  and name HG1 ))
       3.200     1.300     1.300 peak  1363 spectrum    1 weight  0.10000E+01 volume  0.13433E-02 ppm1      7.172 ppm2      1.655 CV     1
  ASSI { 1365}
    (( segid "    " and resid 104  and name HE  ))
    (( segid "    " and resid 104  and name HG2 ))
       3.100     1.200     1.200 peak  1365 spectrum    1 weight  0.10000E+01 volume  0.17839E-02 ppm1      7.175 ppm2      1.728 CV     1
  ASSI { 1366}
    (( segid "    " and resid 104  and name HE  ))
    (( segid "    " and resid 104  and name HN  ))
       6.000     4.800     0.000 peak  1366 spectrum    1 weight  0.10000E+01 volume  0.25485E-04 ppm1      7.170 ppm2      7.845 CV     1
  ASSI { 1368}
    (( segid "    " and resid 104  and name HE  ))
    (( segid "    " and resid 104  and name HA  ))
       3.700     1.700     1.700 peak  1368 spectrum    1 weight  0.10000E+01 volume  0.46471E-03 ppm1      7.170 ppm2      4.003 CV     1
  ASSI { 1369}
    (( segid "    " and resid 108  and name HE  ))
    (( segid "    " and resid 108  and name HD1 ))
       2.500     0.800     0.800 peak  1369 spectrum    1 weight  0.10000E+01 volume  0.40795E-02 ppm1      7.160 ppm2      3.133 CV     1
  ASSI { 1370}
    (( segid "    " and resid 108  and name HE  ))
    (( segid "    " and resid 108  and name HB1 ))
       3.900     1.900     1.900 peak  1370 spectrum    1 weight  0.10000E+01 volume  0.37005E-03 ppm1      7.155 ppm2      1.640 CV     1
  ASSI { 1371}
    (( segid "    " and resid 66   and name HN  ))
    (( segid "    " and resid 68   and name HN  ))
       5.800     4.200     0.200 peak  1371 spectrum    1 weight  0.10000E+01 volume  0.10226E-03 ppm1      7.023 ppm2      8.409 CV     1
  ASSI { 1372}
    (( segid "    " and resid 66   and name HN  ))
    (( segid "    " and resid 65   and name HN  ))
       2.500     0.800     0.800 peak  1372 spectrum    1 weight  0.10000E+01 volume  0.36484E-02 ppm1      7.021 ppm2      7.113 CV     1
  ASSI { 1373}
    (( segid "    " and resid 66   and name HN  ))
    (( segid "    " and resid 65   and name HA  ))
       4.900     3.000     1.100 peak  1373 spectrum    1 weight  0.10000E+01 volume  0.98496E-04 ppm1      7.026 ppm2      4.820 CV     1
  ASSI { 1374}
    (( segid "    " and resid 66   and name HN  ))
    (( segid "    " and resid 65   and name HB2 ))
       4.000     2.000     2.000 peak  1374 spectrum    1 weight  0.10000E+01 volume  0.22250E-03 ppm1      7.022 ppm2      2.920 CV     1
  ASSI { 1377}
    (( segid "    " and resid 66   and name HN  ))
    (  segid "    " and resid 85   and name HG1%)
       4.500     2.500     1.500 peak  1377 spectrum    1 weight  0.10000E+01 volume  0.24389E-03 ppm1      7.022 ppm2      0.425 CV     1
  ASSI { 1379}
    (( segid "    " and resid 66   and name HN  ))
    (( segid "    " and resid 64   and name HA  ))
       3.700     1.700     1.700 peak  1379 spectrum    1 weight  0.10000E+01 volume  0.58684E-03 ppm1      7.018 ppm2      4.125 CV     1
  ASSI { 1380}
    (( segid "    " and resid 66   and name HN  ))
    (( segid "    " and resid 66   and name HA2 ))
       2.400     0.700     0.700 peak  1380 spectrum    1 weight  0.10000E+01 volume  0.47101E-02 ppm1      7.019 ppm2      4.000 CV     1
  ASSI { 1381}
    (( segid "    " and resid 66   and name HN  ))
    (( segid "    " and resid 66   and name HA1 ))
       2.700     0.900     0.900 peak  1381 spectrum    1 weight  0.10000E+01 volume  0.55245E-02 ppm1      7.019 ppm2      3.664 CV     1
  ASSI { 1382}
    (( segid "    " and resid 66   and name HN  ))
    (( segid "    " and resid 65   and name HB1 ))
       4.600     2.700     1.400 peak  1382 spectrum    1 weight  0.10000E+01 volume  0.26670E-03 ppm1      7.017 ppm2      2.288 CV     1
  ASSI { 1383}
    (( segid "    " and resid 66   and name HN  ))
    (  segid "    " and resid 64   and name HB% )
       4.500     2.500     1.500 peak  1383 spectrum    1 weight  0.10000E+01 volume  0.46125E-03 ppm1      7.020 ppm2      1.490 CV     1
  ASSI { 1384}
    (( segid "    " and resid 66   and name HN  ))
    (  segid "    " and resid 68   and name HD1%)
       4.500     2.500     1.500 peak  1384 spectrum    1 weight  0.10000E+01 volume  0.43300E-03 ppm1      7.019 ppm2      1.019 CV     1
  ASSI { 1385}
    (( segid "    " and resid 69   and name HE  ))
    (( segid "    " and resid 69   and name HD1 ))
       2.400     0.700     0.700 peak  1385 spectrum    1 weight  0.10000E+01 volume  0.63450E-02 ppm1      6.930 ppm2      2.806 CV     1
  ASSI { 1386}
    (( segid "    " and resid 69   and name HE  ))
    (( segid "    " and resid 69   and name HB1 ))
       3.300     1.300     1.300 peak  1386 spectrum    1 weight  0.10000E+01 volume  0.10774E-02 ppm1      6.928 ppm2      1.315 CV     1
  ASSI { 1387}
    (( segid "    " and resid 69   and name HE  ))
    (( segid "    " and resid 69   and name HG2 ))
       2.500     0.800     0.800 peak  1387 spectrum    1 weight  0.10000E+01 volume  0.43290E-02 ppm1      6.930 ppm2      1.053 CV     1
  ASSI { 1389}
    (( segid "    " and resid 66   and name HN  ))
    (( segid "    " and resid 62   and name HA  ))
       6.000     6.000     0.000 peak  1389 spectrum    1 weight  0.10000E+01 volume  0.59106E-05 ppm1      7.013 ppm2      3.833 CV     1
  ASSI { 1391}
    (( segid "    " and resid 66   and name HN  ))
    (( segid "    " and resid 67   and name HA2 ))
       4.400     2.500     1.600 peak  1391 spectrum    1 weight  0.10000E+01 volume  0.39068E-03 ppm1      7.017 ppm2      2.370 CV     1
  ASSI {    1}
    (( segid "    " and resid 98   and name HE3 ))
    (( segid "    " and resid 95   and name HA  ))
       2.500     0.800     0.800 peak     1 spectrum    2 weight  0.10000E+01 volume  0.10201E-02 ppm1      7.930 ppm2      5.054 CV     1
  ASSI {    1}
    (( segid "    " and resid 98   and name HE3 ))
    (( segid "    " and resid 98   and name HB1 ))
       5.300     3.500     0.700 peak     1 spectrum    2 weight  0.10000E+01 volume  0.20998E-03 ppm1      7.933 ppm2      3.435 CV     1
  ASSI {    2}
    (( segid "    " and resid 98   and name HE3 ))
    (( segid "    " and resid 98   and name HB2 ))
       3.900     1.900     1.900 peak     2 spectrum    2 weight  0.10000E+01 volume  0.16335E-03 ppm1      7.931 ppm2      3.256 CV     1
  ASSI {    3}
    (( segid "    " and resid 98   and name HE3 ))
    (  segid "    " and resid 102  and name HB% )
       3.300     3.300     2.700 peak     3 spectrum    2 weight  0.10000E+01 volume  0.31993E-03 ppm1      7.932 ppm2      1.477 CV     1
  ASSI {    4}
    (  segid "    " and resid 57   and name HD% )
    (( segid "    " and resid 57   and name HA  ))
       6.000     5.300     0.000 peak     4 spectrum    2 weight  0.10000E+01 volume  0.36719E-04 ppm1      7.782 ppm2      4.947 CV     1
  ASSI {    5}
    (  segid "    " and resid 57   and name HD% )
    (( segid "    " and resid 61   and name HB  ))
       2.600     2.600     3.400 peak     5 spectrum    2 weight  0.10000E+01 volume  0.21420E-02 ppm1      7.782 ppm2      4.472 CV     1
  ASSI {    7}
    (  segid "    " and resid 57   and name HD% )
    (( segid "    " and resid 57   and name HB2 ))
       2.600     0.800     0.800 peak     7 spectrum    2 weight  0.10000E+01 volume  0.21298E-02 ppm1      7.782 ppm2      3.800 CV     1
  ASSI {    8}
    (  segid "    " and resid 57   and name HD% )
    (( segid "    " and resid 57   and name HB1 ))
       2.900     1.100     1.100 peak     8 spectrum    2 weight  0.10000E+01 volume  0.19309E-02 ppm1      7.782 ppm2      2.805 CV     1
  ASSI {    9}
    (  segid "    " and resid 57   and name HD% )
    (  segid "    " and resid 61   and name HG2%)
       2.500     2.500     3.500 peak     9 spectrum    2 weight  0.10000E+01 volume  0.32150E-02 ppm1      7.782 ppm2      1.430 CV     1
  ASSI {   10}
    (  segid "    " and resid 57   and name HD% )
    (  segid "    " and resid 89   and name HG2%)
       4.900     3.000     1.100 peak    10 spectrum    2 weight  0.10000E+01 volume  0.17567E-03 ppm1      7.782 ppm2      1.127 CV     1
  ASSI {   13}
    (  segid "    " and resid 57   and name HD% )
    (  segid "    " and resid 85   and name HG1%)
       4.700     2.800     1.300 peak    13 spectrum    2 weight  0.10000E+01 volume  0.36155E-03 ppm1      7.782 ppm2      0.430 CV     1
  ASSI {   14}
    (( segid "    " and resid 43   and name HE3 ))
    (( segid "    " and resid 43   and name HA  ))
       3.600     1.600     1.600 peak    14 spectrum    2 weight  0.10000E+01 volume  0.93225E-03 ppm1      7.745 ppm2      3.886 CV     1
  ASSI {   16}
    (( segid "    " and resid 43   and name HE3 ))
    (( segid "    " and resid 79   and name HA  ))
       2.900     1.100     1.100 peak    16 spectrum    2 weight  0.10000E+01 volume  0.11865E-02 ppm1      7.746 ppm2      3.262 CV     1
  ASSI {   17}
    (( segid "    " and resid 43   and name HE3 ))
    (( segid "    " and resid 43   and name HB1 ))
       2.800     1.000     1.000 peak    17 spectrum    2 weight  0.10000E+01 volume  0.12210E-02 ppm1      7.746 ppm2      3.135 CV     1
  ASSI {   18}
    (( segid "    " and resid 43   and name HE3 ))
    (( segid "    " and resid 54   and name HA1 ))
       3.000     1.200     1.200 peak    18 spectrum    2 weight  0.10000E+01 volume  0.10358E-02 ppm1      7.746 ppm2      2.681 CV     1
  ASSI {   20}
    (( segid "    " and resid 95   and name HE3 ))
    (( segid "    " and resid 95   and name HA  ))
       3.100     1.200     1.200 peak    20 spectrum    2 weight  0.10000E+01 volume  0.10470E-02 ppm1      7.661 ppm2      5.053 CV     1
  ASSI {   21}
    (  segid "    " and resid 57   and name HE% )
    (( segid "    " and resid 57   and name HA  ))
       5.400     3.700     0.600 peak    21 spectrum    2 weight  0.10000E+01 volume  0.14579E-03 ppm1      7.665 ppm2      4.951 CV     1
  ASSI {   23}
    (  segid "    " and resid 57   and name HE% )
    (( segid "    " and resid 82   and name HA  ))
       6.000     6.000     0.000 peak    23 spectrum    2 weight  0.10000E+01 volume  0.10389E-04 ppm1      7.664 ppm2      4.325 CV     1
  ASSI {   24}
    (  segid "    " and resid 57   and name HE% )
    (( segid "    " and resid 86   and name HA  ))
       3.100     1.200     1.200 peak    24 spectrum    2 weight  0.10000E+01 volume  0.10421E-02 ppm1      7.665 ppm2      4.260 CV     1
  ASSI {   25}
    (  segid "    " and resid 57   and name HE% )
    (( segid "    " and resid 57   and name HB2 ))
       4.400     2.400     1.600 peak    25 spectrum    2 weight  0.10000E+01 volume  0.50545E-03 ppm1      7.665 ppm2      3.816 CV     1
  ASSI {   26}
    (( segid "    " and resid 95   and name HE3 ))
    (( segid "    " and resid 95   and name HB2 ))
       4.600     2.700     1.400 peak    26 spectrum    2 weight  0.10000E+01 volume  0.60615E-03 ppm1      7.661 ppm2      3.637 CV     1
  ASSI {   27}
    (( segid "    " and resid 95   and name HE3 ))
    (( segid "    " and resid 95   and name HB1 ))
       3.600     1.600     1.600 peak    27 spectrum    2 weight  0.10000E+01 volume  0.25784E-03 ppm1      7.662 ppm2      2.964 CV     1
  ASSI {   29}
    (  segid "    " and resid 57   and name HE% )
    (( segid "    " and resid 85   and name HB  ))
       4.000     2.000     2.000 peak    29 spectrum    2 weight  0.10000E+01 volume  0.59057E-03 ppm1      7.663 ppm2      2.092 CV     1
  ASSI {   33}
    (  segid "    " and resid 57   and name HE% )
    (  segid "    " and resid 86   and name HB% )
       2.900     2.900     3.100 peak    33 spectrum    2 weight  0.10000E+01 volume  0.17184E-02 ppm1      7.664 ppm2      0.725 CV     1
  ASSI {   35}
    (  segid "    " and resid 57   and name HE% )
    (  segid "    " and resid 85   and name HG2%)
       4.500     2.500     1.500 peak    35 spectrum    2 weight  0.10000E+01 volume  0.70426E-03 ppm1      7.662 ppm2      0.537 CV     1
  ASSI {   36}
    (  segid "    " and resid 57   and name HE% )
    (  segid "    " and resid 85   and name HG1%)
       2.800     2.800     3.200 peak    36 spectrum    2 weight  0.10000E+01 volume  0.14351E-02 ppm1      7.663 ppm2      0.431 CV     1
  ASSI {   37}
    (( segid "    " and resid 95   and name HE3 ))
    (  segid "    " and resid 34   and name HD1%)
       3.400     1.500     1.500 peak    37 spectrum    2 weight  0.10000E+01 volume  0.49661E-03 ppm1      7.663 ppm2      0.224 CV     1
  ASSI {   38}
    (( segid "    " and resid 43   and name HZ2 ))
    (( segid "    " and resid 32   and name HA  ))
       2.400     0.700     0.700 peak    38 spectrum    2 weight  0.10000E+01 volume  0.17061E-02 ppm1      7.576 ppm2      4.863 CV     1
  ASSI {   39}
    (( segid "    " and resid 43   and name HZ2 ))
    (( segid "    " and resid 31   and name HB1 ))
       5.200     3.400     0.800 peak    39 spectrum    2 weight  0.10000E+01 volume  0.11186E-03 ppm1      7.577 ppm2      3.411 CV     1
  ASSI {   40}
    (( segid "    " and resid 43   and name HZ2 ))
    (( segid "    " and resid 31   and name HB2 ))
       5.100     3.300     0.900 peak    40 spectrum    2 weight  0.10000E+01 volume  0.13473E-03 ppm1      7.576 ppm2      3.162 CV     1
  ASSI {   41}
    (( segid "    " and resid 43   and name HZ2 ))
    (( segid "    " and resid 32   and name HB2 ))
       4.400     2.400     1.600 peak    41 spectrum    2 weight  0.10000E+01 volume  0.11101E-03 ppm1      7.576 ppm2      2.802 CV     1
  ASSI {   42}
    (( segid "    " and resid 43   and name HZ2 ))
    (( segid "    " and resid 79   and name HG1 ))
       4.400     2.400     1.600 peak    42 spectrum    2 weight  0.10000E+01 volume  0.54253E-03 ppm1      7.575 ppm2      0.587 CV     1
  ASSI {   43}
    (( segid "    " and resid 43   and name HZ2 ))
    (  segid "    " and resid 35   and name HB% )
       2.900     1.100     1.100 peak    43 spectrum    2 weight  0.10000E+01 volume  0.19179E-02 ppm1      7.576 ppm2      0.492 CV     1
  ASSI {   44}
    (( segid "    " and resid 43   and name HD1 ))
    (( segid "    " and resid 43   and name HA  ))
       4.500     2.600     1.500 peak    44 spectrum    2 weight  0.10000E+01 volume  0.22867E-03 ppm1      7.491 ppm2      3.889 CV     1
  ASSI {   46}
    (( segid "    " and resid 43   and name HD1 ))
    (( segid "    " and resid 42   and name HB2 ))
       6.000     4.900     0.000 peak    46 spectrum    2 weight  0.10000E+01 volume  0.80918E-04 ppm1      7.493 ppm2      3.246 CV     1
  ASSI {   47}
    (( segid "    " and resid 43   and name HD1 ))
    (( segid "    " and resid 43   and name HB1 ))
       3.400     1.400     1.400 peak    47 spectrum    2 weight  0.10000E+01 volume  0.21710E-02 ppm1      7.492 ppm2      3.133 CV     1
  ASSI {   48}
    (( segid "    " and resid 43   and name HD1 ))
    (( segid "    " and resid 54   and name HA1 ))
       5.400     3.600     0.600 peak    48 spectrum    2 weight  0.10000E+01 volume  0.19217E-03 ppm1      7.491 ppm2      2.657 CV     1
  ASSI {   50}
    (( segid "    " and resid 88   and name HN  ))
    (( segid "    " and resid 92   and name HD1 ))
       3.900     1.900     1.900 peak    50 spectrum    2 weight  0.10000E+01 volume  0.82421E-03 ppm1      7.338 ppm2      3.254 CV     1
  OR {   50}
    (( segid "    " and resid 88   and name HN  ))
    (( segid "    " and resid 92   and name HD2 ))
  ASSI {   56}
    (( segid "    " and resid 93   and name HE21))
    (( segid "    " and resid 95   and name HA  ))
       4.100     2.100     1.900 peak    56 spectrum    2 weight  0.10000E+01 volume  0.69933E-03 ppm1      7.337 ppm2      5.046 CV     1
  ASSI {   59}
    (( segid "    " and resid 98   and name HH2 ))
    (( segid "    " and resid 86   and name HA  ))
       3.500     1.600     1.600 peak    59 spectrum    2 weight  0.10000E+01 volume  0.38701E-03 ppm1      7.284 ppm2      4.260 CV     1
  ASSI {   61}
    (( segid "    " and resid 98   and name HH2 ))
    (  segid "    " and resid 89   and name HG2%)
       3.500     1.500     1.500 peak    61 spectrum    2 weight  0.10000E+01 volume  0.11673E-02 ppm1      7.276 ppm2      1.127 CV     1
  ASSI {   62}
    (( segid "    " and resid 95   and name HZ2 ))
    (( segid "    " and resid 108  and name HG1 ))
       3.500     1.500     1.500 peak    62 spectrum    2 weight  0.10000E+01 volume  0.57867E-03 ppm1      7.256 ppm2      1.439 CV     1
  ASSI {   63}
    (( segid "    " and resid 95   and name HZ2 ))
    (( segid "    " and resid 30   and name HG11))
       3.000     1.100     1.100 peak    63 spectrum    2 weight  0.10000E+01 volume  0.22505E-02 ppm1      7.255 ppm2      0.815 CV     1
  ASSI {   64}
    (( segid "    " and resid 95   and name HZ2 ))
    (  segid "    " and resid 30   and name HD1%)
       4.300     2.300     1.700 peak    64 spectrum    2 weight  0.10000E+01 volume  0.25628E-03 ppm1      7.257 ppm2      0.543 CV     1
  ASSI {   65}
    (( segid "    " and resid 95   and name HZ2 ))
    (  segid "    " and resid 30   and name HG2%)
       3.700     3.700     2.300 peak    65 spectrum    2 weight  0.10000E+01 volume  0.70404E-03 ppm1      7.257 ppm2      0.156 CV     1
  ASSI {   66}
    (( segid "    " and resid 31   and name HD1 ))
    (( segid "    " and resid 31   and name HA  ))
       4.300     2.300     1.700 peak    66 spectrum    2 weight  0.10000E+01 volume  0.32071E-03 ppm1      7.214 ppm2      4.468 CV     1
  ASSI {   67}
    (( segid "    " and resid 62   and name HZ2 ))
    (( segid "    " and resid 74   and name HA  ))
       2.800     1.000     1.000 peak    67 spectrum    2 weight  0.10000E+01 volume  0.25608E-02 ppm1      7.215 ppm2      4.027 CV     1
  ASSI {   68}
    (( segid "    " and resid 31   and name HD1 ))
    (( segid "    " and resid 31   and name HB1 ))
       3.600     1.700     1.700 peak    68 spectrum    2 weight  0.10000E+01 volume  0.10441E-02 ppm1      7.214 ppm2      3.409 CV     1
  ASSI {   69}
    (( segid "    " and resid 31   and name HD1 ))
    (( segid "    " and resid 31   and name HB2 ))
       2.600     0.900     0.900 peak    69 spectrum    2 weight  0.10000E+01 volume  0.18523E-02 ppm1      7.214 ppm2      3.160 CV     1
  ASSI {   70}
    (( segid "    " and resid 31   and name HD1 ))
    (( segid "    " and resid 83   and name HG11))
       3.500     1.500     1.500 peak    70 spectrum    2 weight  0.10000E+01 volume  0.25346E-02 ppm1      7.214 ppm2      0.575 CV     1
  ASSI {   71}
    (( segid "    " and resid 31   and name HD1 ))
    (  segid "    " and resid 83   and name HG2%)
       2.500     2.500     3.500 peak    71 spectrum    2 weight  0.10000E+01 volume  0.28820E-02 ppm1      7.214 ppm2      0.445 CV     1
  ASSI {   73}
    (( segid "    " and resid 62   and name HZ2 ))
    (( segid "    " and resid 70   and name HB1 ))
       3.500     1.500     1.500 peak    73 spectrum    2 weight  0.10000E+01 volume  0.15330E-02 ppm1      7.205 ppm2      3.297 CV     1
  ASSI {   74}
    (( segid "    " and resid 62   and name HZ2 ))
    (( segid "    " and resid 81   and name HG2 ))
       4.600     2.600     1.400 peak    74 spectrum    2 weight  0.10000E+01 volume  0.37730E-03 ppm1      7.208 ppm2      2.404 CV     1
  ASSI {   75}
    (( segid "    " and resid 62   and name HZ2 ))
    (  segid "    " and resid 77   and name HB% )
       2.500     0.800     0.800 peak    75 spectrum    2 weight  0.10000E+01 volume  0.30890E-02 ppm1      7.206 ppm2      1.840 CV     1
  ASSI {   77}
    (( segid "    " and resid 62   and name HZ2 ))
    (  segid "    " and resid 71   and name HB% )
       2.400     0.700     0.700 peak    77 spectrum    2 weight  0.10000E+01 volume  0.40960E-02 ppm1      7.206 ppm2      1.548 CV     1
  ASSI {   78}
    (( segid "    " and resid 31   and name HN  ))
    (  segid "    " and resid 105  and name HB% )
       4.900     3.100     1.100 peak    78 spectrum    2 weight  0.10000E+01 volume  0.15641E-03 ppm1      7.206 ppm2      1.225 CV     1
  ASSI {   79}
    (( segid "    " and resid 62   and name HZ2 ))
    (  segid "    " and resid 74   and name HB% )
       3.200     3.200     2.800 peak    79 spectrum    2 weight  0.10000E+01 volume  0.25788E-02 ppm1      7.209 ppm2      0.844 CV     1
  ASSI {   80}
    (( segid "    " and resid 62   and name HZ2 ))
    (( segid "    " and resid 68   and name HA  ))
       3.900     1.900     1.900 peak    80 spectrum    2 weight  0.10000E+01 volume  0.50660E-03 ppm1      7.204 ppm2      4.327 CV     1
  ASSI {   83}
    (( segid "    " and resid 95   and name HD1 ))
    (( segid "    " and resid 95   and name HB2 ))
       3.000     1.200     1.200 peak    83 spectrum    2 weight  0.10000E+01 volume  0.97865E-03 ppm1      7.194 ppm2      3.635 CV     1
  ASSI {   84}
    (( segid "    " and resid 57   and name HZ  ))
    (( segid "    " and resid 86   and name HA  ))
       2.600     0.800     0.800 peak    84 spectrum    2 weight  0.10000E+01 volume  0.29944E-02 ppm1      7.152 ppm2      4.260 CV     1
  ASSI {   85}
    (( segid "    " and resid 57   and name HZ  ))
    (( segid "    " and resid 85   and name HB  ))
       3.500     1.600     1.600 peak    85 spectrum    2 weight  0.10000E+01 volume  0.22794E-03 ppm1      7.150 ppm2      2.096 CV     1
  ASSI {   86}
    (( segid "    " and resid 57   and name HZ  ))
    (  segid "    " and resid 86   and name HB% )
       2.600     2.600     3.400 peak    86 spectrum    2 weight  0.10000E+01 volume  0.34210E-02 ppm1      7.152 ppm2      0.729 CV     1
  ASSI {   87}
    (( segid "    " and resid 57   and name HZ  ))
    (  segid "    " and resid 85   and name HG1%)
       2.900     1.000     1.000 peak    87 spectrum    2 weight  0.10000E+01 volume  0.17698E-02 ppm1      7.152 ppm2      0.432 CV     1
  ASSI {   89}
    (  segid "    " and resid 52   and name HD% )
    (( segid "    " and resid 52   and name HA  ))
       3.000     1.100     1.100 peak    89 spectrum    2 weight  0.10000E+01 volume  0.21625E-02 ppm1      7.122 ppm2      4.926 CV     1
  ASSI {   90}
    (  segid "    " and resid 52   and name HD% )
    (( segid "    " and resid 52   and name HB1 ))
       2.500     0.800     0.800 peak    90 spectrum    2 weight  0.10000E+01 volume  0.24514E-02 ppm1      7.121 ppm2      3.299 CV     1
  ASSI {   92}
    (  segid "    " and resid 52   and name HD% )
    (( segid "    " and resid 52   and name HB2 ))
       2.600     0.900     0.900 peak    92 spectrum    2 weight  0.10000E+01 volume  0.30161E-02 ppm1      7.122 ppm2      2.740 CV     1
  ASSI {   93}
    (( segid "    " and resid 31   and name HZ2 ))
    (( segid "    " and resid 90   and name HG2 ))
       2.700     0.900     0.900 peak    93 spectrum    2 weight  0.10000E+01 volume  0.96928E-03 ppm1      7.118 ppm2      1.814 CV     1
  ASSI {   94}
    (  segid "    " and resid 52   and name HD% )
    (  segid "    " and resid 74   and name HB% )
       3.500     1.500     1.500 peak    94 spectrum    2 weight  0.10000E+01 volume  0.19889E-02 ppm1      7.118 ppm2      0.841 CV     1
  ASSI {   95}
    (( segid "    " and resid 31   and name HZ2 ))
    (( segid "    " and resid 87   and name HA  ))
       2.300     0.700     0.700 peak    95 spectrum    2 weight  0.10000E+01 volume  0.38476E-02 ppm1      7.113 ppm2      4.481 CV     1
  ASSI {  102}
    (( segid "    " and resid 31   and name HZ3 ))
    (  segid "    " and resid 34   and name HD1%)
       3.000     1.100     1.100 peak   102 spectrum    2 weight  0.10000E+01 volume  0.12020E-02 ppm1      7.113 ppm2      0.229 CV     1
  ASSI {  106}
    (( segid "    " and resid 31   and name HZ2 ))
    (( segid "    " and resid 90   and name HB2 ))
       3.200     1.300     1.300 peak   106 spectrum    2 weight  0.10000E+01 volume  0.14567E-02 ppm1      7.102 ppm2      2.037 CV     1
  ASSI {  107}
    (( segid "    " and resid 98   and name HD1 ))
    (( segid "    " and resid 101  and name HB2 ))
       3.100     1.200     1.200 peak   107 spectrum    2 weight  0.10000E+01 volume  0.17631E-02 ppm1      7.091 ppm2      3.145 CV     1
  ASSI {  108}
    (( segid "    " and resid 98   and name HZ3 ))
    (( segid "    " and resid 95   and name HA  ))
       4.200     2.200     1.800 peak   108 spectrum    2 weight  0.10000E+01 volume  0.40019E-03 ppm1      7.073 ppm2      5.046 CV     1
  ASSI {  109}
    (( segid "    " and resid 98   and name HZ3 ))
    (  segid "    " and resid 89   and name HG2%)
       4.300     2.300     1.700 peak   109 spectrum    2 weight  0.10000E+01 volume  0.63478E-03 ppm1      7.074 ppm2      1.127 CV     1
  ASSI {  110}
    (( segid "    " and resid 66   and name HN  ))
    (( segid "    " and resid 62   and name HB1 ))
       4.400     2.400     1.600 peak   110 spectrum    2 weight  0.10000E+01 volume  0.28688E-03 ppm1      7.026 ppm2      3.092 CV     1
  ASSI {  111}
    (( segid "    " and resid 62   and name HZ3 ))
    (( segid "    " and resid 82   and name HA  ))
       2.500     0.800     0.800 peak   111 spectrum    2 weight  0.10000E+01 volume  0.19915E-02 ppm1      6.934 ppm2      4.331 CV     1
  ASSI {  112}
    (  segid "    " and resid 51   and name HD% )
    (( segid "    " and resid 51   and name HA  ))
       2.900     1.000     1.000 peak   112 spectrum    2 weight  0.10000E+01 volume  0.15998E-02 ppm1      6.930 ppm2      4.874 CV     1
  ASSI {  114}
    (  segid "    " and resid 51   and name HD% )
    (( segid "    " and resid 58   and name HB2 ))
       3.600     1.600     1.600 peak   114 spectrum    2 weight  0.10000E+01 volume  0.78341E-03 ppm1      6.929 ppm2      3.166 CV     1
  ASSI {  115}
    (  segid "    " and resid 51   and name HD% )
    (( segid "    " and resid 51   and name HB2 ))
       2.300     2.300     3.700 peak   115 spectrum    2 weight  0.10000E+01 volume  0.50894E-02 ppm1      6.930 ppm2      2.481 CV     1
  ASSI {  116}
    (  segid "    " and resid 51   and name HD% )
    (( segid "    " and resid 59   and name HB2 ))
       4.700     2.800     1.300 peak   116 spectrum    2 weight  0.10000E+01 volume  0.37863E-03 ppm1      6.930 ppm2      2.302 CV     1
  ASSI {  117}
    (  segid "    " and resid 51   and name HD% )
    (( segid "    " and resid 51   and name HB1 ))
       2.500     0.800     0.800 peak   117 spectrum    2 weight  0.10000E+01 volume  0.57916E-02 ppm1      6.929 ppm2      2.128 CV     1
  ASSI {  120}
    (( segid "    " and resid 98   and name HZ2 ))
    (  segid "    " and resid 89   and name HG2%)
       3.300     3.300     2.700 peak   120 spectrum    2 weight  0.10000E+01 volume  0.17325E-02 ppm1      6.928 ppm2      1.112 CV     1
  ASSI {  121}
    (( segid "    " and resid 98   and name HZ2 ))
    (  segid "    " and resid 86   and name HB% )
       2.900     1.000     1.000 peak   121 spectrum    2 weight  0.10000E+01 volume  0.16340E-02 ppm1      6.930 ppm2      0.728 CV     1
  ASSI {  122}
    (( segid "    " and resid 98   and name HZ2 ))
    (  segid "    " and resid 55   and name HG2%)
       3.100     1.200     1.200 peak   122 spectrum    2 weight  0.10000E+01 volume  0.27465E-02 ppm1      6.929 ppm2      0.657 CV     1
  ASSI {  124}
    (  segid "    " and resid 70   and name HD% )
    (( segid "    " and resid 70   and name HB1 ))
       2.300     0.700     0.700 peak   124 spectrum    2 weight  0.10000E+01 volume  0.37816E-02 ppm1      6.919 ppm2      3.298 CV     1
  ASSI {  125}
    (  segid "    " and resid 51   and name HD% )
    (( segid "    " and resid 58   and name HB1 ))
       3.100     1.200     1.200 peak   125 spectrum    2 weight  0.10000E+01 volume  0.11571E-02 ppm1      6.924 ppm2      2.815 CV     1
  ASSI {  127}
    (  segid "    " and resid 70   and name HD% )
    (  segid "    " and resid 84   and name HB% )
       3.000     3.000     3.000 peak   127 spectrum    2 weight  0.10000E+01 volume  0.19676E-02 ppm1      6.921 ppm2      1.457 CV     1
  ASSI {  128}
    (  segid "    " and resid 70   and name HD% )
    (( segid "    " and resid 69   and name HB2 ))
       2.900     2.900     3.100 peak   128 spectrum    2 weight  0.10000E+01 volume  0.75587E-03 ppm1      6.919 ppm2      1.340 CV     1
  ASSI {  130}
    (( segid "    " and resid 62   and name HZ3 ))
    (  segid "    " and resid 74   and name HB% )
       2.400     2.400     3.600 peak   130 spectrum    2 weight  0.10000E+01 volume  0.39487E-02 ppm1      6.923 ppm2      0.852 CV     1
  ASSI {  131}
    (  segid "    " and resid 70   and name HD% )
    (  segid "    " and resid 85   and name HG2%)
       2.600     2.600     3.400 peak   131 spectrum    2 weight  0.10000E+01 volume  0.69066E-02 ppm1      6.921 ppm2      0.533 CV     1
  ASSI {  132}
    (  segid "    " and resid 70   and name HD% )
    (( segid "    " and resid 70   and name HA  ))
       5.200     3.400     0.800 peak   132 spectrum    2 weight  0.10000E+01 volume  0.59233E-04 ppm1      6.918 ppm2      4.754 CV     1
  ASSI {  133}
    (  segid "    " and resid 70   and name HD% )
    (( segid "    " and resid 70   and name HB2 ))
       2.400     0.700     0.700 peak   133 spectrum    2 weight  0.10000E+01 volume  0.33892E-02 ppm1      6.918 ppm2      2.936 CV     1
  ASSI {  134}
    (  segid "    " and resid 70   and name HD% )
    (( segid "    " and resid 81   and name HG2 ))
       2.700     2.700     3.300 peak   134 spectrum    2 weight  0.10000E+01 volume  0.35207E-02 ppm1      6.919 ppm2      2.391 CV     1
  ASSI {  136}
    (  segid "    " and resid 70   and name HD% )
    (( segid "    " and resid 69   and name HG2 ))
       2.700     2.700     3.300 peak   136 spectrum    2 weight  0.10000E+01 volume  0.24150E-02 ppm1      6.919 ppm2      1.056 CV     1
  ASSI {  137}
    (( segid "    " and resid 43   and name HZ3 ))
    (( segid "    " and resid 82   and name HG1 ))
       6.000     5.500     0.000 peak   137 spectrum    2 weight  0.10000E+01 volume  0.19839E-04 ppm1      6.863 ppm2      2.538 CV     1
  ASSI {  140}
    (  segid "    " and resid 51   and name HE% )
    (( segid "    " and resid 58   and name HB2 ))
       3.200     1.300     1.300 peak   140 spectrum    2 weight  0.10000E+01 volume  0.16856E-02 ppm1      6.857 ppm2      3.167 CV     1
  ASSI {  141}
    (  segid "    " and resid 51   and name HE% )
    (( segid "    " and resid 51   and name HB2 ))
       3.700     1.700     1.700 peak   141 spectrum    2 weight  0.10000E+01 volume  0.15148E-02 ppm1      6.862 ppm2      2.504 CV     1
  ASSI {  142}
    (  segid "    " and resid 51   and name HE% )
    (( segid "    " and resid 51   and name HB1 ))
       6.000     6.000     0.000 peak   142 spectrum    2 weight  0.10000E+01 volume  0.11752E-04 ppm1      6.860 ppm2      2.158 CV     1
  ASSI {  143}
    (  segid "    " and resid 51   and name HE% )
    (( segid "    " and resid 58   and name HB1 ))
       2.900     2.900     3.100 peak   143 spectrum    2 weight  0.10000E+01 volume  0.15748E-02 ppm1      6.856 ppm2      2.852 CV     1
  ASSI {  144}
    (( segid "    " and resid 43   and name HH2 ))
    (( segid "    " and resid 31   and name HB2 ))
       3.500     1.500     1.500 peak   144 spectrum    2 weight  0.10000E+01 volume  0.70300E-03 ppm1      6.799 ppm2      3.163 CV     1
  ASSI {  147}
    (( segid "    " and resid 43   and name HH2 ))
    (( segid "    " and resid 31   and name HB1 ))
       3.200     1.300     1.300 peak   147 spectrum    2 weight  0.10000E+01 volume  0.65874E-03 ppm1      6.797 ppm2      3.413 CV     1
  ASSI {  148}
    (( segid "    " and resid 43   and name HH2 ))
    (( segid "    " and resid 79   and name HG1 ))
       3.800     1.800     1.800 peak   148 spectrum    2 weight  0.10000E+01 volume  0.14771E-02 ppm1      6.798 ppm2      0.587 CV     1
  ASSI {  154}
    (( segid "    " and resid 62   and name HD1 ))
    (( segid "    " and resid 63   and name HA  ))
       3.400     1.500     1.500 peak   154 spectrum    2 weight  0.10000E+01 volume  0.48333E-03 ppm1      6.765 ppm2      3.709 CV     1
  ASSI {  155}
    (( segid "    " and resid 62   and name HD1 ))
    (( segid "    " and resid 62   and name HB2 ))
       3.400     1.500     1.500 peak   155 spectrum    2 weight  0.10000E+01 volume  0.17055E-02 ppm1      6.765 ppm2      3.506 CV     1
  ASSI {  156}
    (( segid "    " and resid 62   and name HD1 ))
    (( segid "    " and resid 62   and name HB1 ))
       2.400     0.700     0.700 peak   156 spectrum    2 weight  0.10000E+01 volume  0.32117E-02 ppm1      6.764 ppm2      3.103 CV     1
  ASSI {  157}
    (( segid "    " and resid 62   and name HD1 ))
    (( segid "    " and resid 63   and name HB1 ))
       3.400     1.500     1.500 peak   157 spectrum    2 weight  0.10000E+01 volume  0.22419E-02 ppm1      6.765 ppm2      2.086 CV     1
  ASSI {  158}
    (( segid "    " and resid 62   and name HD1 ))
    (( segid "    " and resid 68   and name HB1 ))
       4.200     2.200     1.800 peak   158 spectrum    2 weight  0.10000E+01 volume  0.83491E-03 ppm1      6.765 ppm2      1.563 CV     1
  ASSI {  159}
    (( segid "    " and resid 62   and name HD1 ))
    (( segid "    " and resid 68   and name HG  ))
       3.200     1.200     1.200 peak   159 spectrum    2 weight  0.10000E+01 volume  0.95337E-03 ppm1      6.762 ppm2      1.312 CV     1
  ASSI {  160}
    (( segid "    " and resid 62   and name HD1 ))
    (  segid "    " and resid 68   and name HD1%)
       2.500     0.800     0.800 peak   160 spectrum    2 weight  0.10000E+01 volume  0.31165E-02 ppm1      6.765 ppm2      1.010 CV     1
  ASSI {  161}
    (( segid "    " and resid 62   and name HD1 ))
    (  segid "    " and resid 68   and name HD2%)
       3.300     3.300     2.700 peak   161 spectrum    2 weight  0.10000E+01 volume  0.22949E-02 ppm1      6.763 ppm2      0.856 CV     1
  ASSI {  162}
    (  segid "    " and resid 52   and name HE% )
    (( segid "    " and resid 52   and name HA  ))
       3.700     1.800     1.800 peak   162 spectrum    2 weight  0.10000E+01 volume  0.82015E-03 ppm1      6.756 ppm2      4.922 CV     1
  ASSI {  164}
    (  segid "    " and resid 52   and name HE% )
    (( segid "    " and resid 50   and name HA2 ))
       3.000     3.000     3.000 peak   164 spectrum    2 weight  0.10000E+01 volume  0.11506E-02 ppm1      6.756 ppm2      3.299 CV     1
  ASSI {  166}
    (  segid "    " and resid 52   and name HE% )
    (( segid "    " and resid 52   and name HB2 ))
       3.800     1.800     1.800 peak   166 spectrum    2 weight  0.10000E+01 volume  0.10079E-02 ppm1      6.757 ppm2      2.739 CV     1
  ASSI {  167}
    (  segid "    " and resid 52   and name HE% )
    (( segid "    " and resid 59   and name HG2 ))
       3.700     1.700     1.700 peak   167 spectrum    2 weight  0.10000E+01 volume  0.12303E-02 ppm1      6.758 ppm2      2.469 CV     1
  ASSI {  168}
    (  segid "    " and resid 52   and name HE% )
    (( segid "    " and resid 59   and name HB2 ))
       2.600     0.900     0.900 peak   168 spectrum    2 weight  0.10000E+01 volume  0.10457E-02 ppm1      6.757 ppm2      2.319 CV     1
  ASSI {  169}
    (  segid "    " and resid 52   and name HE% )
    (( segid "    " and resid 59   and name HB1 ))
       3.900     1.900     1.900 peak   169 spectrum    2 weight  0.10000E+01 volume  0.47164E-03 ppm1      6.757 ppm2      1.974 CV     1
  ASSI {  171}
    (  segid "    " and resid 52   and name HE% )
    (( segid "    " and resid 73   and name HB1 ))
       3.500     1.600     1.600 peak   171 spectrum    2 weight  0.10000E+01 volume  0.69955E-03 ppm1      6.759 ppm2      1.269 CV     1
  ASSI {  173}
    (( segid "    " and resid 62   and name HH2 ))
    (( segid "    " and resid 82   and name HA  ))
       3.200     1.300     1.300 peak   173 spectrum    2 weight  0.10000E+01 volume  0.66927E-03 ppm1      6.697 ppm2      4.332 CV     1
  ASSI {  175}
    (( segid "    " and resid 62   and name HH2 ))
    (( segid "    " and resid 82   and name HG2 ))
       3.700     1.700     1.700 peak   175 spectrum    2 weight  0.10000E+01 volume  0.36077E-03 ppm1      6.696 ppm2      2.794 CV     1
  ASSI {  177}
    (( segid "    " and resid 62   and name HH2 ))
    (( segid "    " and resid 82   and name HB1 ))
       4.400     2.400     1.600 peak   177 spectrum    2 weight  0.10000E+01 volume  0.34024E-03 ppm1      6.694 ppm2      2.318 CV     1
  ASSI {  178}
    (( segid "    " and resid 62   and name HH2 ))
    (( segid "    " and resid 85   and name HB  ))
       3.800     1.800     1.800 peak   178 spectrum    2 weight  0.10000E+01 volume  0.52132E-03 ppm1      6.693 ppm2      2.085 CV     1
  ASSI {  179}
    (( segid "    " and resid 62   and name HH2 ))
    (  segid "    " and resid 77   and name HB% )
       2.600     0.800     0.800 peak   179 spectrum    2 weight  0.10000E+01 volume  0.21448E-02 ppm1      6.696 ppm2      1.842 CV     1
  ASSI {  180}
    (( segid "    " and resid 76   and name HN  ))
    (( segid "    " and resid 76   and name HB1 ))
       3.000     1.100     1.100 peak   180 spectrum    2 weight  0.10000E+01 volume  0.64783E-03 ppm1      6.694 ppm2      1.752 CV     1
  ASSI {  181}
    (( segid "    " and resid 62   and name HH2 ))
    (  segid "    " and resid 71   and name HB% )
       3.700     1.700     1.700 peak   181 spectrum    2 weight  0.10000E+01 volume  0.19489E-02 ppm1      6.692 ppm2      1.543 CV     1
  ASSI {  184}
    (  segid "    " and resid 70   and name HE% )
    (( segid "    " and resid 70   and name HA  ))
       4.100     2.100     1.900 peak   184 spectrum    2 weight  0.10000E+01 volume  0.62019E-03 ppm1      6.650 ppm2      4.753 CV     1
  ASSI {  185}
    (  segid "    " and resid 70   and name HE% )
    (( segid "    " and resid 85   and name HA  ))
       4.000     2.000     2.000 peak   185 spectrum    2 weight  0.10000E+01 volume  0.33882E-03 ppm1      6.648 ppm2      3.650 CV     1
  ASSI {  186}
    (  segid "    " and resid 70   and name HE% )
    (( segid "    " and resid 70   and name HB1 ))
       3.900     1.900     1.900 peak   186 spectrum    2 weight  0.10000E+01 volume  0.96587E-03 ppm1      6.649 ppm2      3.291 CV     1
  ASSI {  187}
    (  segid "    " and resid 70   and name HE% )
    (( segid "    " and resid 70   and name HB2 ))
       4.500     2.500     1.500 peak   187 spectrum    2 weight  0.10000E+01 volume  0.45765E-03 ppm1      6.649 ppm2      2.939 CV     1
  ASSI {  188}
    (  segid "    " and resid 70   and name HE% )
    (( segid "    " and resid 69   and name HD1 ))
       3.600     1.600     1.600 peak   188 spectrum    2 weight  0.10000E+01 volume  0.50909E-03 ppm1      6.649 ppm2      2.802 CV     1
  ASSI {  189}
    (  segid "    " and resid 70   and name HE% )
    (( segid "    " and resid 67   and name HA1 ))
       4.300     2.400     1.700 peak   189 spectrum    2 weight  0.10000E+01 volume  0.88865E-03 ppm1      6.649 ppm2      2.389 CV     1
  ASSI {  192}
    (  segid "    " and resid 70   and name HE% )
    (  segid "    " and resid 84   and name HB% )
       2.700     0.900     0.900 peak   192 spectrum    2 weight  0.10000E+01 volume  0.27481E-02 ppm1      6.649 ppm2      1.462 CV     1
  ASSI {  195}
    (  segid "    " and resid 70   and name HE% )
    (( segid "    " and resid 69   and name HG2 ))
       3.000     3.000     3.000 peak   195 spectrum    2 weight  0.10000E+01 volume  0.12778E-02 ppm1      6.649 ppm2      1.057 CV     1
  ASSI {  198}
    (  segid "    " and resid 70   and name HE% )
    (  segid "    " and resid 85   and name HG2%)
       2.400     2.400     3.600 peak   198 spectrum    2 weight  0.10000E+01 volume  0.57686E-02 ppm1      6.648 ppm2      0.532 CV     1
  ASSI {  201}
    (( segid "    " and resid 31   and name HE3 ))
    (  segid "    " and resid 86   and name HB% )
       3.400     1.500     1.500 peak   201 spectrum    2 weight  0.10000E+01 volume  0.62529E-03 ppm1      6.558 ppm2      0.730 CV     1
  ASSI {  202}
    (( segid "    " and resid 31   and name HE3 ))
    (( segid "    " and resid 83   and name HG11))
       5.800     4.200     0.200 peak   202 spectrum    2 weight  0.10000E+01 volume  0.96039E-04 ppm1      6.563 ppm2      0.564 CV     1
  ASSI {  204}
    (( segid "    " and resid 95   and name HH2 ))
    (( segid "    " and resid 30   and name HG11))
       2.700     0.900     0.900 peak   204 spectrum    2 weight  0.10000E+01 volume  0.12325E-02 ppm1      6.235 ppm2      0.815 CV     1
  ASSI {  205}
    (( segid "    " and resid 95   and name HH2 ))
    (  segid "    " and resid 34   and name HD1%)
       5.600     4.000     0.400 peak   205 spectrum    2 weight  0.10000E+01 volume  0.10271E-03 ppm1      6.238 ppm2      0.231 CV     1
  ASSI {  206}
    (( segid "    " and resid 95   and name HH2 ))
    (  segid "    " and resid 30   and name HG2%)
       3.600     1.600     1.600 peak   206 spectrum    2 weight  0.10000E+01 volume  0.88695E-03 ppm1      6.238 ppm2      0.157 CV     1
  ASSI {  207}
    (( segid "    " and resid 95   and name HH2 ))
    (  segid "    " and resid 30   and name HD1%)
       4.600     2.600     1.400 peak   207 spectrum    2 weight  0.10000E+01 volume  0.25074E-03 ppm1      6.234 ppm2      0.542 CV     1
  ASSI {  208}
    (( segid "    " and resid 62   and name HE3 ))
    (( segid "    " and resid 62   and name HA  ))
       3.200     1.300     1.300 peak   208 spectrum    2 weight  0.10000E+01 volume  0.10864E-02 ppm1      6.204 ppm2      3.852 CV     1
  ASSI {  209}
    (( segid "    " and resid 62   and name HE3 ))
    (  segid "    " and resid 85   and name HG1%)
       3.400     1.500     1.500 peak   209 spectrum    2 weight  0.10000E+01 volume  0.61355E-03 ppm1      6.205 ppm2      0.430 CV     1
  ASSI {  210}
    (( segid "    " and resid 95   and name HZ3 ))
    (  segid "    " and resid 34   and name HD1%)
       4.200     2.200     1.800 peak   210 spectrum    2 weight  0.10000E+01 volume  0.13762E-03 ppm1      6.065 ppm2      0.225 CV     1
  ASSI {  211}
    (( segid "    " and resid 31   and name HH2 ))
    (( segid "    " and resid 31   and name HA  ))
       6.000     6.000     0.000 peak   211 spectrum    2 weight  0.10000E+01 volume  0.80375E-05 ppm1      5.530 ppm2      4.469 CV     1
  ASSI {  213}
    (( segid "    " and resid 31   and name HH2 ))
    (  segid "    " and resid 34   and name HD1%)
       4.700     2.800     1.300 peak   213 spectrum    2 weight  0.10000E+01 volume  0.18584E-03 ppm1      5.527 ppm2      0.228 CV     1
  ASSI {  214}
    (( segid "    " and resid 58   and name HA  ))
    (( segid "    " and resid 51   and name HA  ))
       2.700     0.900     0.900 peak   214 spectrum    2 weight  0.10000E+01 volume  0.93132E-03 ppm1      5.385 ppm2      4.883 CV     1
  ASSI {  215}
    (( segid "    " and resid 58   and name HA  ))
    (( segid "    " and resid 58   and name HB1 ))
       2.600     0.800     0.800 peak   215 spectrum    2 weight  0.10000E+01 volume  0.21022E-02 ppm1      5.385 ppm2      2.852 CV     1
  ASSI {  216}
    (( segid "    " and resid 58   and name HA  ))
    (( segid "    " and resid 58   and name HB2 ))
       2.700     0.900     0.900 peak   216 spectrum    2 weight  0.10000E+01 volume  0.17162E-02 ppm1      5.385 ppm2      3.166 CV     1
  ASSI {  217}
    (( segid "    " and resid 44   and name HA  ))
    (( segid "    " and resid 75   and name HA  ))
       3.100     1.200     1.200 peak   217 spectrum    2 weight  0.10000E+01 volume  0.13301E-02 ppm1      5.139 ppm2      4.379 CV     1
  ASSI {  219}
    (( segid "    " and resid 44   and name HA  ))
    (( segid "    " and resid 53   and name HA2 ))
       5.400     3.700     0.600 peak   219 spectrum    2 weight  0.10000E+01 volume  0.13373E-03 ppm1      5.139 ppm2      4.023 CV     1
  ASSI {  220}
    (( segid "    " and resid 44   and name HA  ))
    (( segid "    " and resid 75   and name HB1 ))
       3.900     1.900     1.900 peak   220 spectrum    2 weight  0.10000E+01 volume  0.97081E-03 ppm1      5.140 ppm2      2.623 CV     1
  ASSI {  221}
    (( segid "    " and resid 44   and name HA  ))
    (( segid "    " and resid 75   and name HB2 ))
       2.800     1.000     1.000 peak   221 spectrum    2 weight  0.10000E+01 volume  0.12092E-02 ppm1      5.139 ppm2      2.532 CV     1
  ASSI {  222}
    (( segid "    " and resid 44   and name HA  ))
    (  segid "    " and resid 44   and name HB% )
       2.300     0.700     0.700 peak   222 spectrum    2 weight  0.10000E+01 volume  0.59446E-02 ppm1      5.139 ppm2      1.526 CV     1
  ASSI {  224}
    (( segid "    " and resid 95   and name HA  ))
    (( segid "    " and resid 95   and name HB1 ))
       2.700     0.900     0.900 peak   224 spectrum    2 weight  0.10000E+01 volume  0.10432E-02 ppm1      5.049 ppm2      2.979 CV     1
  ASSI {  225}
    (( segid "    " and resid 95   and name HA  ))
    (( segid "    " and resid 95   and name HB2 ))
       2.700     0.900     0.900 peak   225 spectrum    2 weight  0.10000E+01 volume  0.30258E-02 ppm1      5.047 ppm2      3.639 CV     1
  ASSI {  227}
    (( segid "    " and resid 98   and name HA  ))
    (( segid "    " and resid 98   and name HB1 ))
       3.300     1.300     1.300 peak   227 spectrum    2 weight  0.10000E+01 volume  0.45418E-03 ppm1      5.046 ppm2      3.445 CV     1
  ASSI {  228}
    (( segid "    " and resid 98   and name HA  ))
    (( segid "    " and resid 98   and name HB2 ))
       3.000     1.100     1.100 peak   228 spectrum    2 weight  0.10000E+01 volume  0.15952E-02 ppm1      5.045 ppm2      3.251 CV     1
  ASSI {  229}
    (( segid "    " and resid 98   and name HE3 ))
    (( segid "    " and resid 95   and name HE3 ))
       3.300     1.400     1.400 peak   229 spectrum    2 weight  0.10000E+01 volume  0.13036E-02 ppm1      7.931 ppm2      7.665 CV     1
  ASSI {  230}
    (( segid "    " and resid 98   and name HE3 ))
    (( segid "    " and resid 98   and name HZ3 ))
       2.700     0.900     0.900 peak   230 spectrum    2 weight  0.10000E+01 volume  0.99928E-03 ppm1      7.932 ppm2      7.076 CV     1
  ASSI {  231}
    (  segid "    " and resid 57   and name HD% )
    (  segid "    " and resid 57   and name HE% )
       2.100     0.600     0.600 peak   231 spectrum    2 weight  0.10000E+01 volume  0.64958E-02 ppm1      7.782 ppm2      7.668 CV     1
  ASSI {  233}
    (  segid "    " and resid 57   and name HD% )
    (( segid "    " and resid 57   and name HZ  ))
       3.200     1.300     1.300 peak   233 spectrum    2 weight  0.10000E+01 volume  0.17741E-02 ppm1      7.782 ppm2      7.181 CV     1
  ASSI {  234}
    (  segid "    " and resid 57   and name HD% )
    (( segid "    " and resid 62   and name HZ3 ))
       4.300     2.300     1.700 peak   234 spectrum    2 weight  0.10000E+01 volume  0.28838E-03 ppm1      7.782 ppm2      6.933 CV     1
  ASSI {  235}
    (  segid "    " and resid 57   and name HD% )
    (( segid "    " and resid 62   and name HE3 ))
       4.000     2.000     2.000 peak   235 spectrum    2 weight  0.10000E+01 volume  0.28191E-03 ppm1      7.782 ppm2      6.203 CV     1
  ASSI {  237}
    (( segid "    " and resid 43   and name HE3 ))
    (( segid "    " and resid 43   and name HZ3 ))
       2.400     0.700     0.700 peak   237 spectrum    2 weight  0.10000E+01 volume  0.22519E-02 ppm1      7.745 ppm2      6.868 CV     1
  ASSI {  239}
    (( segid "    " and resid 65   and name HD21))
    (( segid "    " and resid 65   and name HD22))
       2.700     0.900     0.900 peak   239 spectrum    2 weight  0.10000E+01 volume  0.93023E-03 ppm1      7.664 ppm2      7.276 CV     1
  ASSI {  240}
    (  segid "    " and resid 57   and name HE% )
    (( segid "    " and resid 57   and name HZ  ))
       2.300     0.600     0.600 peak   240 spectrum    2 weight  0.10000E+01 volume  0.41240E-02 ppm1      7.664 ppm2      7.159 CV     1
  ASSI {  241}
    (  segid "    " and resid 57   and name HE% )
    (( segid "    " and resid 62   and name HZ3 ))
       3.100     3.100     2.900 peak   241 spectrum    2 weight  0.10000E+01 volume  0.89507E-03 ppm1      7.664 ppm2      6.935 CV     1
  ASSI {  242}
    (( segid "    " and resid 95   and name HE3 ))
    (( segid "    " and resid 95   and name HH2 ))
       4.300     2.300     1.700 peak   242 spectrum    2 weight  0.10000E+01 volume  0.42968E-03 ppm1      7.662 ppm2      6.239 CV     1
  ASSI {  243}
    (( segid "    " and resid 95   and name HE3 ))
    (( segid "    " and resid 95   and name HZ3 ))
       3.100     1.200     1.200 peak   243 spectrum    2 weight  0.10000E+01 volume  0.87527E-03 ppm1      7.661 ppm2      6.065 CV     1
  ASSI {  250}
    (( segid "    " and resid 88   and name HN  ))
    (( segid "    " and resid 31   and name HZ2 ))
       3.000     3.000     3.000 peak   250 spectrum    2 weight  0.10000E+01 volume  0.34367E-02 ppm1      7.344 ppm2      7.105 CV     1
  ASSI {  251}
    (( segid "    " and resid 98   and name HH2 ))
    (( segid "    " and resid 98   and name HZ2 ))
       2.600     0.800     0.800 peak   251 spectrum    2 weight  0.10000E+01 volume  0.23673E-02 ppm1      7.292 ppm2      6.930 CV     1
  ASSI {  253}
    (( segid "    " and resid 95   and name HZ2 ))
    (( segid "    " and resid 95   and name HH2 ))
       2.600     0.800     0.800 peak   253 spectrum    2 weight  0.10000E+01 volume  0.28892E-02 ppm1      7.256 ppm2      6.243 CV     1
  ASSI {  255}
    (( segid "    " and resid 62   and name HZ2 ))
    (( segid "    " and resid 62   and name HH2 ))
       2.500     0.800     0.800 peak   255 spectrum    2 weight  0.10000E+01 volume  0.27431E-02 ppm1      7.206 ppm2      6.696 CV     1
  ASSI {  258}
    (  segid "    " and resid 52   and name HD% )
    (( segid "    " and resid 58   and name HA  ))
       4.500     2.500     1.500 peak   258 spectrum    2 weight  0.10000E+01 volume  0.33448E-03 ppm1      7.123 ppm2      5.388 CV     1
  ASSI {  260}
    (  segid "    " and resid 52   and name HD% )
    (  segid "    " and resid 52   and name HE% )
       2.200     0.600     0.600 peak   260 spectrum    2 weight  0.10000E+01 volume  0.67448E-02 ppm1      7.120 ppm2      6.760 CV     1
  ASSI {  261}
    (( segid "    " and resid 31   and name HZ3 ))
    (( segid "    " and resid 31   and name HH2 ))
       2.800     1.000     1.000 peak   261 spectrum    2 weight  0.10000E+01 volume  0.15338E-02 ppm1      7.113 ppm2      5.531 CV     1
  ASSI {  262}
    (( segid "    " and resid 31   and name HZ3 ))
    (( segid "    " and resid 31   and name HE3 ))
       2.500     0.800     0.800 peak   262 spectrum    2 weight  0.10000E+01 volume  0.26920E-02 ppm1      7.107 ppm2      6.562 CV     1
  ASSI {  264}
    (( segid "    " and resid 62   and name HZ3 ))
    (( segid "    " and resid 62   and name HE3 ))
       3.200     1.300     1.300 peak   264 spectrum    2 weight  0.10000E+01 volume  0.62688E-03 ppm1      6.936 ppm2      6.207 CV     1
  ASSI {  265}
    (  segid "    " and resid 51   and name HD% )
    (( segid "    " and resid 58   and name HA  ))
       3.300     1.400     1.400 peak   265 spectrum    2 weight  0.10000E+01 volume  0.44905E-03 ppm1      6.930 ppm2      5.390 CV     1
  ASSI {  266}
    (  segid "    " and resid 70   and name HD% )
    (  segid "    " and resid 70   and name HE% )
       2.000     0.500     0.500 peak   266 spectrum    2 weight  0.10000E+01 volume  0.11897E-01 ppm1      6.918 ppm2      6.656 CV     1
  ASSI {  267}
    (  segid "    " and resid 51   and name HE% )
    (( segid "    " and resid 58   and name HA  ))
       4.900     3.000     1.100 peak   267 spectrum    2 weight  0.10000E+01 volume  0.27362E-03 ppm1      6.857 ppm2      5.389 CV     1
  ASSI {  268}
    (( segid "    " and resid 43   and name HZ3 ))
    (( segid "    " and resid 62   and name HH2 ))
       3.500     3.500     2.500 peak   268 spectrum    2 weight  0.10000E+01 volume  0.26349E-02 ppm1      6.855 ppm2      6.699 CV     1
  ASSI {  269}
    (  segid "    " and resid 52   and name HE% )
    (( segid "    " and resid 58   and name HA  ))
       5.100     3.300     0.900 peak   269 spectrum    2 weight  0.10000E+01 volume  0.19783E-03 ppm1      6.755 ppm2      5.389 CV     1
  ASSI {  270}
    (( segid "    " and resid 31   and name HE3 ))
    (( segid "    " and resid 31   and name HH2 ))
       3.400     1.400     1.400 peak   270 spectrum    2 weight  0.10000E+01 volume  0.14030E-02 ppm1      6.559 ppm2      5.529 CV     1
  ASSI {  271}
    (( segid "    " and resid 95   and name HH2 ))
    (( segid "    " and resid 95   and name HZ3 ))
       2.700     0.900     0.900 peak   271 spectrum    2 weight  0.10000E+01 volume  0.19904E-02 ppm1      6.237 ppm2      6.066 CV     1
  ASSI {  272}
    (( segid "    " and resid 57   and name HA  ))
    (( segid "    " and resid 57   and name HB2 ))
       2.900     1.000     1.000 peak   272 spectrum    2 weight  0.10000E+01 volume  0.19602E-02 ppm1      4.940 ppm2      3.795 CV     1
  ASSI {  273}
    (( segid "    " and resid 57   and name HA  ))
    (( segid "    " and resid 61   and name HB  ))
       6.000     5.500     0.000 peak   273 spectrum    2 weight  0.10000E+01 volume  0.29073E-04 ppm1      4.934 ppm2      4.468 CV     1
  ASSI {  274}
    (( segid "    " and resid 70   and name HA  ))
    (( segid "    " and resid 70   and name HB2 ))
       3.000     1.100     1.100 peak   274 spectrum    2 weight  0.10000E+01 volume  0.22931E-02 ppm1      4.759 ppm2      2.930 CV     1
  ASSI {  275}
    (( segid "    " and resid 70   and name HA  ))
    (( segid "    " and resid 70   and name HB1 ))
       2.800     1.000     1.000 peak   275 spectrum    2 weight  0.10000E+01 volume  0.14313E-02 ppm1      4.754 ppm2      3.303 CV     1
  ASSI {  277}
    (( segid "    " and resid 1    and name HA  ))
    (( segid "    " and resid 1    and name HB2 ))
       2.600     0.900     0.900 peak   277 spectrum    2 weight  0.10000E+01 volume  0.41062E-02 ppm1      4.742 ppm2      2.815 CV     1
  ASSI {  278}
    (( segid "    " and resid 70   and name HA  ))
    (( segid "    " and resid 81   and name HB1 ))
       4.500     2.600     1.500 peak   278 spectrum    2 weight  0.10000E+01 volume  0.49221E-03 ppm1      4.733 ppm2      1.791 CV     1
  ASSI {  280}
    (( segid "    " and resid 93   and name HA  ))
    (( segid "    " and resid 93   and name HG1 ))
       3.900     1.900     1.900 peak   280 spectrum    2 weight  0.10000E+01 volume  0.97717E-03 ppm1      4.716 ppm2      2.467 CV     1
  ASSI {  281}
    (( segid "    " and resid 93   and name HA  ))
    (( segid "    " and resid 93   and name HB2 ))
       2.900     1.100     1.100 peak   281 spectrum    2 weight  0.10000E+01 volume  0.13720E-02 ppm1      4.717 ppm2      2.178 CV     1
  ASSI {  283}
    (( segid "    " and resid 93   and name HA  ))
    (( segid "    " and resid 93   and name HB1 ))
       3.600     1.600     1.600 peak   283 spectrum    2 weight  0.10000E+01 volume  0.57434E-03 ppm1      4.712 ppm2      1.991 CV     1
  ASSI {  285}
    (( segid "    " and resid 23   and name HA  ))
    (( segid "    " and resid 23   and name HD2 ))
       2.800     2.800     3.200 peak   285 spectrum    2 weight  0.10000E+01 volume  0.33148E-02 ppm1      4.705 ppm2      3.841 CV     1
  ASSI {  286}
    (( segid "    " and resid 23   and name HA  ))
    (( segid "    " and resid 23   and name HD1 ))
       2.700     0.900     0.900 peak   286 spectrum    2 weight  0.10000E+01 volume  0.30971E-02 ppm1      4.706 ppm2      3.708 CV     1
  ASSI {  287}
    (( segid "    " and resid 23   and name HA  ))
    (( segid "    " and resid 23   and name HB2 ))
       2.900     1.000     1.000 peak   287 spectrum    2 weight  0.10000E+01 volume  0.33974E-02 ppm1      4.705 ppm2      2.372 CV     1
  ASSI {  288}
    (( segid "    " and resid 93   and name HA  ))
    (( segid "    " and resid 92   and name HG1 ))
       5.100     3.300     0.900 peak   288 spectrum    2 weight  0.10000E+01 volume  0.23889E-04 ppm1      4.706 ppm2      1.890 CV     1
  ASSI {  290}
    (( segid "    " and resid 17   and name HA  ))
    (( segid "    " and resid 17   and name HE1 ))
       3.400     1.400     1.400 peak   290 spectrum    2 weight  0.10000E+01 volume  0.14002E-02 ppm1      4.654 ppm2      3.080 CV     1
  ASSI {  291}
    (( segid "    " and resid 17   and name HA  ))
    (( segid "    " and resid 18   and name HD2 ))
       2.400     0.700     0.700 peak   291 spectrum    2 weight  0.10000E+01 volume  0.56293E-02 ppm1      4.647 ppm2      3.884 CV     1
  ASSI {  292}
    (( segid "    " and resid 17   and name HA  ))
    (( segid "    " and resid 18   and name HD1 ))
       2.300     0.700     0.700 peak   292 spectrum    2 weight  0.10000E+01 volume  0.45730E-02 ppm1      4.648 ppm2      3.678 CV     1
  ASSI {  293}
    (( segid "    " and resid 17   and name HA  ))
    (( segid "    " and resid 17   and name HB2 ))
       3.100     1.200     1.200 peak   293 spectrum    2 weight  0.10000E+01 volume  0.16474E-02 ppm1      4.648 ppm2      1.843 CV     1
  ASSI {  294}
    (( segid "    " and resid 17   and name HA  ))
    (( segid "    " and resid 17   and name HG2 ))
       3.600     1.600     1.600 peak   294 spectrum    2 weight  0.10000E+01 volume  0.80529E-03 ppm1      4.646 ppm2      1.486 CV     1
  ASSI {  295}
    (( segid "    " and resid 17   and name HA  ))
    (( segid "    " and resid 17   and name HD2 ))
       2.800     0.900     0.900 peak   295 spectrum    2 weight  0.10000E+01 volume  0.20134E-02 ppm1      4.642 ppm2      1.755 CV     1
  ASSI {  296}
    (( segid "    " and resid 49   and name HA  ))
    (( segid "    " and resid 49   and name HB2 ))
       2.700     0.900     0.900 peak   296 spectrum    2 weight  0.10000E+01 volume  0.36336E-02 ppm1      4.631 ppm2      3.323 CV     1
  ASSI {  297}
    (( segid "    " and resid 49   and name HA  ))
    (( segid "    " and resid 49   and name HB1 ))
       2.300     0.700     0.700 peak   297 spectrum    2 weight  0.10000E+01 volume  0.70904E-02 ppm1      4.628 ppm2      2.700 CV     1
  ASSI {  298}
    (( segid "    " and resid 78   and name HB  ))
    (( segid "    " and resid 78   and name HA  ))
       2.200     0.600     0.600 peak   298 spectrum    2 weight  0.10000E+01 volume  0.68414E-02 ppm1      4.618 ppm2      4.238 CV     1
  ASSI {  300}
    (( segid "    " and resid 5    and name HA  ))
    (( segid "    " and resid 5    and name HB  ))
       3.200     1.300     1.300 peak   300 spectrum    2 weight  0.10000E+01 volume  0.69692E-03 ppm1      4.590 ppm2      4.120 CV     1
  ASSI {  301}
    (( segid "    " and resid 5    and name HA  ))
    (( segid "    " and resid 6    and name HD2 ))
       2.800     1.000     1.000 peak   301 spectrum    2 weight  0.10000E+01 volume  0.55322E-02 ppm1      4.592 ppm2      3.895 CV     1
  ASSI {  302}
    (( segid "    " and resid 5    and name HA  ))
    (( segid "    " and resid 6    and name HD1 ))
       2.200     0.600     0.600 peak   302 spectrum    2 weight  0.10000E+01 volume  0.37825E-02 ppm1      4.592 ppm2      3.719 CV     1
  ASSI {  303}
    (( segid "    " and resid 39   and name HA  ))
    (( segid "    " and resid 41   and name HA2 ))
       2.900     2.900     3.100 peak   303 spectrum    2 weight  0.10000E+01 volume  0.61053E-02 ppm1      4.589 ppm2      3.147 CV     1
  ASSI {  304}
    (( segid "    " and resid 5    and name HA  ))
    (  segid "    " and resid 5    and name HG2%)
       2.800     1.000     1.000 peak   304 spectrum    2 weight  0.10000E+01 volume  0.22160E-02 ppm1      4.593 ppm2      1.242 CV     1
  ASSI {  305}
    (( segid "    " and resid 39   and name HA  ))
    (  segid "    " and resid 45   and name HD1%)
       2.800     1.000     1.000 peak   305 spectrum    2 weight  0.10000E+01 volume  0.21719E-02 ppm1      4.591 ppm2      0.920 CV     1
  ASSI {  306}
    (( segid "    " and resid 39   and name HA  ))
    (  segid "    " and resid 45   and name HG2%)
       3.500     1.500     1.500 peak   306 spectrum    2 weight  0.10000E+01 volume  0.75582E-03 ppm1      4.591 ppm2      0.789 CV     1
  ASSI {  307}
    (( segid "    " and resid 57   and name HA  ))
    (( segid "    " and resid 57   and name HB1 ))
       2.400     0.700     0.700 peak   307 spectrum    2 weight  0.10000E+01 volume  0.52158E-02 ppm1      4.939 ppm2      2.797 CV     1
  ASSI {  308}
    (( segid "    " and resid 52   and name HA  ))
    (( segid "    " and resid 52   and name HB1 ))
       2.600     0.800     0.800 peak   308 spectrum    2 weight  0.10000E+01 volume  0.22959E-02 ppm1      4.928 ppm2      3.301 CV     1
  ASSI {  309}
    (( segid "    " and resid 42   and name HA  ))
    (( segid "    " and resid 42   and name HB2 ))
       2.500     0.800     0.800 peak   309 spectrum    2 weight  0.10000E+01 volume  0.34831E-02 ppm1      4.894 ppm2      3.239 CV     1
  ASSI {  310}
    (( segid "    " and resid 42   and name HA  ))
    (( segid "    " and resid 42   and name HB1 ))
       2.000     2.000     4.000 peak   310 spectrum    2 weight  0.10000E+01 volume  0.13857E-01 ppm1      4.894 ppm2      2.757 CV     1
  ASSI {  311}
    (( segid "    " and resid 51   and name HA  ))
    (( segid "    " and resid 51   and name HB1 ))
       3.000     1.100     1.100 peak   311 spectrum    2 weight  0.10000E+01 volume  0.77469E-03 ppm1      4.876 ppm2      2.153 CV     1
  ASSI {  312}
    (( segid "    " and resid 51   and name HA  ))
    (( segid "    " and resid 51   and name HB2 ))
       3.200     1.300     1.300 peak   312 spectrum    2 weight  0.10000E+01 volume  0.16333E-02 ppm1      4.871 ppm2      2.487 CV     1
  ASSI {  313}
    (( segid "    " and resid 77   and name HA  ))
    (  segid "    " and resid 77   and name HB% )
       2.400     0.700     0.700 peak   313 spectrum    2 weight  0.10000E+01 volume  0.42020E-02 ppm1      4.854 ppm2      1.842 CV     1
  ASSI {  315}
    (( segid "    " and resid 32   and name HA  ))
    (  segid "    " and resid 35   and name HB% )
       2.700     0.900     0.900 peak   315 spectrum    2 weight  0.10000E+01 volume  0.22404E-02 ppm1      4.857 ppm2      0.492 CV     1
  ASSI {  316}
    (( segid "    " and resid 71   and name HA  ))
    (  segid "    " and resid 71   and name HB% )
       2.100     0.500     0.500 peak   316 spectrum    2 weight  0.10000E+01 volume  0.77874E-02 ppm1      4.848 ppm2      1.548 CV     1
  ASSI {  317}
    (( segid "    " and resid 89   and name HB  ))
    (  segid "    " and resid 89   and name HG2%)
       2.400     0.700     0.700 peak   317 spectrum    2 weight  0.10000E+01 volume  0.35345E-02 ppm1      4.848 ppm2      1.127 CV     1
  ASSI {  320}
    (( segid "    " and resid 65   and name HA  ))
    (( segid "    " and resid 65   and name HB1 ))
       2.700     0.900     0.900 peak   320 spectrum    2 weight  0.10000E+01 volume  0.14581E-02 ppm1      4.805 ppm2      2.259 CV     1
  ASSI {  321}
    (( segid "    " and resid 65   and name HA  ))
    (( segid "    " and resid 88   and name HB  ))
       4.500     2.500     1.500 peak   321 spectrum    2 weight  0.10000E+01 volume  0.48170E-03 ppm1      4.800 ppm2      2.396 CV     1
  ASSI {  322}
    (( segid "    " and resid 65   and name HA  ))
    (  segid "    " and resid 88   and name HG1%)
       2.900     1.000     1.000 peak   322 spectrum    2 weight  0.10000E+01 volume  0.18778E-02 ppm1      4.798 ppm2      1.041 CV     1
  ASSI {  324}
    (( segid "    " and resid 65   and name HA  ))
    (  segid "    " and resid 88   and name HG2%)
       5.200     3.400     0.800 peak   324 spectrum    2 weight  0.10000E+01 volume  0.15085E-03 ppm1      4.793 ppm2      1.189 CV     1
  ASSI {  325}
    (( segid "    " and resid 46   and name HA  ))
    (  segid "    " and resid 47   and name HG2%)
       5.600     3.900     0.400 peak   325 spectrum    2 weight  0.10000E+01 volume  0.17316E-03 ppm1      4.785 ppm2      1.256 CV     1
  ASSI {  328}
    (( segid "    " and resid 79   and name HA  ))
    (( segid "    " and resid 79   and name HG2 ))
       3.100     1.200     1.200 peak   328 spectrum    2 weight  0.10000E+01 volume  0.79339E-03 ppm1      3.264 ppm2     -0.856 CV     1
  ASSI {  329}
    (( segid "    " and resid 79   and name HD2 ))
    (( segid "    " and resid 79   and name HG2 ))
       3.100     1.200     1.200 peak   329 spectrum    2 weight  0.10000E+01 volume  0.84922E-03 ppm1      2.646 ppm2     -0.858 CV     1
  ASSI {  330}
    (( segid "    " and resid 79   and name HD1 ))
    (( segid "    " and resid 79   and name HG2 ))
       3.600     1.600     1.600 peak   330 spectrum    2 weight  0.10000E+01 volume  0.85942E-03 ppm1      2.294 ppm2     -0.862 CV     1
  ASSI {  332}
    (( segid "    " and resid 79   and name HG1 ))
    (( segid "    " and resid 79   and name HG2 ))
       2.200     0.600     0.600 peak   332 spectrum    2 weight  0.10000E+01 volume  0.20594E-02 ppm1      0.587 ppm2     -0.859 CV     1
  ASSI {  333}
    (( segid "    " and resid 79   and name HB1 ))
    (( segid "    " and resid 79   and name HG2 ))
       2.500     0.800     0.800 peak   333 spectrum    2 weight  0.10000E+01 volume  0.22790E-02 ppm1      0.342 ppm2     -0.861 CV     1
  ASSI {  334}
    (( segid "    " and resid 47   and name HB  ))
    (( segid "    " and resid 47   and name HA  ))
       2.700     0.900     0.900 peak   334 spectrum    2 weight  0.10000E+01 volume  0.30749E-02 ppm1      4.528 ppm2      4.391 CV     1
  ASSI {  336}
    (( segid "    " and resid 47   and name HB  ))
    (  segid "    " and resid 47   and name HG2%)
       2.400     0.700     0.700 peak   336 spectrum    2 weight  0.10000E+01 volume  0.61679E-02 ppm1      4.528 ppm2      1.257 CV     1
  ASSI {  337}
    (( segid "    " and resid 101  and name HA  ))
    (( segid "    " and resid 34   and name HA  ))
       3.100     1.200     1.200 peak   337 spectrum    2 weight  0.10000E+01 volume  0.25506E-02 ppm1      4.507 ppm2      3.404 CV     1
  ASSI {  338}
    (( segid "    " and resid 101  and name HA  ))
    (( segid "    " and resid 101  and name HB2 ))
       3.500     1.600     1.600 peak   338 spectrum    2 weight  0.10000E+01 volume  0.83293E-03 ppm1      4.505 ppm2      3.149 CV     1
  ASSI {  339}
    (( segid "    " and resid 101  and name HA  ))
    (( segid "    " and resid 101  and name HB1 ))
       2.600     0.900     0.900 peak   339 spectrum    2 weight  0.10000E+01 volume  0.19007E-02 ppm1      4.507 ppm2      3.003 CV     1
  ASSI {  340}
    (( segid "    " and resid 87   and name HA  ))
    (( segid "    " and resid 87   and name HG1 ))
       3.000     1.100     1.100 peak   340 spectrum    2 weight  0.10000E+01 volume  0.22280E-02 ppm1      4.507 ppm2      2.440 CV     1
  ASSI {  341}
    (( segid "    " and resid 87   and name HA  ))
    (( segid "    " and resid 87   and name HB1 ))
       2.400     0.700     0.700 peak   341 spectrum    2 weight  0.10000E+01 volume  0.39683E-02 ppm1      4.507 ppm2      2.166 CV     1
  ASSI {  342}
    (( segid "    " and resid 101  and name HA  ))
    (( segid "    " and resid 104  and name HB1 ))
       3.400     1.500     1.500 peak   342 spectrum    2 weight  0.10000E+01 volume  0.20501E-02 ppm1      4.508 ppm2      1.862 CV     1
  ASSI {  343}
    (( segid "    " and resid 101  and name HA  ))
    (( segid "    " and resid 104  and name HG1 ))
       4.100     2.100     1.900 peak   343 spectrum    2 weight  0.10000E+01 volume  0.53161E-03 ppm1      4.508 ppm2      1.662 CV     1
  ASSI {  345}
    (( segid "    " and resid 31   and name HA  ))
    (( segid "    " and resid 31   and name HB1 ))
       2.800     1.000     1.000 peak   345 spectrum    2 weight  0.10000E+01 volume  0.11386E-02 ppm1      4.470 ppm2      3.411 CV     1
  ASSI {  346}
    (( segid "    " and resid 31   and name HA  ))
    (( segid "    " and resid 31   and name HB2 ))
       3.300     1.400     1.400 peak   346 spectrum    2 weight  0.10000E+01 volume  0.73394E-03 ppm1      4.468 ppm2      3.153 CV     1
  ASSI {  347}
    (( segid "    " and resid 61   and name HB  ))
    (  segid "    " and resid 61   and name HG2%)
       2.200     0.600     0.600 peak   347 spectrum    2 weight  0.10000E+01 volume  0.77430E-02 ppm1      4.467 ppm2      1.428 CV     1
  ASSI {  348}
    (( segid "    " and resid 31   and name HA  ))
    (  segid "    " and resid 55   and name HG2%)
       3.300     1.400     1.400 peak   348 spectrum    2 weight  0.10000E+01 volume  0.14671E-02 ppm1      4.468 ppm2      0.680 CV     1
  ASSI {  349}
    (( segid "    " and resid 31   and name HA  ))
    (( segid "    " and resid 83   and name HG11))
       4.200     2.200     1.800 peak   349 spectrum    2 weight  0.10000E+01 volume  0.82591E-03 ppm1      4.467 ppm2      0.580 CV     1
  ASSI {  351}
    (( segid "    " and resid 31   and name HA  ))
    (  segid "    " and resid 34   and name HD1%)
       3.300     1.400     1.400 peak   351 spectrum    2 weight  0.10000E+01 volume  0.81236E-03 ppm1      4.469 ppm2      0.235 CV     1
  ASSI {  353}
    (( segid "    " and resid 29   and name HA  ))
    (( segid "    " and resid 29   and name HB1 ))
       2.200     2.200     3.800 peak   353 spectrum    2 weight  0.10000E+01 volume  0.68156E-02 ppm1      4.441 ppm2      4.010 CV     1
  ASSI {  355}
    (( segid "    " and resid 18   and name HA  ))
    (( segid "    " and resid 18   and name HB2 ))
       2.400     0.700     0.700 peak   355 spectrum    2 weight  0.10000E+01 volume  0.10030E-01 ppm1      4.456 ppm2      2.316 CV     1
  ASSI {  356}
    (( segid "    " and resid 18   and name HA  ))
    (( segid "    " and resid 18   and name HB1 ))
       2.400     0.700     0.700 peak   356 spectrum    2 weight  0.10000E+01 volume  0.36898E-02 ppm1      4.459 ppm2      1.979 CV     1
  ASSI {  357}
    (( segid "    " and resid 31   and name HA  ))
    (( segid "    " and resid 34   and name HB  ))
       2.300     0.700     0.700 peak   357 spectrum    2 weight  0.10000E+01 volume  0.44520E-02 ppm1      4.455 ppm2      1.884 CV     1
  ASSI {  358}
    (( segid "    " and resid 18   and name HA  ))
    (( segid "    " and resid 18   and name HG1 ))
       2.400     2.400     3.600 peak   358 spectrum    2 weight  0.10000E+01 volume  0.97668E-02 ppm1      4.449 ppm2      2.053 CV     1
  ASSI {  359}
    (( segid "    " and resid 24   and name HA  ))
    (( segid "    " and resid 24   and name HD1 ))
       2.100     2.100     3.900 peak   359 spectrum    2 weight  0.10000E+01 volume  0.12813E-01 ppm1      4.431 ppm2      3.906 CV     1
  ASSI {  360}
    (( segid "    " and resid 24   and name HA  ))
    (( segid "    " and resid 24   and name HD2 ))
       2.700     0.900     0.900 peak   360 spectrum    2 weight  0.10000E+01 volume  0.64832E-02 ppm1      4.427 ppm2      3.676 CV     1
  ASSI {  361}
    (( segid "    " and resid 22   and name HA  ))
    (  segid "    " and resid 22   and name HG2%)
       2.300     2.300     3.700 peak   361 spectrum    2 weight  0.10000E+01 volume  0.74924E-02 ppm1      4.428 ppm2      0.928 CV     1
  ASSI {  362}
    (( segid "    " and resid 13   and name HA  ))
    (( segid "    " and resid 13   and name HB2 ))
       2.300     0.700     0.700 peak   362 spectrum    2 weight  0.10000E+01 volume  0.69324E-02 ppm1      4.411 ppm2      1.813 CV     1
  ASSI {  364}
    (( segid "    " and resid 13   and name HA  ))
    (( segid "    " and resid 13   and name HG1 ))
       2.800     1.000     1.000 peak   364 spectrum    2 weight  0.10000E+01 volume  0.33634E-02 ppm1      4.410 ppm2      1.579 CV     1
  ASSI {  366}
    (( segid "    " and resid 13   and name HA  ))
    (( segid "    " and resid 13   and name HB1 ))
       2.100     0.600     0.600 peak   366 spectrum    2 weight  0.10000E+01 volume  0.90017E-02 ppm1      4.408 ppm2      1.761 CV     1
  ASSI {  367}
    (( segid "    " and resid 75   and name HA  ))
    (( segid "    " and resid 73   and name HG1 ))
       2.700     2.700     3.300 peak   367 spectrum    2 weight  0.10000E+01 volume  0.61607E-02 ppm1      4.391 ppm2      1.106 CV     1
  ASSI {  368}
    (( segid "    " and resid 47   and name HA  ))
    (  segid "    " and resid 47   and name HG2%)
       2.100     0.600     0.600 peak   368 spectrum    2 weight  0.10000E+01 volume  0.13505E-01 ppm1      4.387 ppm2      1.251 CV     1
  ASSI {  371}
    (( segid "    " and resid 99   and name HA  ))
    (( segid "    " and resid 99   and name HD1 ))
       3.300     1.400     1.400 peak   371 spectrum    2 weight  0.10000E+01 volume  0.11338E-02 ppm1      4.381 ppm2      3.498 CV     1
  ASSI {  372}
    (( segid "    " and resid 75   and name HA  ))
    (( segid "    " and resid 75   and name HB1 ))
       2.600     0.900     0.900 peak   372 spectrum    2 weight  0.10000E+01 volume  0.32593E-02 ppm1      4.380 ppm2      2.626 CV     1
  ASSI {  373}
    (( segid "    " and resid 75   and name HA  ))
    (( segid "    " and resid 75   and name HB2 ))
       2.400     0.700     0.700 peak   373 spectrum    2 weight  0.10000E+01 volume  0.42970E-02 ppm1      4.380 ppm2      2.530 CV     1
  ASSI {  374}
    (( segid "    " and resid 99   and name HA  ))
    (( segid "    " and resid 99   and name HB2 ))
       2.500     0.800     0.800 peak   374 spectrum    2 weight  0.10000E+01 volume  0.83951E-02 ppm1      4.379 ppm2      2.301 CV     1
  ASSI {  375}
    (( segid "    " and resid 99   and name HA  ))
    (( segid "    " and resid 99   and name HG1 ))
       2.200     0.600     0.600 peak   375 spectrum    2 weight  0.10000E+01 volume  0.93401E-02 ppm1      4.382 ppm2      2.051 CV     1
  ASSI {  376}
    (( segid "    " and resid 20   and name HA  ))
    (( segid "    " and resid 20   and name HB  ))
       4.800     2.900     1.200 peak   376 spectrum    2 weight  0.10000E+01 volume  0.11350E-03 ppm1      4.374 ppm2      4.255 CV     1
  ASSI {  378}
    (( segid "    " and resid 20   and name HA  ))
    (  segid "    " and resid 20   and name HG2%)
       2.200     0.600     0.600 peak   378 spectrum    2 weight  0.10000E+01 volume  0.12155E-01 ppm1      4.376 ppm2      1.214 CV     1
  ASSI {  379}
    (( segid "    " and resid 76   and name HA  ))
    (  segid "    " and resid 71   and name HB% )
       2.700     2.700     3.300 peak   379 spectrum    2 weight  0.10000E+01 volume  0.11185E-01 ppm1      4.369 ppm2      1.557 CV     1
  ASSI {  381}
    (( segid "    " and resid 76   and name HA  ))
    (( segid "    " and resid 76   and name HB2 ))
       2.000     0.500     0.500 peak   381 spectrum    2 weight  0.10000E+01 volume  0.10916E-01 ppm1      4.363 ppm2      1.783 CV     1
  ASSI {  383}
    (( segid "    " and resid 37   and name HA  ))
    (( segid "    " and resid 37   and name HB2 ))
       2.500     0.800     0.800 peak   383 spectrum    2 weight  0.10000E+01 volume  0.31779E-02 ppm1      4.350 ppm2      3.210 CV     1
  ASSI {  384}
    (( segid "    " and resid 55   and name HA  ))
    (  segid "    " and resid 55   and name HG2%)
       2.300     0.700     0.700 peak   384 spectrum    2 weight  0.10000E+01 volume  0.79196E-02 ppm1      4.346 ppm2      0.673 CV     1
  ASSI {  385}
    (( segid "    " and resid 35   and name HA  ))
    (  segid "    " and resid 35   and name HB% )
       2.200     0.600     0.600 peak   385 spectrum    2 weight  0.10000E+01 volume  0.88514E-02 ppm1      4.349 ppm2      0.494 CV     1
  ASSI {  388}
    (( segid "    " and resid 72   and name HA  ))
    (( segid "    " and resid 72   and name HB2 ))
       2.100     0.600     0.600 peak   388 spectrum    2 weight  0.10000E+01 volume  0.10373E-01 ppm1      4.336 ppm2      2.460 CV     1
  ASSI {  391}
    (( segid "    " and resid 72   and name HA  ))
    (( segid "    " and resid 72   and name HB1 ))
       1.800     0.400     0.400 peak   391 spectrum    2 weight  0.10000E+01 volume  0.12519E-01 ppm1      4.332 ppm2      1.681 CV     1
  ASSI {  393}
    (( segid "    " and resid 68   and name HA  ))
    (  segid "    " and resid 68   and name HD1%)
       2.300     2.300     3.700 peak   393 spectrum    2 weight  0.10000E+01 volume  0.14053E-01 ppm1      4.331 ppm2      1.010 CV     1
  ASSI {  394}
    (( segid "    " and resid 68   and name HA  ))
    (  segid "    " and resid 68   and name HD2%)
       2.700     2.700     3.300 peak   394 spectrum    2 weight  0.10000E+01 volume  0.97860E-02 ppm1      4.331 ppm2      0.866 CV     1
  ASSI {  395}
    (( segid "    " and resid 16   and name HA  ))
    (( segid "    " and resid 16   and name HB  ))
       2.800     1.000     1.000 peak   395 spectrum    2 weight  0.10000E+01 volume  0.27934E-02 ppm1      4.323 ppm2      4.175 CV     1
  ASSI {  396}
    (( segid "    " and resid 82   and name HA  ))
    (( segid "    " and resid 82   and name HG2 ))
       3.700     1.700     1.700 peak   396 spectrum    2 weight  0.10000E+01 volume  0.39197E-03 ppm1      4.326 ppm2      2.782 CV     1
  ASSI {  397}
    (( segid "    " and resid 16   and name HA  ))
    (  segid "    " and resid 16   and name HG2%)
       2.400     0.700     0.700 peak   397 spectrum    2 weight  0.10000E+01 volume  0.61936E-02 ppm1      4.323 ppm2      1.190 CV     1
  ASSI {  398}
    (( segid "    " and resid 10   and name HA  ))
    (  segid "    " and resid 10   and name HB% )
       1.600     1.600     4.400 peak   398 spectrum    2 weight  0.10000E+01 volume  0.57680E-01 ppm1      4.319 ppm2      1.393 CV     1
  ASSI {  399}
    (( segid "    " and resid 92   and name HA  ))
    (( segid "    " and resid 92   and name HD1 ))
       4.700     2.700     1.300 peak   399 spectrum    2 weight  0.10000E+01 volume  0.59315E-03 ppm1      4.285 ppm2      3.249 CV     1
  ASSI {  400}
    (( segid "    " and resid 92   and name HA  ))
    (( segid "    " and resid 92   and name HB1 ))
       2.000     0.500     0.500 peak   400 spectrum    2 weight  0.10000E+01 volume  0.96527E-02 ppm1      4.283 ppm2      2.004 CV     1
  ASSI {  401}
    (( segid "    " and resid 92   and name HA  ))
    (( segid "    " and resid 91   and name HG  ))
       2.500     2.500     3.500 peak   401 spectrum    2 weight  0.10000E+01 volume  0.54041E-02 ppm1      4.284 ppm2      1.665 CV     1
  ASSI {  402}
    (( segid "    " and resid 92   and name HA  ))
    (( segid "    " and resid 92   and name HG1 ))
       2.600     0.900     0.900 peak   402 spectrum    2 weight  0.10000E+01 volume  0.38642E-02 ppm1      4.281 ppm2      1.922 CV     1
  ASSI {  403}
    (( segid "    " and resid 33   and name HA  ))
    (( segid "    " and resid 105  and name HA  ))
       3.600     1.600     1.600 peak   403 spectrum    2 weight  0.10000E+01 volume  0.33323E-02 ppm1      4.270 ppm2      4.130 CV     1
  ASSI {  406}
    (( segid "    " and resid 48   and name HA2 ))
    (( segid "    " and resid 48   and name HA1 ))
       1.800     0.400     0.400 peak   406 spectrum    2 weight  0.10000E+01 volume  0.17411E-01 ppm1      4.254 ppm2      3.940 CV     1
  ASSI {  407}
    (( segid "    " and resid 9    and name HA  ))
    (( segid "    " and resid 9    and name HG2 ))
       3.100     1.200     1.200 peak   407 spectrum    2 weight  0.10000E+01 volume  0.23445E-02 ppm1      4.251 ppm2      2.193 CV     1
  ASSI {  408}
    (( segid "    " and resid 9    and name HA  ))
    (( segid "    " and resid 9    and name HB1 ))
       2.500     0.800     0.800 peak   408 spectrum    2 weight  0.10000E+01 volume  0.41362E-02 ppm1      4.251 ppm2      1.904 CV     1
  ASSI {  409}
    (( segid "    " and resid 33   and name HA  ))
    (  segid "    " and resid 33   and name HB% )
       2.100     0.500     0.500 peak   409 spectrum    2 weight  0.10000E+01 volume  0.11633E-01 ppm1      4.252 ppm2      1.537 CV     1
  ASSI {  410}
    (( segid "    " and resid 20   and name HB  ))
    (  segid "    " and resid 20   and name HG2%)
       2.100     0.600     0.600 peak   410 spectrum    2 weight  0.10000E+01 volume  0.11526E-01 ppm1      4.254 ppm2      1.209 CV     1
  ASSI {  411}
    (( segid "    " and resid 86   and name HA  ))
    (  segid "    " and resid 86   and name HB% )
       2.600     0.800     0.800 peak   411 spectrum    2 weight  0.10000E+01 volume  0.30002E-02 ppm1      4.257 ppm2      0.727 CV     1
  ASSI {  412}
    (( segid "    " and resid 86   and name HA  ))
    (  segid "    " and resid 85   and name HG1%)
       4.100     2.100     1.900 peak   412 spectrum    2 weight  0.10000E+01 volume  0.24471E-03 ppm1      4.253 ppm2      0.449 CV     1
  ASSI {  413}
    (( segid "    " and resid 9    and name HA  ))
    (( segid "    " and resid 9    and name HB2 ))
       2.100     0.600     0.600 peak   413 spectrum    2 weight  0.10000E+01 volume  0.11051E-01 ppm1      4.247 ppm2      2.024 CV     1
  ASSI {  416}
    (( segid "    " and resid 26   and name HA  ))
    (  segid "    " and resid 26   and name HD1%)
       2.300     0.700     0.700 peak   416 spectrum    2 weight  0.10000E+01 volume  0.69587E-02 ppm1      4.238 ppm2      0.812 CV     1
  ASSI {  418}
    (( segid "    " and resid 90   and name HA  ))
    (( segid "    " and resid 90   and name HD1 ))
       3.700     1.700     1.700 peak   418 spectrum    2 weight  0.10000E+01 volume  0.14061E-02 ppm1      4.233 ppm2      2.286 CV     1
  ASSI {  419}
    (( segid "    " and resid 90   and name HA  ))
    (( segid "    " and resid 90   and name HB1 ))
       2.000     0.500     0.500 peak   419 spectrum    2 weight  0.10000E+01 volume  0.11425E-01 ppm1      4.237 ppm2      1.990 CV     1
  ASSI {  421}
    (( segid "    " and resid 7    and name HA  ))
    (  segid "    " and resid 7    and name HB% )
       1.900     1.900     4.100 peak   421 spectrum    2 weight  0.10000E+01 volume  0.26928E-01 ppm1      4.235 ppm2      1.359 CV     1
  ASSI {  422}
    (( segid "    " and resid 90   and name HA  ))
    (( segid "    " and resid 90   and name HD2 ))
       3.300     1.400     1.400 peak   422 spectrum    2 weight  0.10000E+01 volume  0.11543E-02 ppm1      4.227 ppm2      2.439 CV     1
  ASSI {  423}
    (( segid "    " and resid 90   and name HA  ))
    (( segid "    " and resid 90   and name HG1 ))
       3.200     1.300     1.300 peak   423 spectrum    2 weight  0.10000E+01 volume  0.99193E-03 ppm1      4.231 ppm2      1.761 CV     1
  ASSI {  426}
    (( segid "    " and resid 16   and name HB  ))
    (( segid "    " and resid 17   and name HB2 ))
       4.200     2.200     1.800 peak   426 spectrum    2 weight  0.10000E+01 volume  0.50610E-03 ppm1      4.183 ppm2      1.843 CV     1
  ASSI {  427}
    (( segid "    " and resid 16   and name HB  ))
    (( segid "    " and resid 15   and name HA2 ))
       3.000     3.000     3.000 peak   427 spectrum    2 weight  0.10000E+01 volume  0.53472E-02 ppm1      4.179 ppm2      3.987 CV     1
  ASSI {  428}
    (( segid "    " and resid 4    and name HA  ))
    (( segid "    " and resid 4    and name HB  ))
       2.600     0.900     0.900 peak   428 spectrum    2 weight  0.10000E+01 volume  0.29063E-02 ppm1      4.171 ppm2      2.035 CV     1
  ASSI {  429}
    (( segid "    " and resid 4    and name HA  ))
    (  segid "    " and resid 4    and name HG2%)
       2.200     2.200     3.800 peak   429 spectrum    2 weight  0.10000E+01 volume  0.96247E-02 ppm1      4.169 ppm2      0.910 CV     1
  ASSI {  430}
    (( segid "    " and resid 16   and name HB  ))
    (  segid "    " and resid 16   and name HG2%)
       2.100     0.600     0.600 peak   430 spectrum    2 weight  0.10000E+01 volume  0.12461E-01 ppm1      4.164 ppm2      1.192 CV     1
  ASSI {  431}
    (( segid "    " and resid 41   and name HA1 ))
    (  segid "    " and resid 35   and name HB% )
       3.900     1.900     1.900 peak   431 spectrum    2 weight  0.10000E+01 volume  0.14157E-02 ppm1      4.143 ppm2      0.489 CV     1
  ASSI {  433}
    (( segid "    " and resid 40   and name HA1 ))
    (( segid "    " and resid 40   and name HA2 ))
       2.000     0.500     0.500 peak   433 spectrum    2 weight  0.10000E+01 volume  0.81922E-02 ppm1      4.139 ppm2      3.916 CV     1
  ASSI {  434}
    (( segid "    " and resid 64   and name HA  ))
    (  segid "    " and resid 64   and name HB% )
       2.000     0.500     0.500 peak   434 spectrum    2 weight  0.10000E+01 volume  0.18195E-01 ppm1      4.141 ppm2      1.508 CV     1
  ASSI {  438}
    (( segid "    " and resid 3    and name HA  ))
    (( segid "    " and resid 3    and name HB  ))
       2.500     0.800     0.800 peak   438 spectrum    2 weight  0.10000E+01 volume  0.42270E-02 ppm1      4.124 ppm2      2.020 CV     1
  ASSI {  439}
    (( segid "    " and resid 5    and name HB  ))
    (  segid "    " and resid 5    and name HG2%)
       2.100     0.500     0.500 peak   439 spectrum    2 weight  0.10000E+01 volume  0.13220E-01 ppm1      4.125 ppm2      1.233 CV     1
  ASSI {  440}
    (( segid "    " and resid 3    and name HA  ))
    (  segid "    " and resid 3    and name HG2%)
       1.700     1.700     4.300 peak   440 spectrum    2 weight  0.10000E+01 volume  0.45699E-01 ppm1      4.128 ppm2      0.952 CV     1
  ASSI {  441}
    (( segid "    " and resid 5    and name HB  ))
    (( segid "    " and resid 6    and name HD1 ))
       3.600     1.600     1.600 peak   441 spectrum    2 weight  0.10000E+01 volume  0.23822E-02 ppm1      4.123 ppm2      3.722 CV     1
  ASSI {  442}
    (( segid "    " and resid 41   and name HA1 ))
    (( segid "    " and resid 41   and name HA2 ))
       1.900     0.500     0.500 peak   442 spectrum    2 weight  0.10000E+01 volume  0.82646E-02 ppm1      4.120 ppm2      3.135 CV     1
  ASSI {  443}
    (( segid "    " and resid 59   and name HA  ))
    (( segid "    " and resid 59   and name HG1 ))
       2.800     1.000     1.000 peak   443 spectrum    2 weight  0.10000E+01 volume  0.24073E-02 ppm1      4.120 ppm2      2.471 CV     1
  ASSI {  444}
    (( segid "    " and resid 59   and name HA  ))
    (( segid "    " and resid 59   and name HB2 ))
       2.600     0.800     0.800 peak   444 spectrum    2 weight  0.10000E+01 volume  0.13605E-02 ppm1      4.123 ppm2      2.319 CV     1
  ASSI {  445}
    (( segid "    " and resid 14   and name HA  ))
    (( segid "    " and resid 14   and name HB  ))
       2.500     0.800     0.800 peak   445 spectrum    2 weight  0.10000E+01 volume  0.42512E-02 ppm1      4.130 ppm2      2.087 CV     1
  ASSI {  447}
    (( segid "    " and resid 108  and name HA  ))
    (( segid "    " and resid 108  and name HB2 ))
       3.000     1.100     1.100 peak   447 spectrum    2 weight  0.10000E+01 volume  0.29312E-02 ppm1      4.090 ppm2      1.742 CV     1
  ASSI {  448}
    (( segid "    " and resid 108  and name HA  ))
    (( segid "    " and resid 108  and name HB1 ))
       2.500     0.800     0.800 peak   448 spectrum    2 weight  0.10000E+01 volume  0.31478E-02 ppm1      4.089 ppm2      1.650 CV     1
  ASSI {  449}
    (( segid "    " and resid 103  and name HA  ))
    (  segid "    " and resid 103  and name HB% )
       2.100     2.100     3.900 peak   449 spectrum    2 weight  0.10000E+01 volume  0.11204E-01 ppm1      4.090 ppm2      1.435 CV     1
  ASSI {  450}
    (( segid "    " and resid 12   and name HA  ))
    (  segid "    " and resid 12   and name HG2%)
       1.800     1.800     4.200 peak   450 spectrum    2 weight  0.10000E+01 volume  0.26695E-01 ppm1      4.080 ppm2      0.926 CV     1
  ASSI {  451}
    (( segid "    " and resid 11   and name HA  ))
    (( segid "    " and resid 11   and name HB  ))
       2.200     0.600     0.600 peak   451 spectrum    2 weight  0.10000E+01 volume  0.93313E-02 ppm1      4.079 ppm2      2.033 CV     1
  ASSI {  452}
    (( segid "    " and resid 91   and name HA  ))
    (( segid "    " and resid 91   and name HG  ))
       2.600     2.600     3.400 peak   452 spectrum    2 weight  0.10000E+01 volume  0.49272E-02 ppm1      4.042 ppm2      1.638 CV     1
  ASSI {  455}
    (( segid "    " and resid 66   and name HA2 ))
    (( segid "    " and resid 66   and name HA1 ))
       1.700     0.400     0.500 peak   455 spectrum    2 weight  0.10000E+01 volume  0.16667E-01 ppm1      4.010 ppm2      3.680 CV     1
  ASSI {  457}
    (( segid "    " and resid 104  and name HA  ))
    (( segid "    " and resid 104  and name HD2 ))
       3.600     1.600     1.600 peak   457 spectrum    2 weight  0.10000E+01 volume  0.97306E-03 ppm1      4.012 ppm2      3.147 CV     1
  ASSI {  459}
    (( segid "    " and resid 104  and name HA  ))
    (( segid "    " and resid 104  and name HB1 ))
       2.400     0.700     0.700 peak   459 spectrum    2 weight  0.10000E+01 volume  0.47656E-02 ppm1      4.013 ppm2      1.862 CV     1
  ASSI {  460}
    (( segid "    " and resid 104  and name HA  ))
    (( segid "    " and resid 104  and name HG2 ))
       2.700     0.900     0.900 peak   460 spectrum    2 weight  0.10000E+01 volume  0.34194E-02 ppm1      4.013 ppm2      1.752 CV     1
  ASSI {  462}
    (( segid "    " and resid 74   and name HA  ))
    (  segid "    " and resid 74   and name HB% )
       1.800     1.800     4.200 peak   462 spectrum    2 weight  0.10000E+01 volume  0.21456E-01 ppm1      4.010 ppm2      0.827 CV     1
  ASSI {  463}
    (( segid "    " and resid 104  and name HA  ))
    (( segid "    " and resid 104  and name HD1 ))
       3.900     1.900     1.900 peak   463 spectrum    2 weight  0.10000E+01 volume  0.56589E-03 ppm1      4.009 ppm2      3.103 CV     1
  ASSI {  465}
    (( segid "    " and resid 29   and name HB2 ))
    (  segid "    " and resid 30   and name HD1%)
       3.000     3.000     3.000 peak   465 spectrum    2 weight  0.10000E+01 volume  0.16353E-02 ppm1      4.006 ppm2      0.555 CV     1
  ASSI {  466}
    (( segid "    " and resid 61   and name HA  ))
    (  segid "    " and resid 64   and name HB% )
       1.900     1.900     4.100 peak   466 spectrum    2 weight  0.10000E+01 volume  0.23341E-01 ppm1      4.000 ppm2      1.500 CV     1
  ASSI {  467}
    (( segid "    " and resid 61   and name HA  ))
    (  segid "    " and resid 61   and name HG2%)
       2.000     2.000     4.000 peak   467 spectrum    2 weight  0.10000E+01 volume  0.16469E-01 ppm1      4.000 ppm2      1.436 CV     1
  ASSI {  474}
    (( segid "    " and resid 73   and name HA  ))
    (( segid "    " and resid 73   and name HG1 ))
       2.400     2.400     3.600 peak   474 spectrum    2 weight  0.10000E+01 volume  0.80320E-02 ppm1      3.976 ppm2      1.125 CV     1
  ASSI {  475}
    (( segid "    " and resid 50   and name HA1 ))
    (( segid "    " and resid 50   and name HA2 ))
       2.000     0.500     0.500 peak   475 spectrum    2 weight  0.10000E+01 volume  0.79333E-02 ppm1      3.944 ppm2      3.303 CV     1
  ASSI {  476}
    (( segid "    " and resid 30   and name HA  ))
    (( segid "    " and resid 30   and name HB  ))
       2.400     0.700     0.700 peak   476 spectrum    2 weight  0.10000E+01 volume  0.34898E-02 ppm1      3.923 ppm2      1.706 CV     1
  ASSI {  477}
    (( segid "    " and resid 30   and name HA  ))
    (  segid "    " and resid 33   and name HB% )
       2.300     0.700     0.700 peak   477 spectrum    2 weight  0.10000E+01 volume  0.75790E-02 ppm1      3.925 ppm2      1.541 CV     1
  ASSI {  478}
    (( segid "    " and resid 30   and name HA  ))
    (( segid "    " and resid 30   and name HG11))
       3.100     1.200     1.200 peak   478 spectrum    2 weight  0.10000E+01 volume  0.21816E-02 ppm1      3.924 ppm2      0.824 CV     1
  ASSI {  479}
    (( segid "    " and resid 30   and name HA  ))
    (  segid "    " and resid 30   and name HD1%)
       3.000     3.000     3.000 peak   479 spectrum    2 weight  0.10000E+01 volume  0.22166E-02 ppm1      3.922 ppm2      0.540 CV     1
  ASSI {  480}
    (( segid "    " and resid 97   and name HA  ))
    (  segid "    " and resid 97   and name HB% )
       2.500     0.800     0.800 peak   480 spectrum    2 weight  0.10000E+01 volume  0.46690E-02 ppm1      3.920 ppm2      0.170 CV     1
  ASSI {  481}
    (( segid "    " and resid 28   and name HA1 ))
    (  segid "    " and resid 25   and name HG1%)
       2.400     2.400     3.600 peak   481 spectrum    2 weight  0.10000E+01 volume  0.46519E-02 ppm1      3.915 ppm2      0.922 CV     1
  ASSI {  483}
    (( segid "    " and resid 18   and name HD2 ))
    (( segid "    " and resid 18   and name HG1 ))
       2.100     0.600     0.600 peak   483 spectrum    2 weight  0.10000E+01 volume  0.27410E-01 ppm1      3.892 ppm2      2.015 CV     1
  ASSI {  485}
    (( segid "    " and resid 89   and name HA  ))
    (  segid "    " and resid 89   and name HG2%)
       2.300     2.300     3.700 peak   485 spectrum    2 weight  0.10000E+01 volume  0.46215E-02 ppm1      3.890 ppm2      1.127 CV     1
  ASSI {  486}
    (( segid "    " and resid 89   and name HA  ))
    (  segid "    " and resid 88   and name HG1%)
       3.100     3.100     2.900 peak   486 spectrum    2 weight  0.10000E+01 volume  0.13998E-02 ppm1      3.894 ppm2      1.043 CV     1
  ASSI {  487}
    (( segid "    " and resid 18   and name HD2 ))
    (( segid "    " and resid 18   and name HD1 ))
       1.300     0.200     0.900 peak   487 spectrum    2 weight  0.10000E+01 volume  0.75834E-01 ppm1      3.888 ppm2      3.698 CV     1
  ASSI {  489}
    (( segid "    " and resid 89   and name HA  ))
    (( segid "    " and resid 92   and name HD1 ))
       2.200     0.600     0.600 peak   489 spectrum    2 weight  0.10000E+01 volume  0.35036E-02 ppm1      3.888 ppm2      3.220 CV     1
  ASSI {  491}
    (( segid "    " and resid 43   and name HA  ))
    (( segid "    " and resid 43   and name HB1 ))
       2.200     0.600     0.600 peak   491 spectrum    2 weight  0.10000E+01 volume  0.38330E-02 ppm1      3.868 ppm2      3.130 CV     1
  ASSI {  494}
    (( segid "    " and resid 23   and name HD2 ))
    (  segid "    " and resid 22   and name HG2%)
       4.100     2.100     1.900 peak   494 spectrum    2 weight  0.10000E+01 volume  0.65161E-03 ppm1      3.848 ppm2      0.920 CV     1
  ASSI {  496}
    (( segid "    " and resid 23   and name HD2 ))
    (( segid "    " and resid 23   and name HG2 ))
       1.700     0.400     0.500 peak   496 spectrum    2 weight  0.10000E+01 volume  0.22352E-01 ppm1      3.843 ppm2      2.051 CV     1
  ASSI {  497}
    (( segid "    " and resid 62   and name HA  ))
    (  segid "    " and resid 85   and name HG1%)
       2.800     0.900     0.900 peak   497 spectrum    2 weight  0.10000E+01 volume  0.13275E-02 ppm1      3.841 ppm2      0.431 CV     1
  ASSI {  498}
    (( segid "    " and resid 36   and name HA2 ))
    (( segid "    " and resid 36   and name HA1 ))
       2.000     0.500     0.500 peak   498 spectrum    2 weight  0.10000E+01 volume  0.73964E-02 ppm1      3.832 ppm2      3.513 CV     1
  ASSI {  499}
    (( segid "    " and resid 102  and name HA  ))
    (  segid "    " and resid 105  and name HB% )
       2.700     0.900     0.900 peak   499 spectrum    2 weight  0.10000E+01 volume  0.16148E-02 ppm1      3.814 ppm2      1.195 CV     1
  ASSI {  500}
    (( segid "    " and resid 102  and name HA  ))
    (  segid "    " and resid 34   and name HD1%)
       2.700     0.900     0.900 peak   500 spectrum    2 weight  0.10000E+01 volume  0.17113E-02 ppm1      3.818 ppm2      0.232 CV     1
  ASSI {  502}
    (( segid "    " and resid 45   and name HA  ))
    (( segid "    " and resid 42   and name HB2 ))
       4.300     2.300     1.700 peak   502 spectrum    2 weight  0.10000E+01 volume  0.91262E-03 ppm1      3.801 ppm2      3.219 CV     1
  ASSI {  504}
    (( segid "    " and resid 45   and name HA  ))
    (( segid "    " and resid 45   and name HB  ))
       2.600     0.800     0.800 peak   504 spectrum    2 weight  0.10000E+01 volume  0.21246E-02 ppm1      3.796 ppm2      1.844 CV     1
  ASSI {  506}
    (( segid "    " and resid 45   and name HA  ))
    (  segid "    " and resid 45   and name HD1%)
       3.200     1.300     1.300 peak   506 spectrum    2 weight  0.10000E+01 volume  0.51968E-02 ppm1      3.796 ppm2      0.922 CV     1
  ASSI {  507}
    (( segid "    " and resid 45   and name HA  ))
    (  segid "    " and resid 45   and name HG2%)
       2.800     1.000     1.000 peak   507 spectrum    2 weight  0.10000E+01 volume  0.33752E-02 ppm1      3.796 ppm2      0.793 CV     1
  ASSI {  508}
    (( segid "    " and resid 57   and name HB2 ))
    (( segid "    " and resid 57   and name HB1 ))
       2.100     0.600     0.600 peak   508 spectrum    2 weight  0.10000E+01 volume  0.42371E-02 ppm1      3.787 ppm2      2.810 CV     1
  ASSI {  509}
    (( segid "    " and resid 69   and name HA  ))
    (( segid "    " and resid 69   and name HB1 ))
       2.100     0.500     0.500 peak   509 spectrum    2 weight  0.10000E+01 volume  0.11554E-01 ppm1      3.788 ppm2      1.349 CV     1
  ASSI {  510}
    (( segid "    " and resid 69   and name HA  ))
    (( segid "    " and resid 69   and name HG1 ))
       2.300     2.300     3.700 peak   510 spectrum    2 weight  0.10000E+01 volume  0.12498E-01 ppm1      3.782 ppm2      1.058 CV     1
  ASSI {  512}
    (( segid "    " and resid 63   and name HA  ))
    (( segid "    " and resid 62   and name HB1 ))
       3.400     1.500     1.500 peak   512 spectrum    2 weight  0.10000E+01 volume  0.10223E-02 ppm1      3.706 ppm2      3.099 CV     1
  ASSI {  520}
    (( segid "    " and resid 88   and name HA  ))
    (( segid "    " and resid 88   and name HB  ))
       2.500     0.800     0.800 peak   520 spectrum    2 weight  0.10000E+01 volume  0.45380E-02 ppm1      3.689 ppm2      2.389 CV     1
  ASSI {  522}
    (( segid "    " and resid 88   and name HA  ))
    (  segid "    " and resid 88   and name HG1%)
       2.200     2.200     3.800 peak   522 spectrum    2 weight  0.10000E+01 volume  0.84818E-02 ppm1      3.687 ppm2      1.046 CV     1
  ASSI {  523}
    (( segid "    " and resid 24   and name HD2 ))
    (( segid "    " and resid 24   and name HB1 ))
       3.900     1.900     1.900 peak   523 spectrum    2 weight  0.10000E+01 volume  0.96335E-03 ppm1      3.684 ppm2      1.861 CV     1
  ASSI {  525}
    (( segid "    " and resid 88   and name HA  ))
    (  segid "    " and resid 88   and name HG2%)
       2.200     2.200     3.800 peak   525 spectrum    2 weight  0.10000E+01 volume  0.99258E-02 ppm1      3.686 ppm2      1.194 CV     1
  ASSI {  529}
    (( segid "    " and resid 95   and name HB2 ))
    (  segid "    " and resid 102  and name HB% )
       3.600     1.600     1.600 peak   529 spectrum    2 weight  0.10000E+01 volume  0.19256E-02 ppm1      3.641 ppm2      1.476 CV     1
  ASSI {  531}
    (( segid "    " and resid 85   and name HA  ))
    (  segid "    " and resid 88   and name HG2%)
       3.000     1.100     1.100 peak   531 spectrum    2 weight  0.10000E+01 volume  0.17408E-02 ppm1      3.640 ppm2      1.192 CV     1
  ASSI {  532}
    (( segid "    " and resid 85   and name HA  ))
    (  segid "    " and resid 85   and name HG2%)
       2.600     0.800     0.800 peak   532 spectrum    2 weight  0.10000E+01 volume  0.37440E-02 ppm1      3.639 ppm2      0.532 CV     1
  ASSI {  533}
    (( segid "    " and resid 85   and name HA  ))
    (  segid "    " and resid 85   and name HG1%)
       2.500     0.800     0.800 peak   533 spectrum    2 weight  0.10000E+01 volume  0.31224E-02 ppm1      3.640 ppm2      0.430 CV     1
  ASSI {  534}
    (( segid "    " and resid 95   and name HB2 ))
    (( segid "    " and resid 95   and name HB1 ))
       2.300     0.600     0.600 peak   534 spectrum    2 weight  0.10000E+01 volume  0.24037E-02 ppm1      3.626 ppm2      2.970 CV     1
  ASSI {  537}
    (( segid "    " and resid 72   and name HD1 ))
    (( segid "    " and resid 72   and name HG2 ))
       3.000     1.100     1.100 peak   537 spectrum    2 weight  0.10000E+01 volume  0.30348E-02 ppm1      3.580 ppm2      2.052 CV     1
  ASSI {  538}
    (( segid "    " and resid 72   and name HD1 ))
    (  segid "    " and resid 71   and name HB% )
       3.000     1.200     1.200 peak   538 spectrum    2 weight  0.10000E+01 volume  0.26478E-02 ppm1      3.576 ppm2      1.558 CV     1
  ASSI {  543}
    (( segid "    " and resid 99   and name HD1 ))
    (( segid "    " and resid 99   and name HG1 ))
       2.400     0.700     0.700 peak   543 spectrum    2 weight  0.10000E+01 volume  0.50298E-02 ppm1      3.495 ppm2      2.047 CV     1
  OR {  543}
    (( segid "    " and resid 99   and name HD2 ))
    (( segid "    " and resid 99   and name HG2 ))
  OR {  543}
    (( segid "    " and resid 99   and name HD1 ))
    (( segid "    " and resid 99   and name HG2 ))
  OR {  543}
    (( segid "    " and resid 99   and name HD2 ))
    (( segid "    " and resid 99   and name HG1 ))
  ASSI {  545}
    (( segid "    " and resid 80   and name HA  ))
    (( segid "    " and resid 80   and name HG2 ))
       3.500     1.500     1.500 peak   545 spectrum    2 weight  0.10000E+01 volume  0.11600E-02 ppm1      3.488 ppm2      2.422 CV     1
  OR {  545}
    (( segid "    " and resid 80   and name HA  ))
    (( segid "    " and resid 80   and name HG1 ))
  ASSI {  546}
    (( segid "    " and resid 99   and name HD2 ))
    (( segid "    " and resid 99   and name HB2 ))
       3.600     1.600     1.600 peak   546 spectrum    2 weight  0.10000E+01 volume  0.51677E-03 ppm1      3.488 ppm2      2.298 CV     1
  OR {  546}
    (( segid "    " and resid 99   and name HD1 ))
    (( segid "    " and resid 99   and name HB2 ))
  ASSI {  547}
    (( segid "    " and resid 80   and name HA  ))
    (( segid "    " and resid 80   and name HB1 ))
       2.400     0.700     0.700 peak   547 spectrum    2 weight  0.10000E+01 volume  0.39816E-02 ppm1      3.485 ppm2      1.761 CV     1
  ASSI {  550}
    (( segid "    " and resid 80   and name HA  ))
    (  segid "    " and resid 25   and name HG1%)
       4.100     2.100     1.900 peak   550 spectrum    2 weight  0.10000E+01 volume  0.41014E-03 ppm1      3.490 ppm2      0.923 CV     1
  ASSI {  553}
    (( segid "    " and resid 80   and name HA  ))
    (( segid "    " and resid 79   and name HB1 ))
       4.500     2.600     1.500 peak   553 spectrum    2 weight  0.10000E+01 volume  0.20858E-03 ppm1      3.487 ppm2      0.357 CV     1
  ASSI {  554}
    (( segid "    " and resid 56   and name HA  ))
    (( segid "    " and resid 51   and name HB1 ))
       3.100     1.200     1.200 peak   554 spectrum    2 weight  0.10000E+01 volume  0.10285E-02 ppm1      3.481 ppm2      2.166 CV     1
  ASSI {  555}
    (( segid "    " and resid 98   and name HB1 ))
    (( segid "    " and resid 98   and name HB2 ))
       1.900     0.500     0.500 peak   555 spectrum    2 weight  0.10000E+01 volume  0.58108E-02 ppm1      3.419 ppm2      3.250 CV     1
  ASSI {  556}
    (( segid "    " and resid 34   and name HA  ))
    (( segid "    " and resid 34   and name HG11))
       2.800     1.000     1.000 peak   556 spectrum    2 weight  0.10000E+01 volume  0.25493E-02 ppm1      3.415 ppm2      1.516 CV     1
  ASSI {  557}
    (( segid "    " and resid 34   and name HA  ))
    (( segid "    " and resid 37   and name HB2 ))
       3.200     1.200     1.200 peak   557 spectrum    2 weight  0.10000E+01 volume  0.21795E-02 ppm1      3.412 ppm2      3.220 CV     1
  ASSI {  560}
    (( segid "    " and resid 34   and name HA  ))
    (( segid "    " and resid 34   and name HB  ))
       5.200     3.300     0.800 peak   560 spectrum    2 weight  0.10000E+01 volume  0.53220E-04 ppm1      3.408 ppm2      1.891 CV     1
  ASSI {  561}
    (( segid "    " and resid 34   and name HA  ))
    (  segid "    " and resid 33   and name HB% )
       3.300     3.300     2.700 peak   561 spectrum    2 weight  0.10000E+01 volume  0.14237E-02 ppm1      3.413 ppm2      1.558 CV     1
  ASSI {  562}
    (( segid "    " and resid 34   and name HA  ))
    (  segid "    " and resid 105  and name HB% )
       3.700     1.700     1.700 peak   562 spectrum    2 weight  0.10000E+01 volume  0.36859E-03 ppm1      3.413 ppm2      1.216 CV     1
  ASSI {  564}
    (( segid "    " and resid 31   and name HB1 ))
    (  segid "    " and resid 55   and name HG2%)
       3.100     3.100     2.900 peak   564 spectrum    2 weight  0.10000E+01 volume  0.78088E-03 ppm1      3.411 ppm2      0.679 CV     1
  ASSI {  565}
    (( segid "    " and resid 31   and name HB1 ))
    (( segid "    " and resid 83   and name HG11))
       2.400     0.700     0.700 peak   565 spectrum    2 weight  0.10000E+01 volume  0.47524E-02 ppm1      3.409 ppm2      0.566 CV     1
  ASSI {  567}
    (( segid "    " and resid 34   and name HA  ))
    (  segid "    " and resid 34   and name HG2%)
       3.300     1.400     1.400 peak   567 spectrum    2 weight  0.10000E+01 volume  0.73723E-03 ppm1      3.411 ppm2      0.494 CV     1
  ASSI {  569}
    (( segid "    " and resid 34   and name HA  ))
    (  segid "    " and resid 34   and name HD1%)
       3.500     1.500     1.500 peak   569 spectrum    2 weight  0.10000E+01 volume  0.17451E-02 ppm1      3.412 ppm2      0.228 CV     1
  ASSI {  572}
    (( segid "    " and resid 34   and name HA  ))
    (( segid "    " and resid 101  and name HB1 ))
       2.200     0.600     0.600 peak   572 spectrum    2 weight  0.10000E+01 volume  0.41346E-02 ppm1      3.403 ppm2      3.004 CV     1
  ASSI {  576}
    (( segid "    " and resid 31   and name HB1 ))
    (( segid "    " and resid 79   and name HB1 ))
       5.100     3.300     0.900 peak   576 spectrum    2 weight  0.10000E+01 volume  0.10435E-03 ppm1      3.406 ppm2      0.363 CV     1
  ASSI {  580}
    (( segid "    " and resid 70   and name HB1 ))
    (( segid "    " and resid 70   and name HB2 ))
       2.100     0.600     0.600 peak   580 spectrum    2 weight  0.10000E+01 volume  0.28260E-02 ppm1      3.291 ppm2      2.950 CV     1
  ASSI {  581}
    (( segid "    " and resid 52   and name HB1 ))
    (  segid "    " and resid 74   and name HB% )
       4.100     2.100     1.900 peak   581 spectrum    2 weight  0.10000E+01 volume  0.57576E-03 ppm1      3.293 ppm2      0.848 CV     1
  ASSI {  582}
    (( segid "    " and resid 52   and name HB1 ))
    (( segid "    " and resid 73   and name HB1 ))
       3.800     1.800     1.800 peak   582 spectrum    2 weight  0.10000E+01 volume  0.13316E-02 ppm1      3.282 ppm2      1.276 CV     1
  ASSI {  596}
    (( segid "    " and resid 79   and name HA  ))
    (( segid "    " and resid 43   and name HB1 ))
       3.600     1.600     1.600 peak   596 spectrum    2 weight  0.10000E+01 volume  0.87445E-03 ppm1      3.269 ppm2      3.103 CV     1
  ASSI {  604}
    (( segid "    " and resid 79   and name HA  ))
    (( segid "    " and resid 79   and name HB2 ))
       3.000     1.100     1.100 peak   604 spectrum    2 weight  0.10000E+01 volume  0.22527E-02 ppm1      3.270 ppm2      0.941 CV     1
  ASSI {  607}
    (( segid "    " and resid 79   and name HA  ))
    (( segid "    " and resid 32   and name HB2 ))
       4.000     2.000     2.000 peak   607 spectrum    2 weight  0.10000E+01 volume  0.61119E-03 ppm1      3.263 ppm2      2.838 CV     1
  ASSI {  610}
    (( segid "    " and resid 79   and name HA  ))
    (( segid "    " and resid 82   and name HG1 ))
       3.200     3.200     2.800 peak   610 spectrum    2 weight  0.10000E+01 volume  0.13822E-02 ppm1      3.266 ppm2      2.539 CV     1
  ASSI {  614}
    (( segid "    " and resid 42   and name HB2 ))
    (( segid "    " and resid 45   and name HG11))
       3.300     1.400     1.400 peak   614 spectrum    2 weight  0.10000E+01 volume  0.27120E-02 ppm1      3.266 ppm2      1.351 CV     1
  OR {  614}
    (( segid "    " and resid 42   and name HB2 ))
    (( segid "    " and resid 45   and name HG12))
  ASSI {  616}
    (( segid "    " and resid 79   and name HA  ))
    (( segid "    " and resid 79   and name HG1 ))
       3.000     1.100     1.100 peak   616 spectrum    2 weight  0.10000E+01 volume  0.28818E-02 ppm1      3.264 ppm2      0.593 CV     1
  ASSI {  617}
    (( segid "    " and resid 79   and name HA  ))
    (( segid "    " and resid 79   and name HB1 ))
       2.900     1.000     1.000 peak   617 spectrum    2 weight  0.10000E+01 volume  0.10822E-02 ppm1      3.265 ppm2      0.349 CV     1
  ASSI {  619}
    (( segid "    " and resid 92   and name HD1 ))
    (  segid "    " and resid 88   and name HG1%)
       2.400     2.400     3.600 peak   619 spectrum    2 weight  0.10000E+01 volume  0.33504E-02 ppm1      3.256 ppm2      1.038 CV     1
  ASSI {  620}
    (( segid "    " and resid 92   and name HD1 ))
    (  segid "    " and resid 88   and name HG1%)
       2.600     0.800     0.800 peak   620 spectrum    2 weight  0.10000E+01 volume  0.27956E-02 ppm1      3.258 ppm2      1.028 CV     1
  OR {  620}
    (( segid "    " and resid 92   and name HD2 ))
    (  segid "    " and resid 88   and name HG1%)
  ASSI {  621}
    (( segid "    " and resid 98   and name HB2 ))
    (  segid "    " and resid 34   and name HD1%)
       6.000     6.000     0.000 peak   621 spectrum    2 weight  0.10000E+01 volume  0.11786E-04 ppm1      3.256 ppm2      0.206 CV     1
  ASSI {  622}
    (( segid "    " and resid 92   and name HD1 ))
    (( segid "    " and resid 91   and name HG  ))
       2.500     2.500     3.500 peak   622 spectrum    2 weight  0.10000E+01 volume  0.56874E-02 ppm1      3.249 ppm2      1.666 CV     1
  ASSI {  623}
    (( segid "    " and resid 92   and name HD2 ))
    (( segid "    " and resid 92   and name HB2 ))
       2.400     0.700     0.700 peak   623 spectrum    2 weight  0.10000E+01 volume  0.72423E-02 ppm1      3.248 ppm2      2.003 CV     1
  OR {  623}
    (( segid "    " and resid 92   and name HD2 ))
    (( segid "    " and resid 92   and name HB1 ))
  OR {  623}
    (( segid "    " and resid 92   and name HD1 ))
    (( segid "    " and resid 92   and name HB2 ))
  OR {  623}
    (( segid "    " and resid 92   and name HD1 ))
    (( segid "    " and resid 92   and name HB1 ))
  ASSI {  625}
    (( segid "    " and resid 92   and name HD2 ))
    (( segid "    " and resid 92   and name HG2 ))
       2.500     0.800     0.800 peak   625 spectrum    2 weight  0.10000E+01 volume  0.16993E-02 ppm1      3.245 ppm2      1.945 CV     1
  ASSI {  626}
    (( segid "    " and resid 92   and name HD1 ))
    (( segid "    " and resid 92   and name HG1 ))
       2.600     0.800     0.800 peak   626 spectrum    2 weight  0.10000E+01 volume  0.20913E-02 ppm1      3.244 ppm2      1.923 CV     1
  OR {  626}
    (( segid "    " and resid 92   and name HD2 ))
    (( segid "    " and resid 92   and name HG2 ))
  OR {  626}
    (( segid "    " and resid 92   and name HD1 ))
    (( segid "    " and resid 92   and name HG2 ))
  OR {  626}
    (( segid "    " and resid 92   and name HD2 ))
    (( segid "    " and resid 92   and name HG1 ))
  ASSI {  627}
    (( segid "    " and resid 92   and name HD1 ))
    (( segid "    " and resid 92   and name HG1 ))
       2.200     0.600     0.600 peak   627 spectrum    2 weight  0.10000E+01 volume  0.39341E-02 ppm1      3.242 ppm2      1.895 CV     1
  ASSI {  628}
    (( segid "    " and resid 42   and name HB2 ))
    (( segid "    " and resid 42   and name HB1 ))
       1.800     0.400     0.400 peak   628 spectrum    2 weight  0.10000E+01 volume  0.85191E-02 ppm1      3.236 ppm2      2.749 CV     1
  ASSI {  629}
    (( segid "    " and resid 42   and name HB2 ))
    (  segid "    " and resid 45   and name HG2%)
       4.600     2.700     1.400 peak   629 spectrum    2 weight  0.10000E+01 volume  0.72933E-03 ppm1      3.225 ppm2      0.788 CV     1
  ASSI {  631}
    (( segid "    " and resid 37   and name HB2 ))
    (( segid "    " and resid 101  and name HB1 ))
       3.800     1.800     1.800 peak   631 spectrum    2 weight  0.10000E+01 volume  0.86496E-03 ppm1      3.208 ppm2      3.024 CV     1
  ASSI {  633}
    (( segid "    " and resid 37   and name HB2 ))
    (  segid "    " and resid 34   and name HG2%)
       4.700     2.800     1.300 peak   633 spectrum    2 weight  0.10000E+01 volume  0.54112E-03 ppm1      3.206 ppm2      0.497 CV     1
  ASSI {  637}
    (( segid "    " and resid 13   and name HD2 ))
    (( segid "    " and resid 13   and name HB2 ))
       2.900     1.000     1.000 peak   637 spectrum    2 weight  0.10000E+01 volume  0.31909E-02 ppm1      3.174 ppm2      1.821 CV     1
  ASSI {  639}
    (( segid "    " and resid 13   and name HD1 ))
    (( segid "    " and resid 13   and name HG1 ))
       2.700     0.900     0.900 peak   639 spectrum    2 weight  0.10000E+01 volume  0.26498E-02 ppm1      3.173 ppm2      1.597 CV     1
  OR {  639}
    (( segid "    " and resid 13   and name HD2 ))
    (( segid "    " and resid 13   and name HG2 ))
  OR {  639}
    (( segid "    " and resid 13   and name HD1 ))
    (( segid "    " and resid 13   and name HG2 ))
  OR {  639}
    (( segid "    " and resid 13   and name HD2 ))
    (( segid "    " and resid 13   and name HG1 ))
  ASSI {  640}
    (( segid "    " and resid 13   and name HD1 ))
    (( segid "    " and resid 13   and name HG2 ))
       2.200     0.600     0.600 peak   640 spectrum    2 weight  0.10000E+01 volume  0.10849E-01 ppm1      3.172 ppm2      1.616 CV     1
  ASSI {  641}
    (( segid "    " and resid 58   and name HB2 ))
    (( segid "    " and resid 58   and name HB1 ))
       2.200     0.600     0.600 peak   641 spectrum    2 weight  0.10000E+01 volume  0.33679E-02 ppm1      3.161 ppm2      2.850 CV     1
  ASSI {  647}
    (( segid "    " and resid 31   and name HB2 ))
    (( segid "    " and resid 83   and name HG11))
       3.100     1.200     1.200 peak   647 spectrum    2 weight  0.10000E+01 volume  0.18369E-02 ppm1      3.150 ppm2      0.590 CV     1
  ASSI {  650}
    (( segid "    " and resid 104  and name HD2 ))
    (( segid "    " and resid 104  and name HB1 ))
       3.000     1.100     1.100 peak   650 spectrum    2 weight  0.10000E+01 volume  0.24816E-02 ppm1      3.147 ppm2      1.873 CV     1
  ASSI {  657}
    (( segid "    " and resid 108  and name HD2 ))
    (( segid "    " and resid 108  and name HG2 ))
       3.100     1.200     1.200 peak   657 spectrum    2 weight  0.10000E+01 volume  0.11183E-02 ppm1      3.135 ppm2      1.476 CV     1
  OR {  657}
    (( segid "    " and resid 108  and name HD2 ))
    (( segid "    " and resid 108  and name HG1 ))
  OR {  657}
    (( segid "    " and resid 108  and name HD1 ))
    (( segid "    " and resid 108  and name HG2 ))
  OR {  657}
    (( segid "    " and resid 108  and name HD1 ))
    (( segid "    " and resid 108  and name HG1 ))
  ASSI {  658}
    (( segid "    " and resid 43   and name HB1 ))
    (( segid "    " and resid 54   and name HA1 ))
       3.300     1.400     1.400 peak   658 spectrum    2 weight  0.10000E+01 volume  0.13020E-02 ppm1      3.134 ppm2      2.657 CV     1
  ASSI {  659}
    (( segid "    " and resid 108  and name HD2 ))
    (( segid "    " and resid 108  and name HG1 ))
       3.000     1.100     1.100 peak   659 spectrum    2 weight  0.10000E+01 volume  0.11149E-02 ppm1      3.132 ppm2      1.443 CV     1
  ASSI {  660}
    (( segid "    " and resid 43   and name HB1 ))
    (( segid "    " and resid 75   and name HB1 ))
       4.600     2.600     1.400 peak   660 spectrum    2 weight  0.10000E+01 volume  0.25643E-03 ppm1      3.125 ppm2      2.613 CV     1
  ASSI {  662}
    (( segid "    " and resid 46   and name HB2 ))
    (( segid "    " and resid 46   and name HB1 ))
       2.500     0.800     0.800 peak   662 spectrum    2 weight  0.10000E+01 volume  0.21514E-02 ppm1      3.108 ppm2      2.952 CV     1
  ASSI {  666}
    (( segid "    " and resid 108  and name HD1 ))
    (( segid "    " and resid 108  and name HG1 ))
       3.100     1.200     1.200 peak   666 spectrum    2 weight  0.10000E+01 volume  0.98063E-03 ppm1      3.106 ppm2      1.432 CV     1
  ASSI {  667}
    (( segid "    " and resid 62   and name HB1 ))
    (( segid "    " and resid 59   and name HG1 ))
       4.100     2.100     1.900 peak   667 spectrum    2 weight  0.10000E+01 volume  0.36513E-03 ppm1      3.099 ppm2      2.484 CV     1
  ASSI {  668}
    (( segid "    " and resid 62   and name HB1 ))
    (( segid "    " and resid 59   and name HG1 ))
       5.000     3.200     1.000 peak   668 spectrum    2 weight  0.10000E+01 volume  0.14177E-03 ppm1      3.099 ppm2      2.472 CV     1
  OR {  668}
    (( segid "    " and resid 62   and name HB1 ))
    (( segid "    " and resid 59   and name HG2 ))
  ASSI {  670}
    (( segid "    " and resid 62   and name HB1 ))
    (( segid "    " and resid 59   and name HB1 ))
       5.200     3.300     0.800 peak   670 spectrum    2 weight  0.10000E+01 volume  0.22707E-03 ppm1      3.100 ppm2      1.988 CV     1
  ASSI {  674}
    (( segid "    " and resid 62   and name HB1 ))
    (( segid "    " and resid 63   and name HB1 ))
       2.600     2.600     3.400 peak   674 spectrum    2 weight  0.10000E+01 volume  0.10366E-01 ppm1      3.094 ppm2      2.096 CV     1
  OR {  674}
    (( segid "    " and resid 62   and name HB1 ))
    (( segid "    " and resid 63   and name HG1 ))
  ASSI {  676}
    (( segid "    " and resid 104  and name HD1 ))
    (( segid "    " and resid 104  and name HB1 ))
       3.600     1.600     1.600 peak   676 spectrum    2 weight  0.10000E+01 volume  0.71896E-03 ppm1      3.094 ppm2      1.872 CV     1
  ASSI {  678}
    (( segid "    " and resid 104  and name HD1 ))
    (( segid "    " and resid 104  and name HB1 ))
       3.800     1.800     1.800 peak   678 spectrum    2 weight  0.10000E+01 volume  0.51759E-03 ppm1      3.094 ppm2      1.844 CV     1
  OR {  678}
    (( segid "    " and resid 104  and name HD1 ))
    (( segid "    " and resid 104  and name HB2 ))
  ASSI {  681}
    (( segid "    " and resid 104  and name HD1 ))
    (( segid "    " and resid 104  and name HG2 ))
       3.200     1.300     1.300 peak   681 spectrum    2 weight  0.10000E+01 volume  0.91432E-03 ppm1      3.096 ppm2      1.778 CV     1
  ASSI {  686}
    (( segid "    " and resid 62   and name HB1 ))
    (  segid "    " and resid 68   and name HD1%)
       4.000     2.000     2.000 peak   686 spectrum    2 weight  0.10000E+01 volume  0.69713E-03 ppm1      3.095 ppm2      1.023 CV     1
  ASSI {  692}
    (( segid "    " and resid 95   and name HB1 ))
    (  segid "    " and resid 102  and name HB% )
       3.200     1.300     1.300 peak   692 spectrum    2 weight  0.10000E+01 volume  0.47112E-03 ppm1      3.000 ppm2      1.493 CV     1
  ASSI {  696}
    (( segid "    " and resid 73   and name HD1 ))
    (( segid "    " and resid 73   and name HB1 ))
       2.700     0.900     0.900 peak   696 spectrum    2 weight  0.10000E+01 volume  0.34706E-02 ppm1      2.945 ppm2      1.277 CV     1
  ASSI {  697}
    (( segid "    " and resid 65   and name HB2 ))
    (  segid "    " and resid 88   and name HG2%)
       4.900     3.000     1.100 peak   697 spectrum    2 weight  0.10000E+01 volume  0.40632E-03 ppm1      2.945 ppm2      1.194 CV     1
  ASSI {  698}
    (( segid "    " and resid 73   and name HD1 ))
    (( segid "    " and resid 73   and name HG2 ))
       4.300     2.400     1.700 peak   698 spectrum    2 weight  0.10000E+01 volume  0.76843E-04 ppm1      2.948 ppm2      0.829 CV     1
  ASSI {  701}
    (( segid "    " and resid 73   and name HD1 ))
    (( segid "    " and resid 73   and name HG1 ))
       2.600     0.800     0.800 peak   701 spectrum    2 weight  0.10000E+01 volume  0.30001E-02 ppm1      2.942 ppm2      1.126 CV     1
  ASSI {  706}
    (( segid "    " and resid 83   and name HA  ))
    (  segid "    " and resid 86   and name HB% )
       2.600     0.800     0.800 peak   706 spectrum    2 weight  0.10000E+01 volume  0.29470E-02 ppm1      2.933 ppm2      0.727 CV     1
  ASSI {  710}
    (( segid "    " and resid 83   and name HA  ))
    (( segid "    " and resid 83   and name HG12))
       3.200     1.300     1.300 peak   710 spectrum    2 weight  0.10000E+01 volume  0.70613E-03 ppm1      2.927 ppm2      1.430 CV     1
  ASSI {  711}
    (( segid "    " and resid 83   and name HA  ))
    (  segid "    " and resid 83   and name HG2%)
       2.500     2.500     3.500 peak   711 spectrum    2 weight  0.10000E+01 volume  0.42488E-02 ppm1      2.931 ppm2      0.437 CV     1
  ASSI {  717}
    (( segid "    " and resid 83   and name HA  ))
    (( segid "    " and resid 83   and name HB  ))
       3.500     1.500     1.500 peak   717 spectrum    2 weight  0.10000E+01 volume  0.57450E-03 ppm1      2.917 ppm2      1.598 CV     1
  ASSI {  721}
    (( segid "    " and resid 83   and name HA  ))
    (  segid "    " and resid 25   and name HG1%)
       5.700     4.100     0.300 peak   721 spectrum    2 weight  0.10000E+01 volume  0.12577E-03 ppm1      2.914 ppm2      0.941 CV     1
  OR {  721}
    (( segid "    " and resid 83   and name HA  ))
    (  segid "    " and resid 25   and name HG2%)
  ASSI {  731}
    (( segid "    " and resid 65   and name HB2 ))
    (( segid "    " and resid 65   and name HB1 ))
       1.900     0.500     0.500 peak   731 spectrum    2 weight  0.10000E+01 volume  0.45154E-02 ppm1      2.910 ppm2      2.285 CV     1
  ASSI {  736}
    (( segid "    " and resid 73   and name HD1 ))
    (( segid "    " and resid 76   and name HB1 ))
       4.100     2.100     1.900 peak   736 spectrum    2 weight  0.10000E+01 volume  0.60368E-03 ppm1      2.912 ppm2      1.746 CV     1
  ASSI {  740}
    (( segid "    " and resid 73   and name HD2 ))
    (( segid "    " and resid 75   and name HB1 ))
       6.000     6.000     0.000 peak   740 spectrum    2 weight  0.10000E+01 volume  0.58393E-05 ppm1      2.891 ppm2      2.630 CV     1
  ASSI {  741}
    (( segid "    " and resid 73   and name HD2 ))
    (( segid "    " and resid 72   and name HG1 ))
       5.000     3.200     1.000 peak   741 spectrum    2 weight  0.10000E+01 volume  0.19684E-03 ppm1      2.892 ppm2      1.986 CV     1
  ASSI {  743}
    (( segid "    " and resid 73   and name HD2 ))
    (( segid "    " and resid 73   and name HB1 ))
       4.800     2.900     1.200 peak   743 spectrum    2 weight  0.10000E+01 volume  0.49571E-04 ppm1      2.882 ppm2      1.241 CV     1
  ASSI {  744}
    (( segid "    " and resid 73   and name HD2 ))
    (( segid "    " and resid 73   and name HG1 ))
       3.900     1.900     1.900 peak   744 spectrum    2 weight  0.10000E+01 volume  0.23371E-03 ppm1      2.885 ppm2      1.117 CV     1
  ASSI {  749}
    (( segid "    " and resid 27   and name HB2 ))
    (( segid "    " and resid 26   and name HB  ))
       6.000     4.600     0.000 peak   749 spectrum    2 weight  0.10000E+01 volume  0.25015E-04 ppm1      2.873 ppm2      1.945 CV     1
  ASSI {  753}
    (( segid "    " and resid 27   and name HB2 ))
    (( segid "    " and resid 27   and name HB1 ))
       3.700     3.700     2.300 peak   753 spectrum    2 weight  0.10000E+01 volume  0.16057E-03 ppm1      2.858 ppm2      2.747 CV     1
  ASSI {  754}
    (( segid "    " and resid 27   and name HB2 ))
    (( segid "    " and resid 90   and name HD1 ))
       4.900     3.000     1.100 peak   754 spectrum    2 weight  0.10000E+01 volume  0.97630E-04 ppm1      2.860 ppm2      2.274 CV     1
  ASSI {  756}
    (( segid "    " and resid 69   and name HD2 ))
    (( segid "    " and resid 69   and name HG1 ))
       2.300     0.700     0.700 peak   756 spectrum    2 weight  0.10000E+01 volume  0.71024E-02 ppm1      2.819 ppm2      1.066 CV     1
  ASSI {  758}
    (( segid "    " and resid 69   and name HD2 ))
    (( segid "    " and resid 69   and name HB2 ))
       4.000     2.000     2.000 peak   758 spectrum    2 weight  0.10000E+01 volume  0.36160E-03 ppm1      2.816 ppm2      1.339 CV     1
  ASSI {  760}
    (( segid "    " and resid 32   and name HB2 ))
    (( segid "    " and resid 79   and name HD2 ))
       3.300     1.300     1.300 peak   760 spectrum    2 weight  0.10000E+01 volume  0.18133E-02 ppm1      2.797 ppm2      2.632 CV     1
  ASSI {  762}
    (( segid "    " and resid 57   and name HB1 ))
    (( segid "    " and resid 51   and name HB1 ))
       6.000     4.400     0.000 peak   762 spectrum    2 weight  0.10000E+01 volume  0.51911E-04 ppm1      2.795 ppm2      2.168 CV     1
  ASSI {  763}
    (( segid "    " and resid 82   and name HG2 ))
    (  segid "    " and resid 74   and name HB% )
       3.100     3.100     2.900 peak   763 spectrum    2 weight  0.10000E+01 volume  0.11540E-02 ppm1      2.795 ppm2      0.850 CV     1
  ASSI {  765}
    (( segid "    " and resid 69   and name HD2 ))
    (( segid "    " and resid 69   and name HG2 ))
       2.400     0.700     0.700 peak   765 spectrum    2 weight  0.10000E+01 volume  0.37635E-02 ppm1      2.790 ppm2      1.067 CV     1
  OR {  765}
    (( segid "    " and resid 69   and name HD1 ))
    (( segid "    " and resid 69   and name HG1 ))
  OR {  765}
    (( segid "    " and resid 69   and name HD1 ))
    (( segid "    " and resid 69   and name HG2 ))
  OR {  765}
    (( segid "    " and resid 69   and name HD2 ))
    (( segid "    " and resid 69   and name HG1 ))
  ASSI {  766}
    (( segid "    " and resid 82   and name HG2 ))
    (( segid "    " and resid 82   and name HB1 ))
       2.900     1.000     1.000 peak   766 spectrum    2 weight  0.10000E+01 volume  0.10953E-02 ppm1      2.781 ppm2      2.318 CV     1
  ASSI {  771}
    (( segid "    " and resid 82   and name HG2 ))
    (( segid "    " and resid 82   and name HG1 ))
       2.000     0.500     0.500 peak   771 spectrum    2 weight  0.10000E+01 volume  0.53128E-02 ppm1      2.778 ppm2      2.541 CV     1
  ASSI {  772}
    (( segid "    " and resid 42   and name HB1 ))
    (( segid "    " and resid 45   and name HB  ))
       3.000     1.100     1.100 peak   772 spectrum    2 weight  0.10000E+01 volume  0.37298E-03 ppm1      2.767 ppm2      1.843 CV     1
  ASSI {  779}
    (( segid "    " and resid 42   and name HB1 ))
    (  segid "    " and resid 45   and name HD1%)
       3.600     1.600     1.600 peak   779 spectrum    2 weight  0.10000E+01 volume  0.59787E-03 ppm1      2.752 ppm2      0.904 CV     1
  ASSI {  782}
    (( segid "    " and resid 52   and name HB2 ))
    (( segid "    " and resid 75   and name HB1 ))
       3.200     1.300     1.300 peak   782 spectrum    2 weight  0.10000E+01 volume  0.33288E-02 ppm1      2.739 ppm2      2.602 CV     1
  ASSI {  783}
    (( segid "    " and resid 52   and name HB2 ))
    (( segid "    " and resid 75   and name HB2 ))
       5.600     4.000     0.400 peak   783 spectrum    2 weight  0.10000E+01 volume  0.26691E-03 ppm1      2.739 ppm2      2.539 CV     1
  ASSI {  785}
    (( segid "    " and resid 54   and name HA1 ))
    (  segid "    " and resid 39   and name HB% )
       3.700     1.700     1.700 peak   785 spectrum    2 weight  0.10000E+01 volume  0.97547E-03 ppm1      2.685 ppm2      1.389 CV     1
  ASSI {  786}
    (( segid "    " and resid 54   and name HA1 ))
    (  segid "    " and resid 35   and name HB% )
       5.000     3.100     1.000 peak   786 spectrum    2 weight  0.10000E+01 volume  0.15777E-03 ppm1      2.678 ppm2      0.497 CV     1
  ASSI {  790}
    (( segid "    " and resid 79   and name HD2 ))
    (( segid "    " and resid 79   and name HB2 ))
       6.000     6.000     0.000 peak   790 spectrum    2 weight  0.10000E+01 volume  0.12238E-04 ppm1      2.647 ppm2      0.988 CV     1
  ASSI {  791}
    (( segid "    " and resid 79   and name HD2 ))
    (( segid "    " and resid 79   and name HG1 ))
       3.100     1.200     1.200 peak   791 spectrum    2 weight  0.10000E+01 volume  0.72560E-03 ppm1      2.649 ppm2      0.595 CV     1
  ASSI {  792}
    (( segid "    " and resid 79   and name HD2 ))
    (( segid "    " and resid 79   and name HB1 ))
       4.000     2.000     2.000 peak   792 spectrum    2 weight  0.10000E+01 volume  0.75105E-03 ppm1      2.648 ppm2      0.341 CV     1
  ASSI {  793}
    (( segid "    " and resid 79   and name HD2 ))
    (( segid "    " and resid 79   and name HD1 ))
       2.400     0.700     0.700 peak   793 spectrum    2 weight  0.10000E+01 volume  0.16741E-02 ppm1      2.646 ppm2      2.317 CV     1
  ASSI {  796}
    (( segid "    " and resid 75   and name HB1 ))
    (( segid "    " and resid 75   and name HB2 ))
       1.500     0.300     0.700 peak   796 spectrum    2 weight  0.10000E+01 volume  0.32550E-01 ppm1      2.623 ppm2      2.527 CV     1
  ASSI {  798}
    (  segid "    " and resid 51   and name HD% )
    (  segid "    " and resid 51   and name HE% )
       1.800     1.800     4.200 peak   798 spectrum    2 weight  0.10000E+01 volume  0.24237E-01 ppm1      6.928 ppm2      6.859 CV     1
  ASSI {  807}
    (( segid "    " and resid 39   and name HA  ))
    (  segid "    " and resid 39   and name HB% )
       2.200     0.600     0.600 peak   807 spectrum    2 weight  0.10000E+01 volume  0.83079E-02 ppm1      4.591 ppm2      1.386 CV     1
  ASSI {  808}
    (( segid "    " and resid 61   and name HB  ))
    (( segid "    " and resid 61   and name HA  ))
       2.300     0.600     0.600 peak   808 spectrum    2 weight  0.10000E+01 volume  0.80995E-02 ppm1      4.454 ppm2      3.994 CV     1
  ASSI {  809}
    (( segid "    " and resid 37   and name HA  ))
    (( segid "    " and resid 37   and name HB1 ))
       2.900     1.100     1.100 peak   809 spectrum    2 weight  0.10000E+01 volume  0.32348E-02 ppm1      4.350 ppm2      3.170 CV     1
  ASSI {  810}
    (( segid "    " and resid 94   and name HA2 ))
    (( segid "    " and resid 94   and name HA1 ))
       2.000     0.500     0.500 peak   810 spectrum    2 weight  0.10000E+01 volume  0.82739E-02 ppm1      4.271 ppm2      3.819 CV     1
  ASSI {  820}
    (( segid "    " and resid 30   and name HA  ))
    (  segid "    " and resid 30   and name HG2%)
       2.300     0.700     0.700 peak   820 spectrum    2 weight  0.10000E+01 volume  0.55997E-02 ppm1      3.924 ppm2      0.155 CV     1

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ASN   1          1HT       ASN   1   6.420  35.793   6.919
    2   2H    ASN   1          2HT       ASN   1   4.835  36.249   6.541
    3   3H    ASN   1          3HT       ASN   1   5.590  35.012   5.662
    4    HA   ASN   1           HA       ASN   1   4.839  34.927   8.521
    5   1HB   ASN   1          2HB       ASN   1   3.739  33.549   6.065
    6   2HB   ASN   1          1HB       ASN   1   3.386  33.015   7.705
    7   1HD2  ASN   1          1HD2      ASN   1   1.554  33.977   5.679
    8   2HD2  ASN   1          2HD2      ASN   1   0.770  35.371   6.360
    9    H    VAL   2           H        VAL   2   6.096  33.696   9.699
   10    HA   VAL   2           HA       VAL   2   8.184  32.106   8.621
   11    HB   VAL   2           HB       VAL   2   8.271  33.209  10.845
   12   1HG1  VAL   2          1HG1      VAL   2   6.326  31.059  11.658
   13   2HG1  VAL   2          2HG1      VAL   2   6.039  32.799  11.640
   14   3HG1  VAL   2          3HG1      VAL   2   7.200  32.110  12.773
   15   1HG2  VAL   2          1HG2      VAL   2   9.394  31.383  12.033
   16   2HG2  VAL   2          2HG2      VAL   2   9.847  31.442  10.331
   17   3HG2  VAL   2          3HG2      VAL   2   8.702  30.227  10.896
   18    H    VAL   3           H        VAL   3   4.885  31.502   9.205
   19    HA   VAL   3           HA       VAL   3   4.829  28.760   9.627
   20    HB   VAL   3           HB       VAL   3   2.833  30.435   8.098
   21   1HG1  VAL   3          1HG1      VAL   3   2.507  27.761   9.457
   22   2HG1  VAL   3          2HG1      VAL   3   2.515  28.052   7.718
   23   3HG1  VAL   3          3HG1      VAL   3   1.214  28.702   8.714
   24   1HG2  VAL   3          1HG2      VAL   3   2.919  29.738  11.033
   25   2HG2  VAL   3          2HG2      VAL   3   1.639  30.636  10.217
   26   3HG2  VAL   3          3HG2      VAL   3   3.260  31.320  10.336
   27    H    VAL   4           H        VAL   4   5.899  27.341   8.384
   28    HA   VAL   4           HA       VAL   4   6.484  27.872   5.649
   29    HB   VAL   4           HB       VAL   4   8.098  26.676   6.906
   30   1HG1  VAL   4          1HG1      VAL   4   6.685  25.613   8.557
   31   2HG1  VAL   4          2HG1      VAL   4   7.718  24.410   7.781
   32   3HG1  VAL   4          3HG1      VAL   4   6.018  24.541   7.324
   33   1HG2  VAL   4          1HG2      VAL   4   6.845  24.869   4.859
   34   2HG2  VAL   4          2HG2      VAL   4   8.479  24.693   5.498
   35   3HG2  VAL   4          3HG2      VAL   4   8.045  26.126   4.565
   36    H    THR   5           H        THR   5   5.755  26.944   3.866
   37    HA   THR   5           HA       THR   5   3.137  25.629   4.075
   38    HB   THR   5           HB       THR   5   2.974  26.539   1.618
   39    HG1  THR   5           1HG      THR   5   4.769  27.600   1.170
   40   1HG2  THR   5          1HG2      THR   5   2.736  28.339   4.035
   41   2HG2  THR   5          2HG2      THR   5   1.499  27.234   3.434
   42   3HG2  THR   5          3HG2      THR   5   1.983  28.626   2.467
   43    HA   PRO   6           HA       PRO   6   5.329  22.343   1.907
   44   1HB   PRO   6          2HB       PRO   6   3.425  20.463   2.758
   45   2HB   PRO   6          1HB       PRO   6   4.961  20.820   3.543
   46   1HG   PRO   6          2HG       PRO   6   2.401  21.308   4.581
   47   2HG   PRO   6          1HG       PRO   6   3.933  21.922   5.224
   48   1HD   PRO   6          2HD       PRO   6   1.928  23.264   3.479
   49   2HD   PRO   6          1HD       PRO   6   2.974  23.957   4.739
   50    H    ALA   7           H        ALA   7   4.671  20.720   0.389
   51    HA   ALA   7           HA       ALA   7   2.810  21.769  -1.556
   52   1HB   ALA   7          1HB       ALA   7   3.520  19.920  -2.949
   53   2HB   ALA   7          2HB       ALA   7   4.382  19.197  -1.590
   54   3HB   ALA   7          3HB       ALA   7   4.917  20.741  -2.255
   55    H    HIS   8           H        HIS   8   0.911  21.696  -0.470
   56    HA   HIS   8           HA       HIS   8  -0.317  19.157   0.130
   57   1HB   HIS   8          2HB       HIS   8  -1.535  21.924  -0.076
   58   2HB   HIS   8          1HB       HIS   8  -2.364  20.491   0.517
   59    HD1  HIS   8           1HD      HIS   8  -1.497  23.317   2.034
   60    HD2  HIS   8           2HD      HIS   8  -0.037  19.458   2.591
   61    HE1  HIS   8           1HE      HIS   8  -0.546  23.242   4.377
   62    H    GLU   9           H        GLU   9   0.421  20.980  -2.567
   63    HA   GLU   9           HA       GLU   9  -1.948  20.352  -4.091
   64   1HB   GLU   9          2HB       GLU   9  -0.790  21.345  -5.992
   65   2HB   GLU   9          1HB       GLU   9  -0.697  22.394  -4.588
   66   1HG   GLU   9          2HG       GLU   9   1.590  21.708  -4.189
   67   2HG   GLU   9          1HG       GLU   9   1.497  20.568  -5.531
   68    H    ALA  10           H        ALA  10  -2.237  18.795  -5.562
   69    HA   ALA  10           HA       ALA  10  -0.069  17.020  -6.298
   70   1HB   ALA  10          1HB       ALA  10  -2.551  16.024  -4.895
   71   2HB   ALA  10          2HB       ALA  10  -0.910  16.005  -4.247
   72   3HB   ALA  10          3HB       ALA  10  -1.321  15.005  -5.641
   73    H    VAL  11           H        VAL  11  -0.527  18.170  -8.234
   74    HA   VAL  11           HA       VAL  11  -3.019  18.040  -9.544
   75    HB   VAL  11           HB       VAL  11  -0.306  18.476 -10.735
   76   1HG1  VAL  11          1HG1      VAL  11  -1.491  19.534 -12.597
   77   2HG1  VAL  11          2HG1      VAL  11  -3.031  19.105 -11.853
   78   3HG1  VAL  11          3HG1      VAL  11  -1.945  17.839 -12.424
   79   1HG2  VAL  11          1HG2      VAL  11  -0.782  20.125  -9.033
   80   2HG2  VAL  11          2HG2      VAL  11  -2.356  20.450  -9.757
   81   3HG2  VAL  11          3HG2      VAL  11  -0.883  20.869 -10.630
   82    H    VAL  12           H        VAL  12  -0.002  16.547 -10.647
   83    HA   VAL  12           HA       VAL  12   0.225  14.869 -12.176
   84    HB   VAL  12           HB       VAL  12   1.048  14.036 -10.144
   85   1HG1  VAL  12          1HG1      VAL  12  -0.862  14.411  -8.699
   86   2HG1  VAL  12          2HG1      VAL  12  -0.282  12.751  -8.538
   87   3HG1  VAL  12          3HG1      VAL  12  -1.734  13.093  -9.482
   88   1HG2  VAL  12          1HG2      VAL  12   0.775  11.613 -10.448
   89   2HG2  VAL  12          2HG2      VAL  12   1.025  12.468 -11.972
   90   3HG2  VAL  12          3HG2      VAL  12  -0.591  11.925 -11.521
   91    H    ARG  13           H        ARG  13  -1.353  15.303 -13.640
   92    HA   ARG  13           HA       ARG  13  -4.008  14.338 -13.312
   93   1HB   ARG  13          2HB       ARG  13  -2.591  15.803 -15.498
   94   2HB   ARG  13          1HB       ARG  13  -4.191  15.135 -15.723
   95   1HG   ARG  13          2HG       ARG  13  -4.871  16.445 -13.657
   96   2HG   ARG  13          1HG       ARG  13  -3.331  17.288 -13.833
   97   1HD   ARG  13          2HD       ARG  13  -5.477  17.114 -15.943
   98   2HD   ARG  13          1HD       ARG  13  -5.207  18.494 -14.882
   99    HE   ARG  13           HE       ARG  13  -2.793  18.082 -16.114
  100   1HH1  ARG  13          1HH1      ARG  13  -6.071  18.710 -17.169
  101   2HH1  ARG  13          2HH1      ARG  13  -5.589  19.512 -18.628
  102   1HH2  ARG  13          1HH2      ARG  13  -2.149  19.148 -18.032
  103   2HH2  ARG  13          2HH2      ARG  13  -3.360  19.740 -19.136
  104    H    VAL  14           H        VAL  14  -4.315  12.322 -13.435
  105    HA   VAL  14           HA       VAL  14  -3.193  10.695 -15.562
  106    HB   VAL  14           HB       VAL  14  -5.162   9.720 -13.546
  107   1HG1  VAL  14          1HG1      VAL  14  -3.933   7.610 -13.806
  108   2HG1  VAL  14          2HG1      VAL  14  -2.866   8.400 -14.965
  109   3HG1  VAL  14          3HG1      VAL  14  -4.581   8.215 -15.330
  110   1HG2  VAL  14          1HG2      VAL  14  -2.207  10.014 -13.026
  111   2HG2  VAL  14          2HG2      VAL  14  -3.342   9.138 -12.000
  112   3HG2  VAL  14          3HG2      VAL  14  -3.505  10.882 -12.203
  113    H    GLY  15           H        GLY  15  -4.669   9.472 -16.838
  114   1HA   GLY  15          2HA       GLY  15  -6.958  11.150 -17.568
  115   2HA   GLY  15          1HA       GLY  15  -6.062  10.093 -18.658
  116    H    THR  16           H        THR  16  -6.035   7.796 -17.928
  117    HA   THR  16           HA       THR  16  -8.467   6.936 -16.656
  118    HB   THR  16           HB       THR  16  -7.751   6.322 -19.507
  119    HG1  THR  16           1HG      THR  16  -9.610   7.881 -18.211
  120   1HG2  THR  16          1HG2      THR  16  -9.582   4.721 -19.503
  121   2HG2  THR  16          2HG2      THR  16  -9.814   4.991 -17.775
  122   3HG2  THR  16          3HG2      THR  16  -8.318   4.266 -18.360
  123    H    LYS  17           H        LYS  17  -5.570   6.011 -18.330
  124    HA   LYS  17           HA       LYS  17  -5.301   3.423 -17.262
  125   1HB   LYS  17          2HB       LYS  17  -3.013   5.160 -18.199
  126   2HB   LYS  17          1HB       LYS  17  -3.111   3.408 -18.214
  127   1HG   LYS  17          2HG       LYS  17  -4.617   5.323 -19.979
  128   2HG   LYS  17          1HG       LYS  17  -3.317   4.228 -20.450
  129   1HD   LYS  17          2HD       LYS  17  -4.810   2.334 -19.699
  130   2HD   LYS  17          1HD       LYS  17  -6.109   3.525 -19.579
  131   1HE   LYS  17          2HE       LYS  17  -5.701   4.115 -21.963
  132   2HE   LYS  17          1HE       LYS  17  -4.542   2.789 -22.045
  133   1HZ   LYS  17          1HZ       LYS  17  -6.438   1.322 -21.300
  134   2HZ   LYS  17          2HZ       LYS  17  -6.544   1.942 -22.875
  135   3HZ   LYS  17          3HZ       LYS  17  -7.469   2.632 -21.630
  136    HA   PRO  18           HA       PRO  18  -4.142   5.020 -13.234
  137   1HB   PRO  18          2HB       PRO  18  -4.334   2.718 -11.912
  138   2HB   PRO  18          1HB       PRO  18  -5.777   3.601 -12.433
  139   1HG   PRO  18          2HG       PRO  18  -4.372   1.337 -13.780
  140   2HG   PRO  18          1HG       PRO  18  -6.104   1.489 -13.425
  141   1HD   PRO  18          2HD       PRO  18  -5.102   2.064 -15.862
  142   2HD   PRO  18          1HD       PRO  18  -6.430   3.021 -15.171
  143    H    GLY  19           H        GLY  19  -2.179   5.511 -13.255
  144   1HA   GLY  19          2HA       GLY  19   0.108   5.328 -12.894
  145   2HA   GLY  19          1HA       GLY  19  -0.068   3.576 -12.898
  146    H    THR  20           H        THR  20  -0.751   6.194 -15.174
  147    HA   THR  20           HA       THR  20  -0.244   4.803 -17.518
  148    HB   THR  20           HB       THR  20   0.497   7.702 -17.317
  149    HG1  THR  20           1HG      THR  20  -1.512   8.298 -16.868
  150   1HG2  THR  20          1HG2      THR  20  -0.713   7.796 -19.459
  151   2HG2  THR  20          2HG2      THR  20  -1.071   6.075 -19.316
  152   3HG2  THR  20          3HG2      THR  20   0.598   6.617 -19.491
  153    H    GLU  21           H        GLU  21   1.960   7.001 -15.775
  154    HA   GLU  21           HA       GLU  21   4.170   5.257 -16.425
  155   1HB   GLU  21          2HB       GLU  21   4.137   8.191 -17.118
  156   2HB   GLU  21          1HB       GLU  21   5.605   7.235 -17.022
  157   1HG   GLU  21          2HG       GLU  21   4.681   5.748 -18.780
  158   2HG   GLU  21          1HG       GLU  21   3.319   6.855 -18.934
  159    H    VAL  22           H        VAL  22   4.836   4.739 -14.485
  160    HA   VAL  22           HA       VAL  22   5.213   6.873 -12.491
  161    HB   VAL  22           HB       VAL  22   5.088   3.876 -12.059
  162   1HG1  VAL  22          1HG1      VAL  22   6.538   4.942 -10.440
  163   2HG1  VAL  22          2HG1      VAL  22   5.036   4.448  -9.662
  164   3HG1  VAL  22          3HG1      VAL  22   5.299   6.143 -10.078
  165   1HG2  VAL  22          1HG2      VAL  22   3.074   6.007 -11.341
  166   2HG2  VAL  22          2HG2      VAL  22   2.945   4.284 -10.984
  167   3HG2  VAL  22          3HG2      VAL  22   2.912   4.842 -12.656
  168    HA   PRO  23           HA       PRO  23   9.511   6.516 -13.754
  169   1HB   PRO  23          2HB       PRO  23   9.835   8.133 -11.284
  170   2HB   PRO  23          1HB       PRO  23  10.451   8.434 -12.912
  171   1HG   PRO  23          2HG       PRO  23   8.386   9.813 -11.928
  172   2HG   PRO  23          1HG       PRO  23   8.455   9.348 -13.638
  173   1HD   PRO  23          2HD       PRO  23   6.843   8.211 -11.419
  174   2HD   PRO  23          1HD       PRO  23   6.439   8.392 -13.135
  175    HA   PRO  24           HA       PRO  24  10.628   3.092 -11.084
  176   1HB   PRO  24          2HB       PRO  24  13.261   3.055 -11.998
  177   2HB   PRO  24          1HB       PRO  24  11.914   2.150 -12.698
  178   1HG   PRO  24          2HG       PRO  24  13.071   4.776 -13.535
  179   2HG   PRO  24          1HG       PRO  24  12.491   3.432 -14.539
  180   1HD   PRO  24          2HD       PRO  24  10.977   5.585 -14.206
  181   2HD   PRO  24          1HD       PRO  24  10.255   3.964 -14.163
  182    H    VAL  25           H        VAL  25  11.560   2.968  -9.173
  183    HA   VAL  25           HA       VAL  25  13.165   5.267  -8.261
  184    HB   VAL  25           HB       VAL  25  11.233   3.596  -6.640
  185   1HG1  VAL  25          1HG1      VAL  25  12.992   4.244  -5.192
  186   2HG1  VAL  25          2HG1      VAL  25  11.657   5.356  -4.894
  187   3HG1  VAL  25          3HG1      VAL  25  13.037   5.875  -5.859
  188   1HG2  VAL  25          1HG2      VAL  25  10.112   5.138  -8.170
  189   2HG2  VAL  25          2HG2      VAL  25  11.065   6.476  -7.526
  190   3HG2  VAL  25          3HG2      VAL  25   9.905   5.642  -6.493
  191    H    ILE  26           H        ILE  26  15.111   4.861  -7.505
  192    HA   ILE  26           HA       ILE  26  16.215   2.265  -7.846
  193    HB   ILE  26           HB       ILE  26  17.490   4.676  -6.542
  194   1HG1  ILE  26          2HG1      ILE  26  16.709   5.256  -8.766
  195   2HG1  ILE  26          1HG1      ILE  26  18.462   5.088  -8.793
  196   1HG2  ILE  26          1HG2      ILE  26  19.611   3.641  -7.196
  197   2HG2  ILE  26          2HG2      ILE  26  18.740   2.239  -7.814
  198   3HG2  ILE  26          3HG2      ILE  26  18.702   2.610  -6.088
  199   1HD1  ILE  26          1HD1      ILE  26  17.478   4.107 -10.768
  200   2HD1  ILE  26          2HD1      ILE  26  16.462   3.064  -9.773
  201   3HD1  ILE  26          3HD1      ILE  26  18.211   2.852  -9.768
  202    H    ASP  27           H        ASP  27  14.803   3.857  -5.181
  203    HA   ASP  27           HA       ASP  27  16.117   2.175  -3.228
  204   1HB   ASP  27          2HB       ASP  27  14.037   4.317  -2.778
  205   2HB   ASP  27          1HB       ASP  27  15.010   3.520  -1.547
  206    H    GLY  28           H        GLY  28  13.829   1.814  -5.352
  207   1HA   GLY  28          2HA       GLY  28  11.661   0.667  -3.960
  208   2HA   GLY  28          1HA       GLY  28  12.123   0.309  -5.622
  209    H    SER  29           H        SER  29  14.870  -0.222  -4.261
  210    HA   SER  29           HA       SER  29  14.527  -3.064  -3.983
  211   1HB   SER  29          2HB       SER  29  16.921  -1.326  -3.398
  212   2HB   SER  29          1HB       SER  29  16.931  -3.085  -3.523
  213    HG   SER  29           HG       SER  29  15.932  -2.567  -5.727
  214    H    ILE  30           H        ILE  30  15.027  -0.334  -1.882
  215    HA   ILE  30           HA       ILE  30  15.187  -1.800   0.565
  216    HB   ILE  30           HB       ILE  30  14.014   0.925   0.718
  217   1HG1  ILE  30          2HG1      ILE  30  16.694   0.400  -0.583
  218   2HG1  ILE  30          1HG1      ILE  30  15.390   1.446  -1.140
  219   1HG2  ILE  30          1HG2      ILE  30  14.764  -0.268   2.677
  220   2HG2  ILE  30          2HG2      ILE  30  15.709   1.202   2.435
  221   3HG2  ILE  30          3HG2      ILE  30  16.396  -0.367   2.011
  222   1HD1  ILE  30          1HD1      ILE  30  17.141   1.953   1.246
  223   2HD1  ILE  30          2HD1      ILE  30  15.849   3.003   0.661
  224   3HD1  ILE  30          3HD1      ILE  30  17.281   2.726  -0.332
  225    H    TRP  31           H        TRP  31  12.725  -0.419  -1.429
  226    HA   TRP  31           HA       TRP  31  10.571  -0.763   0.388
  227   1HB   TRP  31          2HB       TRP  31  10.655  -0.252  -2.595
  228   2HB   TRP  31          1HB       TRP  31   9.163  -0.341  -1.670
  229    HD1  TRP  31           HD       TRP  31  11.281   2.241  -2.977
  230    HE1  TRP  31           1HE      TRP  31  11.096   4.429  -1.593
  231    HE3  TRP  31           3HE      TRP  31   9.165   0.346   1.218
  232    HZ2  TRP  31           2HZ      TRP  31  10.204   5.197   0.951
  233    HZ3  TRP  31           3HZ      TRP  31   8.693   1.845   3.105
  234    HH2  TRP  31           HH       TRP  31   9.207   4.223   2.971
  235    H    ASP  32           H        ASP  32  11.989  -2.702  -2.160
  236    HA   ASP  32           HA       ASP  32   9.949  -4.700  -2.097
  237   1HB   ASP  32          2HB       ASP  32  11.198  -4.345  -4.131
  238   2HB   ASP  32          1HB       ASP  32  12.720  -4.665  -3.298
  239    H    ALA  33           H        ALA  33  13.152  -4.277  -0.641
  240    HA   ALA  33           HA       ALA  33  13.229  -6.869   0.481
  241   1HB   ALA  33          1HB       ALA  33  15.084  -6.057   1.821
  242   2HB   ALA  33          2HB       ALA  33  14.700  -4.396   1.369
  243   3HB   ALA  33          3HB       ALA  33  15.251  -5.539   0.144
  244    H    ILE  34           H        ILE  34  11.997  -3.753   1.617
  245    HA   ILE  34           HA       ILE  34  11.262  -4.597   4.219
  246    HB   ILE  34           HB       ILE  34  10.038  -2.546   2.387
  247   1HG1  ILE  34          2HG1      ILE  34  11.745  -2.245   4.870
  248   2HG1  ILE  34          1HG1      ILE  34  12.337  -2.105   3.217
  249   1HG2  ILE  34          1HG2      ILE  34   8.314  -3.312   3.908
  250   2HG2  ILE  34          2HG2      ILE  34   8.839  -1.691   4.367
  251   3HG2  ILE  34          3HG2      ILE  34   9.395  -3.090   5.285
  252   1HD1  ILE  34          1HD1      ILE  34  10.323  -0.312   4.551
  253   2HD1  ILE  34          2HD1      ILE  34  10.852  -0.182   2.875
  254   3HD1  ILE  34          3HD1      ILE  34  12.004   0.079   4.184
  255    H    ALA  35           H        ALA  35   9.477  -4.560   1.149
  256    HA   ALA  35           HA       ALA  35   7.099  -5.717   2.032
  257   1HB   ALA  35          1HB       ALA  35   8.444  -6.001  -0.654
  258   2HB   ALA  35          2HB       ALA  35   7.327  -4.722  -0.176
  259   3HB   ALA  35          3HB       ALA  35   6.758  -6.386  -0.307
  260    H    GLY  36           H        GLY  36  10.129  -7.151   0.969
  261   1HA   GLY  36          2HA       GLY  36   9.240  -9.864   1.056
  262   2HA   GLY  36          1HA       GLY  36  10.912  -9.322   1.029
  263    H    CYS  37           H        CYS  37  10.115  -7.640   3.465
  264    HA   CYS  37           HA       CYS  37  10.884  -9.659   5.402
  265   1HB   CYS  37          2HB       CYS  37  12.171  -7.634   5.425
  266   2HB   CYS  37          1HB       CYS  37  10.714  -6.652   5.503
  267    H    GLU  38           H        GLU  38   8.356  -7.193   5.019
  268    HA   GLU  38           HA       GLU  38   7.118  -8.046   7.500
  269   1HB   GLU  38          2HB       GLU  38   7.435  -5.609   6.713
  270   2HB   GLU  38          1HB       GLU  38   6.080  -5.919   5.639
  271   1HG   GLU  38          2HG       GLU  38   5.310  -4.834   7.642
  272   2HG   GLU  38          1HG       GLU  38   4.691  -6.485   7.584
  273    H    ALA  39           H        ALA  39   6.599  -8.164   4.056
  274    HA   ALA  39           HA       ALA  39   4.007  -9.426   4.510
  275   1HB   ALA  39          1HB       ALA  39   3.497  -8.949   2.171
  276   2HB   ALA  39          2HB       ALA  39   5.104  -8.245   1.974
  277   3HB   ALA  39          3HB       ALA  39   3.932  -7.484   3.052
  278    H    GLY  40           H        GLY  40   7.165 -10.190   3.834
  279   1HA   GLY  40          2HA       GLY  40   8.129 -12.249   3.331
  280   2HA   GLY  40          1HA       GLY  40   6.511 -12.909   3.092
  281    H    GLY  41           H        GLY  41   7.115  -9.973   1.599
  282   1HA   GLY  41          2HA       GLY  41   7.455  -9.329  -0.551
  283   2HA   GLY  41          1HA       GLY  41   8.018 -10.958  -0.939
  284    H    ASN  42           H        ASN  42   5.013  -9.257  -0.025
  285    HA   ASN  42           HA       ASN  42   3.652 -10.582  -2.213
  286   1HB   ASN  42          2HB       ASN  42   3.435 -12.083  -0.200
  287   2HB   ASN  42          1HB       ASN  42   2.552 -10.782   0.597
  288   1HD2  ASN  42          1HD2      ASN  42   2.329 -11.492  -2.814
  289   2HD2  ASN  42          2HD2      ASN  42   0.705 -12.082  -2.772
  290    H    TRP  43           H        TRP  43   3.209  -8.730  -3.201
  291    HA   TRP  43           HA       TRP  43   2.371  -6.394  -1.708
  292   1HB   TRP  43          2HB       TRP  43   2.646  -6.801  -4.687
  293   2HB   TRP  43          1HB       TRP  43   2.448  -5.258  -3.857
  294    HD1  TRP  43           HD       TRP  43   4.956  -8.217  -3.870
  295    HE1  TRP  43           1HE      TRP  43   7.333  -7.280  -3.538
  296    HE3  TRP  43           3HE      TRP  43   3.798  -3.271  -3.293
  297    HZ2  TRP  43           2HZ      TRP  43   8.549  -4.764  -3.125
  298    HZ3  TRP  43           3HZ      TRP  43   5.620  -1.665  -2.948
  299    HH2  TRP  43           HH       TRP  43   7.953  -2.402  -2.869
  300    H    ALA  44           H        ALA  44   0.910  -9.054  -2.853
  301    HA   ALA  44           HA       ALA  44  -1.665  -7.704  -3.310
  302   1HB   ALA  44          1HB       ALA  44  -0.842 -10.509  -4.064
  303   2HB   ALA  44          2HB       ALA  44  -0.934  -9.131  -5.160
  304   3HB   ALA  44          3HB       ALA  44  -2.399  -9.759  -4.407
  305    H    ILE  45           H        ILE  45  -0.140  -8.612  -0.764
  306    HA   ILE  45           HA       ILE  45  -1.844 -10.588   0.365
  307    HB   ILE  45           HB       ILE  45   0.635 -10.151   0.926
  308   1HG1  ILE  45          2HG1      ILE  45  -1.378 -10.506   3.143
  309   2HG1  ILE  45          1HG1      ILE  45  -0.810 -11.768   2.054
  310   1HG2  ILE  45          1HG2      ILE  45   0.490  -7.780   1.429
  311   2HG2  ILE  45          2HG2      ILE  45   1.029  -8.677   2.848
  312   3HG2  ILE  45          3HG2      ILE  45  -0.638  -8.108   2.744
  313   1HD1  ILE  45          1HD1      ILE  45   1.466 -11.466   2.932
  314   2HD1  ILE  45          2HD1      ILE  45   0.312 -11.941   4.180
  315   3HD1  ILE  45          3HD1      ILE  45   0.845 -10.263   4.063
  316    H    ASN  46           H        ASN  46  -3.487 -10.313   1.729
  317    HA   ASN  46           HA       ASN  46  -4.141  -7.634   2.711
  318   1HB   ASN  46          2HB       ASN  46  -5.415  -8.142   0.544
  319   2HB   ASN  46          1HB       ASN  46  -6.252  -9.399   1.451
  320   1HD2  ASN  46          1HD2      ASN  46  -5.826  -6.003   0.971
  321   2HD2  ASN  46          2HD2      ASN  46  -7.167  -5.493   1.937
  322    H    THR  47           H        THR  47  -3.233  -8.621   4.546
  323    HA   THR  47           HA       THR  47  -4.118 -10.921   5.818
  324    HB   THR  47           HB       THR  47  -3.275  -9.652   7.918
  325    HG1  THR  47           1HG      THR  47  -1.921  -7.817   7.202
  326   1HG2  THR  47          1HG2      THR  47  -0.934  -9.939   7.220
  327   2HG2  THR  47          2HG2      THR  47  -1.454 -10.066   5.539
  328   3HG2  THR  47          3HG2      THR  47  -1.931 -11.300   6.706
  329    H    GLY  48           H        GLY  48  -5.442  -7.710   5.715
  330   1HA   GLY  48          2HA       GLY  48  -7.733  -7.264   6.058
  331   2HA   GLY  48          1HA       GLY  48  -7.831  -8.694   7.079
  332    H    ASN  49           H        ASN  49  -5.169  -6.547   7.429
  333    HA   ASN  49           HA       ASN  49  -6.220  -5.834  10.073
  334   1HB   ASN  49          2HB       ASN  49  -3.935  -5.497  10.780
  335   2HB   ASN  49          1HB       ASN  49  -4.063  -7.062   9.989
  336   1HD2  ASN  49          1HD2      ASN  49  -1.664  -5.687  10.387
  337   2HD2  ASN  49          2HD2      ASN  49  -1.021  -5.251   8.838
  338    H    GLY  50           H        GLY  50  -6.208  -4.524   7.145
  339   1HA   GLY  50          2HA       GLY  50  -6.982  -2.338   6.712
  340   2HA   GLY  50          1HA       GLY  50  -6.277  -1.813   8.236
  341    H    TYR  51           H        TYR  51  -3.971  -3.663   7.049
  342    HA   TYR  51           HA       TYR  51  -2.678  -1.445   5.620
  343   1HB   TYR  51          2HB       TYR  51  -1.095  -3.619   6.978
  344   2HB   TYR  51          1HB       TYR  51  -0.588  -2.010   6.521
  345    HD1  TYR  51           1HD      TYR  51  -3.415  -1.032   7.922
  346    HD2  TYR  51           2HD      TYR  51   0.118  -3.080   9.119
  347    HE1  TYR  51           1HE      TYR  51  -3.751  -0.266  10.238
  348    HE2  TYR  51           2HE      TYR  51  -0.218  -2.326  11.438
  349    HH   TYR  51           HH       TYR  51  -1.384  -0.468  12.624
  350    H    TYR  52           H        TYR  52  -1.767  -1.948   3.670
  351    HA   TYR  52           HA       TYR  52  -2.872  -4.469   2.673
  352   1HB   TYR  52          2HB       TYR  52  -2.386  -1.916   1.163
  353   2HB   TYR  52          1HB       TYR  52  -3.180  -3.362   0.539
  354    HD1  TYR  52           1HD      TYR  52  -3.713  -0.225   1.931
  355    HD2  TYR  52           2HD      TYR  52  -5.185  -4.206   2.102
  356    HE1  TYR  52           1HE      TYR  52  -5.836   0.605   2.834
  357    HE2  TYR  52           2HE      TYR  52  -7.332  -3.386   2.979
  358    HH   TYR  52           HH       TYR  52  -8.218  -0.135   2.904
  359    H    GLY  53           H        GLY  53  -1.911  -5.084   0.479
  360   1HA   GLY  53          2HA       GLY  53   0.319  -6.509   1.086
  361   2HA   GLY  53          1HA       GLY  53  -0.216  -6.189  -0.547
  362    H    GLY  54           H        GLY  54   2.422  -6.599   0.424
  363   1HA   GLY  54          2HA       GLY  54   4.341  -5.825  -0.665
  364   2HA   GLY  54          1HA       GLY  54   3.587  -4.246  -0.849
  365    H    VAL  55           H        VAL  55   4.072  -2.687   0.576
  366    HA   VAL  55           HA       VAL  55   6.087  -3.282   2.566
  367    HB   VAL  55           HB       VAL  55   5.844  -0.706   2.948
  368   1HG1  VAL  55          1HG1      VAL  55   7.811  -1.806   2.025
  369   2HG1  VAL  55          2HG1      VAL  55   7.455  -0.333   1.121
  370   3HG1  VAL  55          3HG1      VAL  55   7.032  -1.905   0.447
  371   1HG2  VAL  55          1HG2      VAL  55   4.764  -0.961   0.147
  372   2HG2  VAL  55          2HG2      VAL  55   5.094   0.527   1.030
  373   3HG2  VAL  55          3HG2      VAL  55   3.789  -0.537   1.554
  374    H    GLN  56           H        GLN  56   2.809  -3.251   2.499
  375    HA   GLN  56           HA       GLN  56   1.284  -3.732   4.100
  376   1HB   GLN  56          2HB       GLN  56   3.855  -4.538   5.289
  377   2HB   GLN  56          1HB       GLN  56   2.519  -4.359   6.417
  378   1HG   GLN  56          2HG       GLN  56   2.321  -6.003   3.917
  379   2HG   GLN  56          1HG       GLN  56   2.890  -6.657   5.452
  380   1HE2  GLN  56          1HE2      GLN  56   0.174  -5.358   3.723
  381   2HE2  GLN  56          2HE2      GLN  56  -1.045  -5.879   4.834
  382    H    PHE  57           H        PHE  57   1.501  -1.011   3.859
  383    HA   PHE  57           HA       PHE  57   1.146  -0.278   6.669
  384   1HB   PHE  57          2HB       PHE  57   1.640   2.040   6.176
  385   2HB   PHE  57          1HB       PHE  57   2.975   0.979   5.786
  386    HD1  PHE  57           1HD      PHE  57   2.703   0.160   3.106
  387    HD2  PHE  57           2HD      PHE  57   1.489   3.848   4.848
  388    HE1  PHE  57           1HE      PHE  57   2.992   1.284   0.935
  389    HE2  PHE  57           2HE      PHE  57   1.763   4.971   2.679
  390    HZ   PHE  57           HZ       PHE  57   2.538   3.698   0.712
  391    H    ASP  58           H        ASP  58  -0.409   1.559   7.003
  392    HA   ASP  58           HA       ASP  58  -2.825   0.198   6.413
  393   1HB   ASP  58          2HB       ASP  58  -3.879   1.781   7.936
  394   2HB   ASP  58          1HB       ASP  58  -2.396   1.129   8.621
  395    H    GLN  59           H        GLN  59  -4.799   1.144   5.820
  396    HA   GLN  59           HA       GLN  59  -4.900   2.285   3.314
  397   1HB   GLN  59          2HB       GLN  59  -6.707   1.021   4.310
  398   2HB   GLN  59          1HB       GLN  59  -6.883   2.208   5.583
  399   1HG   GLN  59          2HG       GLN  59  -8.667   2.543   4.117
  400   2HG   GLN  59          1HG       GLN  59  -7.539   3.858   3.835
  401   1HE2  GLN  59          1HE2      GLN  59  -5.714   2.438   2.164
  402   2HE2  GLN  59          2HE2      GLN  59  -6.523   2.097   0.669
  403    H    GLY  60           H        GLY  60  -5.007   3.770   6.478
  404   1HA   GLY  60          2HA       GLY  60  -5.908   6.334   5.631
  405   2HA   GLY  60          1HA       GLY  60  -5.176   5.957   7.183
  406    H    THR  61           H        THR  61  -2.710   5.120   6.562
  407    HA   THR  61           HA       THR  61  -1.318   7.479   5.908
  408    HB   THR  61           HB       THR  61  -0.341   4.655   6.012
  409    HG1  THR  61           1HG      THR  61  -0.661   4.902   8.073
  410   1HG2  THR  61          1HG2      THR  61   1.246   6.103   4.841
  411   2HG2  THR  61          2HG2      THR  61   1.881   5.629   6.416
  412   3HG2  THR  61          3HG2      THR  61   1.206   7.242   6.187
  413    H    TRP  62           H        TRP  62  -2.027   4.545   4.084
  414    HA   TRP  62           HA       TRP  62  -0.652   5.090   1.729
  415   1HB   TRP  62          2HB       TRP  62  -1.758   2.960   2.185
  416   2HB   TRP  62          1HB       TRP  62  -3.323   3.766   2.200
  417    HD1  TRP  62           HD       TRP  62  -4.478   4.266  -0.063
  418    HE1  TRP  62           1HE      TRP  62  -4.037   3.503  -2.476
  419    HE3  TRP  62           3HE      TRP  62   0.227   2.366   0.546
  420    HZ2  TRP  62           2HZ      TRP  62  -1.969   2.239  -3.945
  421    HZ3  TRP  62           3HZ      TRP  62   1.373   1.398  -1.404
  422    HH2  TRP  62           HH       TRP  62   0.308   1.331  -3.598
  423    H    GLU  63           H        GLU  63  -3.934   5.923   2.716
  424    HA   GLU  63           HA       GLU  63  -4.616   7.375   0.405
  425   1HB   GLU  63          2HB       GLU  63  -6.349   6.524   1.773
  426   2HB   GLU  63          1HB       GLU  63  -5.692   7.276   3.217
  427   1HG   GLU  63          2HG       GLU  63  -6.270   9.480   2.299
  428   2HG   GLU  63          1HG       GLU  63  -6.984   8.686   0.895
  429    H    ALA  64           H        ALA  64  -3.069   8.237   3.432
  430    HA   ALA  64           HA       ALA  64  -3.389  11.034   3.309
  431   1HB   ALA  64          1HB       ALA  64  -1.160   9.503   4.641
  432   2HB   ALA  64          2HB       ALA  64  -2.745   9.817   5.351
  433   3HB   ALA  64          3HB       ALA  64  -1.658  11.160   4.990
  434    H    ASN  65           H        ASN  65  -0.767   8.931   2.189
  435    HA   ASN  65           HA       ASN  65   0.657  11.126   0.994
  436   1HB   ASN  65          2HB       ASN  65   1.042   8.138   0.697
  437   2HB   ASN  65          1HB       ASN  65   2.145   9.371   0.101
  438   1HD2  ASN  65          1HD2      ASN  65   0.944   7.711   2.902
  439   2HD2  ASN  65          2HD2      ASN  65   2.156   8.282   4.002
  440    H    GLY  66           H        GLY  66  -2.047   9.344   0.207
  441   1HA   GLY  66          2HA       GLY  66  -3.467   9.741  -1.581
  442   2HA   GLY  66          1HA       GLY  66  -2.171  10.617  -2.386
  443    H    GLY  67           H        GLY  67  -2.476   7.260  -1.193
  444   1HA   GLY  67          2HA       GLY  67  -1.039   6.317  -3.522
  445   2HA   GLY  67          1HA       GLY  67  -1.623   5.340  -2.181
  446    H    LEU  68           H        LEU  68  -4.215   6.912  -2.735
  447    HA   LEU  68           HA       LEU  68  -5.598   4.741  -3.763
  448   1HB   LEU  68          2HB       LEU  68  -6.487   7.581  -3.736
  449   2HB   LEU  68          1HB       LEU  68  -7.509   6.162  -3.623
  450    HG   LEU  68           HG       LEU  68  -5.515   6.980  -1.505
  451   1HD1  LEU  68          1HD1      LEU  68  -7.453   7.737  -0.224
  452   2HD1  LEU  68          2HD1      LEU  68  -8.495   7.412  -1.609
  453   3HD1  LEU  68          3HD1      LEU  68  -7.256   8.662  -1.712
  454   1HD2  LEU  68          1HD2      LEU  68  -6.776   5.424  -0.096
  455   2HD2  LEU  68          2HD2      LEU  68  -5.990   4.629  -1.459
  456   3HD2  LEU  68          3HD2      LEU  68  -7.726   4.942  -1.503
  457    H    ARG  69           H        ARG  69  -4.233   7.540  -5.305
  458    HA   ARG  69           HA       ARG  69  -5.647   7.424  -7.754
  459   1HB   ARG  69          2HB       ARG  69  -3.812   8.849  -8.586
  460   2HB   ARG  69          1HB       ARG  69  -4.436   9.418  -7.041
  461   1HG   ARG  69          2HG       ARG  69  -2.588   8.275  -5.902
  462   2HG   ARG  69          1HG       ARG  69  -1.943   7.796  -7.465
  463   1HD   ARG  69          2HD       ARG  69  -0.740   9.717  -6.721
  464   2HD   ARG  69          1HD       ARG  69  -1.774  10.216  -8.061
  465    HE   ARG  69           HE       ARG  69  -3.350  10.876  -6.081
  466   1HH1  ARG  69          1HH1      ARG  69   0.118  11.268  -6.261
  467   2HH1  ARG  69          2HH1      ARG  69   0.158  12.644  -5.198
  468   1HH2  ARG  69          1HH2      ARG  69  -3.319  12.668  -4.678
  469   2HH2  ARG  69          2HH2      ARG  69  -1.813  13.435  -4.294
  470    H    TYR  70           H        TYR  70  -2.896   5.809  -6.415
  471    HA   TYR  70           HA       TYR  70  -2.000   4.600  -8.883
  472   1HB   TYR  70          2HB       TYR  70  -1.486   4.037  -5.963
  473   2HB   TYR  70          1HB       TYR  70  -0.532   3.363  -7.301
  474    HD1  TYR  70           1HD      TYR  70  -1.004   6.002  -5.001
  475    HD2  TYR  70           2HD      TYR  70   0.803   5.070  -8.727
  476    HE1  TYR  70           1HE      TYR  70   0.440   7.963  -4.777
  477    HE2  TYR  70           2HE      TYR  70   2.263   7.043  -8.520
  478    HH   TYR  70           HH       TYR  70   2.555   8.805  -5.598
  479    H    ALA  71           H        ALA  71  -3.913   4.024  -6.109
  480    HA   ALA  71           HA       ALA  71  -5.797   2.294  -7.001
  481   1HB   ALA  71          1HB       ALA  71  -5.091   0.081  -6.229
  482   2HB   ALA  71          2HB       ALA  71  -3.504   0.723  -5.811
  483   3HB   ALA  71          3HB       ALA  71  -4.012   0.660  -7.500
  484    HA   PRO  72           HA       PRO  72  -6.923   3.848  -2.990
  485   1HB   PRO  72          2HB       PRO  72  -8.999   1.816  -3.072
  486   2HB   PRO  72          1HB       PRO  72  -9.122   3.558  -2.908
  487   1HG   PRO  72          2HG       PRO  72  -9.744   2.205  -5.190
  488   2HG   PRO  72          1HG       PRO  72  -9.241   3.901  -5.143
  489   1HD   PRO  72          2HD       PRO  72  -7.776   1.535  -6.080
  490   2HD   PRO  72          1HD       PRO  72  -7.510   3.253  -6.438
  491    H    ARG  73           H        ARG  73  -5.825   0.744  -3.627
  492    HA   ARG  73           HA       ARG  73  -5.160   0.433  -0.823
  493   1HB   ARG  73          2HB       ARG  73  -5.928  -1.880  -0.695
  494   2HB   ARG  73          1HB       ARG  73  -7.285  -0.841  -1.118
  495   1HG   ARG  73          2HG       ARG  73  -6.674  -1.443  -3.551
  496   2HG   ARG  73          1HG       ARG  73  -5.780  -2.778  -2.818
  497   1HD   ARG  73          2HD       ARG  73  -8.683  -2.244  -2.215
  498   2HD   ARG  73          1HD       ARG  73  -8.169  -3.246  -3.569
  499    HE   ARG  73           HE       ARG  73  -6.868  -4.379  -1.518
  500   1HH1  ARG  73          1HH1      ARG  73 -10.205  -3.348  -1.826
  501   2HH1  ARG  73          2HH1      ARG  73 -10.843  -4.708  -0.943
  502   1HH2  ARG  73          1HH2      ARG  73  -7.694  -6.146  -0.347
  503   2HH2  ARG  73          2HH2      ARG  73  -9.407  -6.291  -0.073
  504    H    ALA  74           H        ALA  74  -3.230  -0.604  -0.545
  505    HA   ALA  74           HA       ALA  74  -1.377  -0.486  -2.615
  506   1HB   ALA  74          1HB       ALA  74  -0.934  -2.130  -0.150
  507   2HB   ALA  74          2HB       ALA  74  -0.975  -0.368  -0.095
  508   3HB   ALA  74          3HB       ALA  74   0.233  -1.193  -1.080
  509    H    ASP  75           H        ASP  75  -3.400  -3.159  -1.619
  510    HA   ASP  75           HA       ASP  75  -1.703  -5.088  -2.905
  511   1HB   ASP  75          2HB       ASP  75  -3.396  -6.737  -2.389
  512   2HB   ASP  75          1HB       ASP  75  -3.019  -5.780  -0.966
  513    H    LEU  76           H        LEU  76  -3.829  -2.834  -3.998
  514    HA   LEU  76           HA       LEU  76  -4.528  -4.356  -6.400
  515   1HB   LEU  76          2HB       LEU  76  -6.288  -3.013  -5.315
  516   2HB   LEU  76          1HB       LEU  76  -5.315  -1.572  -5.528
  517    HG   LEU  76           HG       LEU  76  -5.485  -1.857  -7.986
  518   1HD1  LEU  76          1HD1      LEU  76  -5.850  -4.280  -8.003
  519   2HD1  LEU  76          2HD1      LEU  76  -7.101  -3.419  -8.899
  520   3HD1  LEU  76          3HD1      LEU  76  -7.442  -4.039  -7.284
  521   1HD2  LEU  76          1HD2      LEU  76  -8.096  -1.703  -6.483
  522   2HD2  LEU  76          2HD2      LEU  76  -7.842  -1.173  -8.145
  523   3HD2  LEU  76          3HD2      LEU  76  -7.001  -0.362  -6.822
  524    H    ALA  77           H        ALA  77  -2.626  -1.684  -5.224
  525    HA   ALA  77           HA       ALA  77  -1.526  -0.975  -7.773
  526   1HB   ALA  77          1HB       ALA  77  -0.074   0.484  -6.455
  527   2HB   ALA  77          2HB       ALA  77  -0.653  -0.270  -4.970
  528   3HB   ALA  77          3HB       ALA  77  -1.760   0.668  -5.973
  529    H    THR  78           H        THR  78   0.884  -1.082  -8.097
  530    HA   THR  78           HA       THR  78   1.764  -3.782  -7.360
  531    HB   THR  78           HB       THR  78   3.206  -3.694  -9.298
  532    HG1  THR  78           1HG      THR  78   2.223  -1.039  -9.746
  533   1HG2  THR  78          1HG2      THR  78   0.413  -2.680  -9.821
  534   2HG2  THR  78          2HG2      THR  78   0.944  -4.361  -9.742
  535   3HG2  THR  78          3HG2      THR  78   1.478  -3.332 -11.071
  536    H    ARG  79           H        ARG  79   4.426  -3.698  -7.674
  537    HA   ARG  79           HA       ARG  79   5.419  -2.864  -5.242
  538   1HB   ARG  79          2HB       ARG  79   6.892  -3.152  -7.865
  539   2HB   ARG  79          1HB       ARG  79   7.683  -2.953  -6.312
  540   1HG   ARG  79          2HG       ARG  79   6.582  -5.051  -5.564
  541   2HG   ARG  79          1HG       ARG  79   5.993  -5.261  -7.217
  542   1HD   ARG  79          2HD       ARG  79   8.087  -6.504  -6.747
  543   2HD   ARG  79          1HD       ARG  79   8.233  -5.346  -8.066
  544    HE   ARG  79           HE       ARG  79   9.210  -4.796  -5.331
  545   1HH1  ARG  79          1HH1      ARG  79   9.612  -4.749  -8.813
  546   2HH1  ARG  79          2HH1      ARG  79  11.133  -3.905  -8.747
  547   1HH2  ARG  79          1HH2      ARG  79  11.232  -3.679  -5.266
  548   2HH2  ARG  79          2HH2      ARG  79  12.041  -3.302  -6.758
  549    H    GLU  80           H        GLU  80   5.694  -1.212  -8.341
  550    HA   GLU  80           HA       GLU  80   7.257   0.907  -7.349
  551   1HB   GLU  80          2HB       GLU  80   6.751   1.966  -9.556
  552   2HB   GLU  80          1HB       GLU  80   7.412   0.341  -9.641
  553   1HG   GLU  80          2HG       GLU  80   4.968  -0.424  -9.828
  554   2HG   GLU  80          1HG       GLU  80   4.630   1.263 -10.219
  555    H    GLU  81           H        GLU  81   3.784   0.483  -7.567
  556    HA   GLU  81           HA       GLU  81   3.184   3.200  -6.968
  557   1HB   GLU  81          2HB       GLU  81   1.603   0.670  -6.847
  558   2HB   GLU  81          1HB       GLU  81   0.964   2.172  -6.187
  559   1HG   GLU  81          2HG       GLU  81   0.133   2.287  -8.266
  560   2HG   GLU  81          1HG       GLU  81   1.657   3.112  -8.528
  561    H    GLN  82           H        GLN  82   3.371   0.260  -4.938
  562    HA   GLN  82           HA       GLN  82   2.877   1.557  -2.494
  563   1HB   GLN  82          2HB       GLN  82   4.273  -0.954  -3.256
  564   2HB   GLN  82          1HB       GLN  82   4.616  -0.299  -1.658
  565   1HG   GLN  82          2HG       GLN  82   2.875  -1.645  -1.167
  566   2HG   GLN  82          1HG       GLN  82   2.011  -0.152  -1.519
  567   1HE2  GLN  82          1HE2      GLN  82   2.399  -3.422  -2.275
  568   2HE2  GLN  82          2HE2      GLN  82   1.355  -3.465  -3.662
  569    H    ILE  83           H        ILE  83   5.732   1.186  -4.425
  570    HA   ILE  83           HA       ILE  83   7.590   2.412  -2.738
  571    HB   ILE  83           HB       ILE  83   7.411   2.239  -5.741
  572   1HG1  ILE  83          2HG1      ILE  83   9.460   1.045  -3.875
  573   2HG1  ILE  83          1HG1      ILE  83   7.959   0.216  -4.265
  574   1HG2  ILE  83          1HG2      ILE  83   9.621   3.482  -4.112
  575   2HG2  ILE  83          2HG2      ILE  83   8.557   4.309  -5.252
  576   3HG2  ILE  83          3HG2      ILE  83   9.712   3.108  -5.834
  577   1HD1  ILE  83          1HD1      ILE  83   9.781  -0.585  -5.641
  578   2HD1  ILE  83          2HD1      ILE  83  10.090   1.051  -6.219
  579   3HD1  ILE  83          3HD1      ILE  83   8.580   0.241  -6.633
  580    H    ALA  84           H        ALA  84   5.364   3.833  -5.184
  581    HA   ALA  84           HA       ALA  84   6.410   6.455  -4.954
  582   1HB   ALA  84          1HB       ALA  84   3.654   5.599  -5.822
  583   2HB   ALA  84          2HB       ALA  84   5.079   5.694  -6.857
  584   3HB   ALA  84          3HB       ALA  84   4.410   7.161  -6.141
  585    H    VAL  85           H        VAL  85   3.650   4.902  -3.402
  586    HA   VAL  85           HA       VAL  85   2.728   7.185  -2.006
  587    HB   VAL  85           HB       VAL  85   2.400   4.294  -1.226
  588   1HG1  VAL  85          1HG1      VAL  85   0.309   5.059  -0.192
  589   2HG1  VAL  85          2HG1      VAL  85   0.697   6.717  -0.650
  590   3HG1  VAL  85          3HG1      VAL  85   1.714   5.860   0.509
  591   1HG2  VAL  85          1HG2      VAL  85   1.764   4.588  -3.543
  592   2HG2  VAL  85          2HG2      VAL  85   0.741   5.958  -3.110
  593   3HG2  VAL  85          3HG2      VAL  85   0.333   4.340  -2.545
  594    H    ALA  86           H        ALA  86   4.680   4.402  -0.987
  595    HA   ALA  86           HA       ALA  86   5.312   5.297   1.584
  596   1HB   ALA  86          1HB       ALA  86   5.655   2.996   0.799
  597   2HB   ALA  86          2HB       ALA  86   7.118   3.680   1.512
  598   3HB   ALA  86          3HB       ALA  86   6.964   3.560  -0.241
  599    H    GLU  87           H        GLU  87   6.537   6.124  -1.541
  600    HA   GLU  87           HA       GLU  87   9.020   7.243  -0.863
  601   1HB   GLU  87          2HB       GLU  87   7.103   7.740  -3.107
  602   2HB   GLU  87          1HB       GLU  87   8.441   8.852  -2.875
  603   1HG   GLU  87          2HG       GLU  87   8.649   5.892  -3.347
  604   2HG   GLU  87          1HG       GLU  87   8.983   7.170  -4.518
  605    H    VAL  88           H        VAL  88   5.788   8.748  -0.972
  606    HA   VAL  88           HA       VAL  88   6.687  11.291  -0.108
  607    HB   VAL  88           HB       VAL  88   3.956  10.074   0.409
  608   1HG1  VAL  88          1HG1      VAL  88   4.453  12.030   1.795
  609   2HG1  VAL  88          2HG1      VAL  88   3.219  12.402   0.585
  610   3HG1  VAL  88          3HG1      VAL  88   4.877  12.953   0.349
  611   1HG2  VAL  88          1HG2      VAL  88   4.943  11.739  -1.914
  612   2HG2  VAL  88          2HG2      VAL  88   3.264  11.286  -1.622
  613   3HG2  VAL  88          3HG2      VAL  88   4.465  10.042  -1.972
  614    H    THR  89           H        THR  89   5.612   8.412   1.610
  615    HA   THR  89           HA       THR  89   5.468   9.600   4.169
  616    HB   THR  89           HB       THR  89   6.093   6.718   4.050
  617    HG1  THR  89           1HG      THR  89   3.989   7.904   2.560
  618   1HG2  THR  89          1HG2      THR  89   3.742   8.265   5.127
  619   2HG2  THR  89          2HG2      THR  89   5.210   7.898   6.027
  620   3HG2  THR  89          3HG2      THR  89   4.156   6.588   5.491
  621    H    ARG  90           H        ARG  90   7.982   7.672   2.567
  622    HA   ARG  90           HA       ARG  90   9.750   7.620   4.787
  623   1HB   ARG  90          2HB       ARG  90  11.334   6.613   3.366
  624   2HB   ARG  90          1HB       ARG  90   9.787   6.077   2.730
  625   1HG   ARG  90          2HG       ARG  90  10.062   7.167   0.778
  626   2HG   ARG  90          1HG       ARG  90  10.900   8.529   1.529
  627   1HD   ARG  90          2HD       ARG  90  12.944   7.387   1.586
  628   2HD   ARG  90          1HD       ARG  90  12.179   5.824   1.308
  629    HE   ARG  90           HE       ARG  90  11.592   6.999  -0.963
  630   1HH1  ARG  90          1HH1      ARG  90  14.606   7.234   0.816
  631   2HH1  ARG  90          2HH1      ARG  90  15.588   7.287  -0.620
  632   1HH2  ARG  90          1HH2      ARG  90  12.848   7.097  -2.824
  633   2HH2  ARG  90          2HH2      ARG  90  14.584   7.182  -2.703
  634    H    LEU  91           H        LEU  91   9.069   9.799   2.274
  635    HA   LEU  91           HA       LEU  91  11.474  11.259   2.168
  636   1HB   LEU  91          2HB       LEU  91   9.739  11.365   0.453
  637   2HB   LEU  91          1HB       LEU  91   8.652  12.140   1.590
  638    HG   LEU  91           HG       LEU  91  10.231  14.045   1.728
  639   1HD1  LEU  91          1HD1      LEU  91  12.259  12.859   1.057
  640   2HD1  LEU  91          2HD1      LEU  91  11.965  14.243   0.002
  641   3HD1  LEU  91          3HD1      LEU  91  11.592  12.611  -0.557
  642   1HD2  LEU  91          1HD2      LEU  91   9.623  14.978  -0.456
  643   2HD2  LEU  91          2HD2      LEU  91   8.271  14.114   0.280
  644   3HD2  LEU  91          3HD2      LEU  91   9.194  13.361  -1.022
  645    H    ARG  92           H        ARG  92   8.785  11.380   4.334
  646    HA   ARG  92           HA       ARG  92   9.490  13.975   5.411
  647   1HB   ARG  92          2HB       ARG  92   7.367  12.154   6.478
  648   2HB   ARG  92          1HB       ARG  92   7.420  13.913   6.501
  649   1HG   ARG  92          2HG       ARG  92   6.776  14.091   4.292
  650   2HG   ARG  92          1HG       ARG  92   7.290  12.448   3.909
  651   1HD   ARG  92          2HD       ARG  92   4.824  13.377   5.310
  652   2HD   ARG  92          1HD       ARG  92   4.993  12.259   3.952
  653    HE   ARG  92           HE       ARG  92   6.265  11.007   6.013
  654   1HH1  ARG  92          1HH1      ARG  92   3.042  12.243   5.423
  655   2HH1  ARG  92          2HH1      ARG  92   2.279  11.220   6.604
  656   1HH2  ARG  92          1HH2      ARG  92   5.253   9.651   7.606
  657   2HH2  ARG  92          2HH2      ARG  92   3.536   9.752   7.850
  658    H    GLN  93           H        GLN  93   9.309  10.605   6.355
  659    HA   GLN  93           HA       GLN  93  10.313  11.281   9.020
  660   1HB   GLN  93          2HB       GLN  93   9.299   9.237   9.751
  661   2HB   GLN  93          1HB       GLN  93   8.142  10.121   8.754
  662   1HG   GLN  93          2HG       GLN  93   8.981   8.706   6.817
  663   2HG   GLN  93          1HG       GLN  93   9.727   7.684   8.045
  664   1HE2  GLN  93          1HE2      GLN  93   7.573   7.206   6.109
  665   2HE2  GLN  93          2HE2      GLN  93   6.241   6.630   7.059
  666    H    GLY  94           H        GLY  94  11.133   9.454   6.185
  667   1HA   GLY  94          2HA       GLY  94  13.426   8.798   5.793
  668   2HA   GLY  94          1HA       GLY  94  13.574   8.491   7.524
  669    H    TRP  95           H        TRP  95  13.280   6.513   8.201
  670    HA   TRP  95           HA       TRP  95  11.384   4.803   6.809
  671   1HB   TRP  95          2HB       TRP  95  14.097   3.783   7.720
  672   2HB   TRP  95          1HB       TRP  95  12.868   2.886   6.821
  673    HD1  TRP  95           HD       TRP  95  15.356   5.775   6.318
  674    HE1  TRP  95           1HE      TRP  95  15.898   5.946   3.817
  675    HE3  TRP  95           3HE      TRP  95  12.097   2.265   4.574
  676    HZ2  TRP  95           2HZ      TRP  95  15.044   4.729   1.398
  677    HZ3  TRP  95           3HZ      TRP  95  12.011   1.833   2.156
  678    HH2  TRP  95           HH       TRP  95  13.451   3.041   0.603
  679    H    GLY  96           H        GLY  96  11.678   6.551   9.198
  680   1HA   GLY  96          2HA       GLY  96  11.908   5.126  11.576
  681   2HA   GLY  96          1HA       GLY  96  10.911   6.556  11.365
  682    H    ALA  97           H        ALA  97   9.125   5.378   9.427
  683    HA   ALA  97           HA       ALA  97   7.377   3.974  11.232
  684   1HB   ALA  97          1HB       ALA  97   6.475   5.601   9.638
  685   2HB   ALA  97          2HB       ALA  97   5.769   4.003   9.403
  686   3HB   ALA  97          3HB       ALA  97   7.017   4.586   8.303
  687    H    TRP  98           H        TRP  98   9.799   3.118   9.015
  688    HA   TRP  98           HA       TRP  98   8.718   0.396   8.780
  689   1HB   TRP  98          2HB       TRP  98  10.785   1.901   7.180
  690   2HB   TRP  98          1HB       TRP  98  10.531   0.164   7.017
  691    HD1  TRP  98           HD       TRP  98   8.158  -0.646   6.038
  692    HE1  TRP  98           1HE      TRP  98   6.454   0.527   4.501
  693    HE3  TRP  98           3HE      TRP  98   9.800   4.210   6.537
  694    HZ2  TRP  98           2HZ      TRP  98   5.890   3.162   3.610
  695    HZ3  TRP  98           3HZ      TRP  98   8.632   5.965   5.306
  696    HH2  TRP  98           HH       TRP  98   6.717   5.459   3.878
  697    HA   PRO  99           HA       PRO  99  11.429  -0.320  12.235
  698   1HB   PRO  99          2HB       PRO  99  10.414  -3.076  11.829
  699   2HB   PRO  99          1HB       PRO  99  10.401  -2.072  13.291
  700   1HG   PRO  99          2HG       PRO  99   8.152  -2.444  11.964
  701   2HG   PRO  99          1HG       PRO  99   8.569  -0.825  12.569
  702   1HD   PRO  99          2HD       PRO  99   8.869  -1.921   9.785
  703   2HD   PRO  99          1HD       PRO  99   8.180  -0.366  10.311
  704    H    VAL 100           H        VAL 100  12.111  -3.240  12.369
  705    HA   VAL 100           HA       VAL 100  14.747  -3.140  11.525
  706    HB   VAL 100           HB       VAL 100  13.097  -5.647  11.902
  707   1HG1  VAL 100          1HG1      VAL 100  16.048  -5.113  12.175
  708   2HG1  VAL 100          2HG1      VAL 100  15.253  -6.151  10.991
  709   3HG1  VAL 100          3HG1      VAL 100  15.250  -6.597  12.696
  710   1HG2  VAL 100          1HG2      VAL 100  13.773  -5.541  14.263
  711   2HG2  VAL 100          2HG2      VAL 100  12.764  -4.171  13.796
  712   3HG2  VAL 100          3HG2      VAL 100  14.507  -3.963  13.966
  713    H    CYS 101           H        CYS 101  11.866  -4.019   9.783
  714    HA   CYS 101           HA       CYS 101  12.983  -5.419   7.633
  715   1HB   CYS 101          2HB       CYS 101  10.552  -3.620   7.744
  716   2HB   CYS 101          1HB       CYS 101  10.973  -4.616   6.352
  717    H    ALA 102           H        ALA 102  12.681  -1.932   8.192
  718    HA   ALA 102           HA       ALA 102  13.626  -1.199   5.599
  719   1HB   ALA 102          1HB       ALA 102  13.612   0.403   8.152
  720   2HB   ALA 102          2HB       ALA 102  12.317   0.345   6.957
  721   3HB   ALA 102          3HB       ALA 102  13.879   1.043   6.529
  722    H    ALA 103           H        ALA 103  15.136  -1.633   8.766
  723    HA   ALA 103           HA       ALA 103  17.720  -0.779   8.099
  724   1HB   ALA 103          1HB       ALA 103  16.873  -2.890  10.085
  725   2HB   ALA 103          2HB       ALA 103  17.040  -1.162  10.405
  726   3HB   ALA 103          3HB       ALA 103  18.463  -2.130  10.018
  727    H    ARG 104           H        ARG 104  16.206  -3.954   7.932
  728    HA   ARG 104           HA       ARG 104  18.386  -5.383   6.875
  729   1HB   ARG 104          2HB       ARG 104  15.449  -5.771   7.053
  730   2HB   ARG 104          1HB       ARG 104  16.286  -6.711   5.826
  731   1HG   ARG 104          2HG       ARG 104  16.052  -7.983   7.861
  732   2HG   ARG 104          1HG       ARG 104  17.749  -7.653   7.534
  733   1HD   ARG 104          2HD       ARG 104  16.136  -5.907   9.369
  734   2HD   ARG 104          1HD       ARG 104  16.896  -7.396   9.940
  735    HE   ARG 104           HE       ARG 104  18.269  -4.973   9.040
  736   1HH1  ARG 104          1HH1      ARG 104  18.465  -8.249  10.268
  737   2HH1  ARG 104          2HH1      ARG 104  20.096  -8.065  10.850
  738   1HH2  ARG 104          1HH2      ARG 104  20.415  -4.724   9.785
  739   2HH2  ARG 104          2HH2      ARG 104  21.212  -6.070  10.554
  740    H    ALA 105           H        ALA 105  15.909  -3.425   5.380
  741    HA   ALA 105           HA       ALA 105  16.482  -4.260   2.689
  742   1HB   ALA 105          1HB       ALA 105  14.840  -2.576   2.082
  743   2HB   ALA 105          2HB       ALA 105  14.846  -1.961   3.735
  744   3HB   ALA 105          3HB       ALA 105  14.252  -3.589   3.403
  745    H    GLY 106           H        GLY 106  17.668  -1.824   4.838
  746   1HA   GLY 106          2HA       GLY 106  19.812  -0.791   4.225
  747   2HA   GLY 106          1HA       GLY 106  19.162  -0.594   2.603
  748    H    ALA 107           H        ALA 107  18.247   0.236   5.931
  749    HA   ALA 107           HA       ALA 107  16.667   2.453   5.301
  750   1HB   ALA 107          1HB       ALA 107  16.553   1.277   7.447
  751   2HB   ALA 107          2HB       ALA 107  16.797   3.010   7.662
  752   3HB   ALA 107          3HB       ALA 107  18.150   1.896   7.867
  753    H    ARG 108           H        ARG 108  17.067   4.631   5.262
  754    HA   ARG 108           HA       ARG 108  19.659   5.759   5.578
  755   1HB   ARG 108          2HB       ARG 108  19.866   6.272   3.064
  756   2HB   ARG 108          1HB       ARG 108  20.296   4.654   3.605
  757   1HG   ARG 108          2HG       ARG 108  18.125   3.814   2.915
  758   2HG   ARG 108          1HG       ARG 108  17.652   5.436   2.393
  759   1HD   ARG 108          2HD       ARG 108  19.743   3.628   1.218
  760   2HD   ARG 108          1HD       ARG 108  18.299   4.284   0.445
  761    HE   ARG 108           HE       ARG 108  20.062   6.354   1.285
  762   1HH1  ARG 108          1HH1      ARG 108  19.456   4.019  -1.233
  763   2HH1  ARG 108          2HH1      ARG 108  20.449   4.820  -2.408
  764   1HH2  ARG 108          1HH2      ARG 108  21.369   7.437  -0.245
  765   2HH2  ARG 108          2HH2      ARG 108  21.543   6.770  -1.846
  Start of MODEL    2
    1   1H    ASN   1          1HT       ASN   1   6.940  36.751 -35.751
    2   2H    ASN   1          2HT       ASN   1   7.012  35.619 -34.495
    3   3H    ASN   1          3HT       ASN   1   6.648  37.242 -34.154
    4    HA   ASN   1           HA       ASN   1   4.994  35.327 -35.676
    5   1HB   ASN   1          2HB       ASN   1   3.373  35.650 -33.849
    6   2HB   ASN   1          1HB       ASN   1   4.889  34.973 -33.272
    7   1HD2  ASN   1          1HD2      ASN   1   2.809  36.392 -31.835
    8   2HD2  ASN   1          2HD2      ASN   1   3.576  37.749 -31.092
    9    H    VAL   2           H        VAL   2   3.675  36.164 -37.119
   10    HA   VAL   2           HA       VAL   2   3.763  38.997 -37.613
   11    HB   VAL   2           HB       VAL   2   3.865  37.388 -39.473
   12   1HG1  VAL   2          1HG1      VAL   2   1.849  36.200 -40.200
   13   2HG1  VAL   2          2HG1      VAL   2   1.014  36.743 -38.744
   14   3HG1  VAL   2          3HG1      VAL   2   2.403  35.665 -38.614
   15   1HG2  VAL   2          1HG2      VAL   2   3.104  39.643 -39.936
   16   2HG2  VAL   2          2HG2      VAL   2   1.445  39.188 -39.549
   17   3HG2  VAL   2          3HG2      VAL   2   2.246  38.490 -40.956
   18    H    VAL   3           H        VAL   3   1.500  36.718 -36.263
   19    HA   VAL   3           HA       VAL   3  -0.711  38.469 -36.242
   20    HB   VAL   3           HB       VAL   3  -0.977  36.026 -36.056
   21   1HG1  VAL   3          1HG1      VAL   3  -0.534  34.886 -33.940
   22   2HG1  VAL   3          2HG1      VAL   3   0.192  36.359 -33.297
   23   3HG1  VAL   3          3HG1      VAL   3   0.948  35.523 -34.654
   24   1HG2  VAL   3          1HG2      VAL   3  -2.783  37.450 -35.304
   25   2HG2  VAL   3          2HG2      VAL   3  -2.050  37.575 -33.704
   26   3HG2  VAL   3          3HG2      VAL   3  -2.670  36.023 -34.273
   27    H    VAL   4           H        VAL   4  -1.298  39.994 -34.760
   28    HA   VAL   4           HA       VAL   4   0.704  40.748 -32.804
   29    HB   VAL   4           HB       VAL   4  -2.002  42.013 -33.123
   30   1HG1  VAL   4          1HG1      VAL   4  -0.764  42.672 -31.148
   31   2HG1  VAL   4          2HG1      VAL   4  -0.869  44.015 -32.286
   32   3HG1  VAL   4          3HG1      VAL   4   0.629  43.095 -32.143
   33   1HG2  VAL   4          1HG2      VAL   4  -1.026  41.978 -35.332
   34   2HG2  VAL   4          2HG2      VAL   4   0.494  42.606 -34.702
   35   3HG2  VAL   4          3HG2      VAL   4  -0.949  43.617 -34.687
   36    H    THR   5           H        THR   5   0.507  40.603 -30.649
   37    HA   THR   5           HA       THR   5  -1.491  38.696 -29.711
   38    HB   THR   5           HB       THR   5   0.060  38.630 -27.661
   39    HG1  THR   5           1HG      THR   5   2.076  39.463 -27.911
   40   1HG2  THR   5          1HG2      THR   5   1.048  37.669 -30.347
   41   2HG2  THR   5          2HG2      THR   5  -0.102  36.831 -29.304
   42   3HG2  THR   5          3HG2      THR   5   1.568  37.052 -28.780
   43    HA   PRO   6           HA       PRO   6  -3.388  42.221 -27.657
   44   1HB   PRO   6          2HB       PRO   6  -5.728  40.595 -27.341
   45   2HB   PRO   6          1HB       PRO   6  -5.476  41.925 -28.471
   46   1HG   PRO   6          2HG       PRO   6  -5.779  39.302 -29.220
   47   2HG   PRO   6          1HG       PRO   6  -4.941  40.528 -30.188
   48   1HD   PRO   6          2HD       PRO   6  -3.799  38.448 -28.361
   49   2HD   PRO   6          1HD       PRO   6  -3.237  38.972 -29.964
   50    H    ALA   7           H        ALA   7  -4.636  42.408 -25.677
   51    HA   ALA   7           HA       ALA   7  -3.814  40.464 -23.631
   52   1HB   ALA   7          1HB       ALA   7  -2.380  42.451 -23.524
   53   2HB   ALA   7          2HB       ALA   7  -3.400  42.322 -22.090
   54   3HB   ALA   7          3HB       ALA   7  -3.808  43.472 -23.362
   55    H    HIS   8           H        HIS   8  -5.037  41.789 -21.485
   56    HA   HIS   8           HA       HIS   8  -6.994  41.862 -20.353
   57   1HB   HIS   8          2HB       HIS   8  -7.831  43.304 -22.180
   58   2HB   HIS   8          1HB       HIS   8  -8.342  41.871 -23.059
   59    HD1  HIS   8           1HD      HIS   8 -10.668  41.014 -22.555
   60    HD2  HIS   8           2HD      HIS   8  -9.296  43.725 -19.714
   61    HE1  HIS   8           1HE      HIS   8 -12.630  41.509 -21.033
   62    H    GLU   9           H        GLU   9  -6.019  39.502 -22.496
   63    HA   GLU   9           HA       GLU   9  -8.034  37.571 -21.663
   64   1HB   GLU   9          2HB       GLU   9  -6.956  36.013 -23.182
   65   2HB   GLU   9          1HB       GLU   9  -7.256  37.535 -24.007
   66   1HG   GLU   9          2HG       GLU   9  -4.978  38.133 -23.943
   67   2HG   GLU   9          1HG       GLU   9  -4.605  36.859 -22.781
   68    H    ALA  10           H        ALA  10  -7.697  35.949 -20.247
   69    HA   ALA  10           HA       ALA  10  -5.024  35.488 -19.189
   70   1HB   ALA  10          1HB       ALA  10  -5.960  37.193 -17.704
   71   2HB   ALA  10          2HB       ALA  10  -5.790  35.653 -16.863
   72   3HB   ALA  10          3HB       ALA  10  -7.376  36.179 -17.423
   73    H    VAL  11           H        VAL  11  -5.481  33.647 -20.559
   74    HA   VAL  11           HA       VAL  11  -7.495  31.773 -19.941
   75    HB   VAL  11           HB       VAL  11  -4.869  31.319 -21.307
   76   1HG1  VAL  11          1HG1      VAL  11  -5.923  29.311 -22.266
   77   2HG1  VAL  11          2HG1      VAL  11  -7.335  29.588 -21.244
   78   3HG1  VAL  11          3HG1      VAL  11  -5.772  29.216 -20.512
   79   1HG2  VAL  11          1HG2      VAL  11  -7.596  31.867 -22.460
   80   2HG2  VAL  11          2HG2      VAL  11  -6.144  31.497 -23.390
   81   3HG2  VAL  11          3HG2      VAL  11  -6.232  32.983 -22.444
   82    H    VAL  12           H        VAL  12  -4.074  31.923 -19.108
   83    HA   VAL  12           HA       VAL  12  -2.786  30.573 -17.819
   84    HB   VAL  12           HB       VAL  12  -4.721  32.013 -16.110
   85   1HG1  VAL  12          1HG1      VAL  12  -2.087  30.793 -15.282
   86   2HG1  VAL  12          2HG1      VAL  12  -3.681  30.256 -14.754
   87   3HG1  VAL  12          3HG1      VAL  12  -3.082  31.844 -14.270
   88   1HG2  VAL  12          1HG2      VAL  12  -2.895  33.656 -15.913
   89   2HG2  VAL  12          2HG2      VAL  12  -3.455  33.432 -17.569
   90   3HG2  VAL  12          3HG2      VAL  12  -1.950  32.684 -17.037
   91    H    ARG  13           H        ARG  13  -3.286  28.527 -18.396
   92    HA   ARG  13           HA       ARG  13  -5.127  27.083 -16.673
   93   1HB   ARG  13          2HB       ARG  13  -5.310  25.357 -18.330
   94   2HB   ARG  13          1HB       ARG  13  -5.647  26.904 -19.084
   95   1HG   ARG  13          2HG       ARG  13  -2.965  25.574 -19.254
   96   2HG   ARG  13          1HG       ARG  13  -4.262  25.260 -20.409
   97   1HD   ARG  13          2HD       ARG  13  -4.334  27.765 -20.794
   98   2HD   ARG  13          1HD       ARG  13  -2.834  27.854 -19.874
   99    HE   ARG  13           HE       ARG  13  -2.996  26.116 -22.240
  100   1HH1  ARG  13          1HH1      ARG  13  -1.593  28.883 -20.592
  101   2HH1  ARG  13          2HH1      ARG  13  -0.370  29.143 -21.803
  102   1HH2  ARG  13          1HH2      ARG  13  -1.367  26.430 -23.801
  103   2HH2  ARG  13          2HH2      ARG  13  -0.219  27.722 -23.604
  104    H    VAL  14           H        VAL  14  -4.244  26.081 -15.130
  105    HA   VAL  14           HA       VAL  14  -1.499  25.122 -15.328
  106    HB   VAL  14           HB       VAL  14  -2.957  25.508 -12.744
  107   1HG1  VAL  14          1HG1      VAL  14  -0.033  25.599 -13.465
  108   2HG1  VAL  14          2HG1      VAL  14  -0.873  24.274 -12.658
  109   3HG1  VAL  14          3HG1      VAL  14  -0.695  25.827 -11.846
  110   1HG2  VAL  14          1HG2      VAL  14  -1.414  27.651 -14.198
  111   2HG2  VAL  14          2HG2      VAL  14  -2.019  27.767 -12.546
  112   3HG2  VAL  14          3HG2      VAL  14  -3.150  27.646 -13.892
  113    H    GLY  15           H        GLY  15  -1.073  23.193 -14.118
  114   1HA   GLY  15          2HA       GLY  15  -1.788  21.162 -13.111
  115   2HA   GLY  15          1HA       GLY  15  -3.365  21.386 -13.864
  116    H    THR  16           H        THR  16   0.021  20.786 -14.531
  117    HA   THR  16           HA       THR  16  -0.373  19.885 -17.189
  118    HB   THR  16           HB       THR  16   1.956  19.438 -15.317
  119    HG1  THR  16           1HG      THR  16   1.030  21.667 -16.645
  120   1HG2  THR  16          1HG2      THR  16   1.988  17.979 -17.262
  121   2HG2  THR  16          2HG2      THR  16   3.262  19.195 -17.372
  122   3HG2  THR  16          3HG2      THR  16   1.787  19.372 -18.324
  123    H    LYS  17           H        LYS  17  -0.589  18.552 -14.103
  124    HA   LYS  17           HA       LYS  17  -0.974  16.521 -13.206
  125   1HB   LYS  17          2HB       LYS  17  -2.270  16.286 -15.889
  126   2HB   LYS  17          1HB       LYS  17  -2.490  15.086 -14.622
  127   1HG   LYS  17          2HG       LYS  17  -3.309  17.983 -14.590
  128   2HG   LYS  17          1HG       LYS  17  -4.366  16.571 -14.621
  129   1HD   LYS  17          2HD       LYS  17  -3.472  15.915 -12.403
  130   2HD   LYS  17          1HD       LYS  17  -2.531  17.410 -12.380
  131   1HE   LYS  17          2HE       LYS  17  -4.588  18.711 -12.515
  132   2HE   LYS  17          1HE       LYS  17  -5.536  17.227 -12.574
  133   1HZ   LYS  17          1HZ       LYS  17  -3.849  18.155 -10.310
  134   2HZ   LYS  17          2HZ       LYS  17  -4.664  16.667 -10.364
  135   3HZ   LYS  17          3HZ       LYS  17  -5.545  18.117 -10.360
  136    HA   PRO  18           HA       PRO  18   2.555  14.392 -15.446
  137   1HB   PRO  18          2HB       PRO  18   3.859  14.849 -12.829
  138   2HB   PRO  18          1HB       PRO  18   4.503  15.063 -14.465
  139   1HG   PRO  18          2HG       PRO  18   3.907  17.191 -13.046
  140   2HG   PRO  18          1HG       PRO  18   3.426  17.096 -14.756
  141   1HD   PRO  18          2HD       PRO  18   1.745  16.490 -12.327
  142   2HD   PRO  18          1HD       PRO  18   1.389  17.613 -13.662
  143    H    GLY  19           H        GLY  19   2.008  12.453 -15.436
  144   1HA   GLY  19          2HA       GLY  19   2.546  10.605 -13.492
  145   2HA   GLY  19          1HA       GLY  19   0.864  11.036 -13.249
  146    H    THR  20           H        THR  20   2.588  10.855 -16.268
  147    HA   THR  20           HA       THR  20   0.702   9.127 -17.496
  148    HB   THR  20           HB       THR  20   3.540   9.720 -18.374
  149    HG1  THR  20           1HG      THR  20   1.587  11.122 -19.650
  150   1HG2  THR  20          1HG2      THR  20   2.510   7.866 -19.571
  151   2HG2  THR  20          2HG2      THR  20   2.666   9.272 -20.622
  152   3HG2  THR  20          3HG2      THR  20   1.100   8.863 -19.925
  153    H    GLU  21           H        GLU  21   3.819   8.724 -15.976
  154    HA   GLU  21           HA       GLU  21   3.404   5.895 -15.612
  155   1HB   GLU  21          2HB       GLU  21   5.952   6.985 -16.827
  156   2HB   GLU  21          1HB       GLU  21   5.634   5.309 -16.414
  157   1HG   GLU  21          2HG       GLU  21   4.018   5.125 -18.168
  158   2HG   GLU  21          1HG       GLU  21   4.130   6.854 -18.505
  159    H    VAL  22           H        VAL  22   4.571   5.142 -13.845
  160    HA   VAL  22           HA       VAL  22   5.522   7.173 -12.005
  161    HB   VAL  22           HB       VAL  22   5.444   4.167 -11.656
  162   1HG1  VAL  22          1HG1      VAL  22   5.636   4.642  -9.272
  163   2HG1  VAL  22          2HG1      VAL  22   5.743   6.369  -9.616
  164   3HG1  VAL  22          3HG1      VAL  22   7.021   5.282 -10.157
  165   1HG2  VAL  22          1HG2      VAL  22   3.212   5.080 -12.043
  166   2HG2  VAL  22          2HG2      VAL  22   3.464   6.263 -10.759
  167   3HG2  VAL  22          3HG2      VAL  22   3.394   4.542 -10.373
  168    HA   PRO  23           HA       PRO  23   9.658   6.841 -13.771
  169   1HB   PRO  23          2HB       PRO  23  10.232   8.453 -11.339
  170   2HB   PRO  23          1HB       PRO  23  10.666   8.767 -13.023
  171   1HG   PRO  23          2HG       PRO  23   8.707  10.127 -11.823
  172   2HG   PRO  23          1HG       PRO  23   8.594   9.657 -13.529
  173   1HD   PRO  23          2HD       PRO  23   7.254   8.498 -11.143
  174   2HD   PRO  23          1HD       PRO  23   6.648   8.688 -12.798
  175    HA   PRO  24           HA       PRO  24  11.253   3.452 -11.398
  176   1HB   PRO  24          2HB       PRO  24  13.939   3.875 -12.030
  177   2HB   PRO  24          1HB       PRO  24  12.794   2.918 -12.977
  178   1HG   PRO  24          2HG       PRO  24  13.639   5.762 -13.340
  179   2HG   PRO  24          1HG       PRO  24  13.347   4.510 -14.565
  180   1HD   PRO  24          2HD       PRO  24  11.516   6.374 -14.133
  181   2HD   PRO  24          1HD       PRO  24  11.030   4.682 -14.357
  182    H    VAL  25           H        VAL  25  12.064   3.164  -9.438
  183    HA   VAL  25           HA       VAL  25  13.036   5.556  -8.024
  184    HB   VAL  25           HB       VAL  25  11.331   3.325  -6.898
  185   1HG1  VAL  25          1HG1      VAL  25  11.052   5.037  -5.016
  186   2HG1  VAL  25          2HG1      VAL  25  12.494   5.808  -5.682
  187   3HG1  VAL  25          3HG1      VAL  25  12.564   4.144  -5.103
  188   1HG2  VAL  25          1HG2      VAL  25   9.530   4.968  -6.814
  189   2HG2  VAL  25          2HG2      VAL  25  10.078   4.706  -8.470
  190   3HG2  VAL  25          3HG2      VAL  25  10.571   6.157  -7.599
  191    H    ILE  26           H        ILE  26  14.841   5.400  -6.880
  192    HA   ILE  26           HA       ILE  26  16.528   3.125  -7.256
  193    HB   ILE  26           HB       ILE  26  16.919   5.672  -5.670
  194   1HG1  ILE  26          2HG1      ILE  26  18.657   6.062  -7.511
  195   2HG1  ILE  26          1HG1      ILE  26  17.871   4.748  -8.377
  196   1HG2  ILE  26          1HG2      ILE  26  19.295   5.079  -5.517
  197   2HG2  ILE  26          2HG2      ILE  26  18.934   3.502  -6.221
  198   3HG2  ILE  26          3HG2      ILE  26  18.263   3.940  -4.648
  199   1HD1  ILE  26          1HD1      ILE  26  15.797   5.998  -8.429
  200   2HD1  ILE  26          2HD1      ILE  26  17.109   6.948  -9.121
  201   3HD1  ILE  26          3HD1      ILE  26  16.533   7.291  -7.489
  202    H    ASP  27           H        ASP  27  14.373   4.194  -4.846
  203    HA   ASP  27           HA       ASP  27  15.547   2.608  -2.739
  204   1HB   ASP  27          2HB       ASP  27  13.112   4.383  -2.699
  205   2HB   ASP  27          1HB       ASP  27  13.843   3.609  -1.300
  206    H    GLY  28           H        GLY  28  13.655   2.104  -5.255
  207   1HA   GLY  28          2HA       GLY  28  11.471   0.607  -4.295
  208   2HA   GLY  28          1HA       GLY  28  12.213   0.423  -5.883
  209    H    SER  29           H        SER  29  14.778   0.079  -4.264
  210    HA   SER  29           HA       SER  29  14.733  -2.803  -4.212
  211   1HB   SER  29          2HB       SER  29  16.867  -0.898  -3.280
  212   2HB   SER  29          1HB       SER  29  17.072  -2.618  -3.608
  213    HG   SER  29           HG       SER  29  17.249  -2.198  -5.659
  214    H    ILE  30           H        ILE  30  14.758  -0.188  -1.958
  215    HA   ILE  30           HA       ILE  30  15.062  -1.743   0.430
  216    HB   ILE  30           HB       ILE  30  13.609   0.853   0.633
  217   1HG1  ILE  30          2HG1      ILE  30  15.175   1.385  -1.196
  218   2HG1  ILE  30          1HG1      ILE  30  15.612   2.224   0.290
  219   1HG2  ILE  30          1HG2      ILE  30  15.164   1.214   2.473
  220   2HG2  ILE  30          2HG2      ILE  30  15.996  -0.285   2.056
  221   3HG2  ILE  30          3HG2      ILE  30  14.318  -0.328   2.600
  222   1HD1  ILE  30          1HD1      ILE  30  17.377   0.589   0.703
  223   2HD1  ILE  30          2HD1      ILE  30  17.578   1.383  -0.860
  224   3HD1  ILE  30          3HD1      ILE  30  16.938  -0.259  -0.779
  225    H    TRP  31           H        TRP  31  12.530  -0.450  -1.533
  226    HA   TRP  31           HA       TRP  31  10.396  -0.979   0.242
  227   1HB   TRP  31          2HB       TRP  31  10.457  -0.381  -2.724
  228   2HB   TRP  31          1HB       TRP  31   8.975  -0.524  -1.782
  229    HD1  TRP  31           HD       TRP  31  10.908   2.149  -3.076
  230    HE1  TRP  31           1HE      TRP  31  10.777   4.279  -1.603
  231    HE3  TRP  31           3HE      TRP  31   9.204   0.028   1.187
  232    HZ2  TRP  31           2HZ      TRP  31  10.069   4.911   1.024
  233    HZ3  TRP  31           3HZ      TRP  31   8.844   1.442   3.162
  234    HH2  TRP  31           HH       TRP  31   9.276   3.835   3.077
  235    H    ASP  32           H        ASP  32  11.868  -2.776  -2.403
  236    HA   ASP  32           HA       ASP  32   9.952  -4.880  -2.319
  237   1HB   ASP  32          2HB       ASP  32  11.096  -4.536  -4.366
  238   2HB   ASP  32          1HB       ASP  32  12.678  -4.570  -3.574
  239    H    ALA  33           H        ALA  33  13.114  -4.272  -0.786
  240    HA   ALA  33           HA       ALA  33  13.330  -6.890   0.263
  241   1HB   ALA  33          1HB       ALA  33  14.664  -4.355   1.195
  242   2HB   ALA  33          2HB       ALA  33  15.286  -5.468  -0.023
  243   3HB   ALA  33          3HB       ALA  33  15.123  -5.995   1.651
  244    H    ILE  34           H        ILE  34  11.959  -3.858   1.459
  245    HA   ILE  34           HA       ILE  34  11.297  -4.789   4.065
  246    HB   ILE  34           HB       ILE  34   9.967  -2.673   2.370
  247   1HG1  ILE  34          2HG1      ILE  34  11.939  -2.444   4.657
  248   2HG1  ILE  34          1HG1      ILE  34  12.321  -2.208   2.956
  249   1HG2  ILE  34          1HG2      ILE  34   9.630  -3.255   5.316
  250   2HG2  ILE  34          2HG2      ILE  34   8.420  -3.504   4.057
  251   3HG2  ILE  34          3HG2      ILE  34   8.949  -1.870   4.460
  252   1HD1  ILE  34          1HD1      ILE  34  10.820  -0.283   2.892
  253   2HD1  ILE  34          2HD1      ILE  34  12.084  -0.091   4.109
  254   3HD1  ILE  34          3HD1      ILE  34  10.447  -0.525   4.599
  255    H    ALA  35           H        ALA  35   9.474  -4.647   1.021
  256    HA   ALA  35           HA       ALA  35   7.098  -5.816   1.886
  257   1HB   ALA  35          1HB       ALA  35   8.434  -6.096  -0.801
  258   2HB   ALA  35          2HB       ALA  35   7.368  -4.779  -0.309
  259   3HB   ALA  35          3HB       ALA  35   6.738  -6.419  -0.448
  260    H    GLY  36           H        GLY  36  10.132  -7.228   0.854
  261   1HA   GLY  36          2HA       GLY  36   9.170  -9.948   0.969
  262   2HA   GLY  36          1HA       GLY  36  10.839  -9.440   0.759
  263    H    CYS  37           H        CYS  37   9.755  -7.773   3.328
  264    HA   CYS  37           HA       CYS  37  10.904  -9.725   5.182
  265   1HB   CYS  37          2HB       CYS  37  12.204  -7.709   5.015
  266   2HB   CYS  37          1HB       CYS  37  10.778  -6.712   5.269
  267    H    GLU  38           H        GLU  38   8.407  -7.156   5.120
  268    HA   GLU  38           HA       GLU  38   7.274  -8.297   7.544
  269   1HB   GLU  38          2HB       GLU  38   7.073  -5.688   6.180
  270   2HB   GLU  38          1HB       GLU  38   5.603  -6.244   6.972
  271   1HG   GLU  38          2HG       GLU  38   6.794  -6.493   9.066
  272   2HG   GLU  38          1HG       GLU  38   8.296  -6.009   8.286
  273    H    ALA  39           H        ALA  39   6.584  -8.043   4.141
  274    HA   ALA  39           HA       ALA  39   3.952  -9.180   4.569
  275   1HB   ALA  39          1HB       ALA  39   5.195  -8.251   2.003
  276   2HB   ALA  39          2HB       ALA  39   4.140  -7.284   3.035
  277   3HB   ALA  39          3HB       ALA  39   3.514  -8.728   2.238
  278    H    GLY  40           H        GLY  40   7.035 -10.260   4.082
  279   1HA   GLY  40          2HA       GLY  40   7.770 -12.459   3.824
  280   2HA   GLY  40          1HA       GLY  40   6.118 -12.932   3.428
  281    H    GLY  41           H        GLY  41   6.811 -10.236   1.772
  282   1HA   GLY  41          2HA       GLY  41   7.658  -9.768  -0.309
  283   2HA   GLY  41          1HA       GLY  41   8.104 -11.465  -0.514
  284    H    ASN  42           H        ASN  42   5.085  -9.648   0.079
  285    HA   ASN  42           HA       ASN  42   3.953 -10.711  -2.354
  286   1HB   ASN  42          2HB       ASN  42   3.398 -12.422  -0.624
  287   2HB   ASN  42          1HB       ASN  42   2.593 -11.151   0.304
  288   1HD2  ASN  42          1HD2      ASN  42   0.661 -12.396   0.104
  289   2HD2  ASN  42          2HD2      ASN  42  -0.278 -12.323  -1.348
  290    H    TRP  43           H        TRP  43   2.849  -9.209  -3.276
  291    HA   TRP  43           HA       TRP  43   2.346  -6.762  -1.749
  292   1HB   TRP  43          2HB       TRP  43   2.497  -7.219  -4.729
  293   2HB   TRP  43          1HB       TRP  43   2.323  -5.656  -3.934
  294    HD1  TRP  43           HD       TRP  43   4.840  -8.609  -3.705
  295    HE1  TRP  43           1HE      TRP  43   7.221  -7.634  -3.579
  296    HE3  TRP  43           3HE      TRP  43   3.701  -3.631  -3.826
  297    HZ2  TRP  43           2HZ      TRP  43   8.466  -5.088  -3.525
  298    HZ3  TRP  43           3HZ      TRP  43   5.528  -1.994  -3.748
  299    HH2  TRP  43           HH       TRP  43   7.866  -2.743  -3.625
  300    H    ALA  44           H        ALA  44   0.762  -9.429  -2.595
  301    HA   ALA  44           HA       ALA  44  -1.813  -8.039  -2.963
  302   1HB   ALA  44          1HB       ALA  44  -2.681 -10.105  -3.895
  303   2HB   ALA  44          2HB       ALA  44  -1.150 -10.918  -3.578
  304   3HB   ALA  44          3HB       ALA  44  -1.226  -9.611  -4.758
  305    H    ILE  45           H        ILE  45  -0.038  -9.123  -0.527
  306    HA   ILE  45           HA       ILE  45  -1.822 -10.838   0.860
  307    HB   ILE  45           HB       ILE  45   0.697 -10.769   1.136
  308   1HG1  ILE  45          2HG1      ILE  45  -0.964 -10.476   3.636
  309   2HG1  ILE  45          1HG1      ILE  45  -0.800 -11.945   2.685
  310   1HG2  ILE  45          1HG2      ILE  45   0.994  -8.367   1.280
  311   2HG2  ILE  45          2HG2      ILE  45   1.630  -9.165   2.719
  312   3HG2  ILE  45          3HG2      ILE  45   0.077  -8.329   2.786
  313   1HD1  ILE  45          1HD1      ILE  45   0.598 -12.026   4.665
  314   2HD1  ILE  45          2HD1      ILE  45   1.417 -10.545   4.163
  315   3HD1  ILE  45          3HD1      ILE  45   1.584 -12.016   3.204
  316    H    ASN  46           H        ASN  46  -3.189 -10.321   2.535
  317    HA   ASN  46           HA       ASN  46  -3.349  -7.613   3.548
  318   1HB   ASN  46          2HB       ASN  46  -4.636  -7.624   1.356
  319   2HB   ASN  46          1HB       ASN  46  -5.767  -8.736   2.117
  320   1HD2  ASN  46          1HD2      ASN  46  -6.059  -5.997   1.060
  321   2HD2  ASN  46          2HD2      ASN  46  -6.755  -5.085   2.359
  322    H    THR  47           H        THR  47  -3.107  -8.356   5.577
  323    HA   THR  47           HA       THR  47  -4.473 -10.672   6.537
  324    HB   THR  47           HB       THR  47  -3.513  -9.904   8.761
  325    HG1  THR  47           1HG      THR  47  -1.976  -8.219   8.618
  326   1HG2  THR  47          1HG2      THR  47  -2.366 -11.547   7.367
  327   2HG2  THR  47          2HG2      THR  47  -1.203 -10.461   8.132
  328   3HG2  THR  47          3HG2      THR  47  -1.624 -10.248   6.432
  329    H    GLY  48           H        GLY  48  -5.141  -7.321   6.376
  330   1HA   GLY  48          2HA       GLY  48  -7.313  -6.435   6.729
  331   2HA   GLY  48          1HA       GLY  48  -7.627  -7.739   7.867
  332    H    ASN  49           H        ASN  49  -4.593  -6.122   8.026
  333    HA   ASN  49           HA       ASN  49  -5.305  -5.152  10.680
  334   1HB   ASN  49          2HB       ASN  49  -3.193  -6.473  10.219
  335   2HB   ASN  49          1HB       ASN  49  -2.589  -5.060   9.359
  336   1HD2  ASN  49          1HD2      ASN  49  -0.873  -4.850  10.808
  337   2HD2  ASN  49          2HD2      ASN  49  -1.106  -4.227  12.409
  338    H    GLY  50           H        GLY  50  -5.895  -3.896   7.904
  339   1HA   GLY  50          2HA       GLY  50  -6.466  -1.716   7.336
  340   2HA   GLY  50          1HA       GLY  50  -5.580  -1.145   8.746
  341    H    TYR  51           H        TYR  51  -3.353  -2.975   7.764
  342    HA   TYR  51           HA       TYR  51  -2.175  -1.179   5.806
  343   1HB   TYR  51          2HB       TYR  51  -0.832  -3.529   7.150
  344   2HB   TYR  51          1HB       TYR  51  -0.067  -2.198   6.313
  345    HD1  TYR  51           1HD      TYR  51   1.210  -2.600   8.630
  346    HD2  TYR  51           2HD      TYR  51  -2.602  -0.744   8.207
  347    HE1  TYR  51           1HE      TYR  51   1.549  -1.453  10.773
  348    HE2  TYR  51           2HE      TYR  51  -2.262   0.411  10.369
  349    HH   TYR  51           HH       TYR  51   0.805   0.385  12.004
  350    H    TYR  52           H        TYR  52  -1.513  -1.898   3.820
  351    HA   TYR  52           HA       TYR  52  -2.870  -4.361   2.984
  352   1HB   TYR  52          2HB       TYR  52  -2.345  -1.794   1.499
  353   2HB   TYR  52          1HB       TYR  52  -2.907  -3.263   0.699
  354    HD1  TYR  52           1HD      TYR  52  -5.164  -3.300   0.275
  355    HD2  TYR  52           2HD      TYR  52  -3.795  -1.333   3.779
  356    HE1  TYR  52           1HE      TYR  52  -7.490  -2.763   0.875
  357    HE2  TYR  52           2HE      TYR  52  -6.102  -0.778   4.403
  358    HH   TYR  52           HH       TYR  52  -8.304  -0.540   3.347
  359    H    GLY  53           H        GLY  53  -1.923  -5.194   0.823
  360   1HA   GLY  53          2HA       GLY  53   0.393  -6.501   1.620
  361   2HA   GLY  53          1HA       GLY  53  -0.293  -6.556   0.011
  362    H    GLY  54           H        GLY  54   2.300  -6.849   0.149
  363   1HA   GLY  54          2HA       GLY  54   4.081  -5.993  -1.087
  364   2HA   GLY  54          1HA       GLY  54   3.279  -4.428  -1.132
  365    H    VAL  55           H        VAL  55   4.087  -2.878   0.098
  366    HA   VAL  55           HA       VAL  55   6.212  -3.546   1.963
  367    HB   VAL  55           HB       VAL  55   5.166  -0.787   1.341
  368   1HG1  VAL  55          1HG1      VAL  55   7.358  -0.058   1.984
  369   2HG1  VAL  55          2HG1      VAL  55   7.919  -1.724   2.132
  370   3HG1  VAL  55          3HG1      VAL  55   6.726  -1.092   3.265
  371   1HG2  VAL  55          1HG2      VAL  55   5.665  -1.931  -0.756
  372   2HG2  VAL  55          2HG2      VAL  55   7.252  -2.390  -0.139
  373   3HG2  VAL  55          3HG2      VAL  55   6.874  -0.691  -0.425
  374    H    GLN  56           H        GLN  56   3.001  -3.568   2.149
  375    HA   GLN  56           HA       GLN  56   1.597  -3.941   3.861
  376   1HB   GLN  56          2HB       GLN  56   3.440  -5.571   4.299
  377   2HB   GLN  56          1HB       GLN  56   4.120  -4.426   5.443
  378   1HG   GLN  56          2HG       GLN  56   2.853  -6.154   6.577
  379   2HG   GLN  56          1HG       GLN  56   2.114  -4.571   6.809
  380   1HE2  GLN  56          1HE2      GLN  56   1.833  -6.393   3.849
  381   2HE2  GLN  56          2HE2      GLN  56   0.150  -6.741   3.996
  382    H    PHE  57           H        PHE  57   1.788  -1.264   3.553
  383    HA   PHE  57           HA       PHE  57   1.724  -0.473   6.364
  384   1HB   PHE  57          2HB       PHE  57   2.294   1.785   5.831
  385   2HB   PHE  57          1HB       PHE  57   3.540   0.697   5.261
  386    HD1  PHE  57           1HD      PHE  57   1.711   3.533   4.502
  387    HD2  PHE  57           2HD      PHE  57   3.209  -0.012   2.673
  388    HE1  PHE  57           1HE      PHE  57   1.720   4.663   2.316
  389    HE2  PHE  57           2HE      PHE  57   3.218   1.115   0.492
  390    HZ   PHE  57           HZ       PHE  57   2.495   3.465   0.306
  391    H    ASP  58           H        ASP  58   0.383   1.607   6.625
  392    HA   ASP  58           HA       ASP  58  -2.208   0.467   6.455
  393   1HB   ASP  58          2HB       ASP  58  -1.851   1.445   8.480
  394   2HB   ASP  58          1HB       ASP  58  -0.935   2.765   7.791
  395    H    GLN  59           H        GLN  59  -3.971   1.067   5.515
  396    HA   GLN  59           HA       GLN  59  -4.031   2.225   3.006
  397   1HB   GLN  59          2HB       GLN  59  -5.738   0.764   3.607
  398   2HB   GLN  59          1HB       GLN  59  -6.053   1.589   5.125
  399   1HG   GLN  59          2HG       GLN  59  -7.882   2.138   3.836
  400   2HG   GLN  59          1HG       GLN  59  -6.835   3.536   3.628
  401   1HE2  GLN  59          1HE2      GLN  59  -5.047   2.076   1.783
  402   2HE2  GLN  59          2HE2      GLN  59  -5.908   1.989   0.284
  403    H    GLY  60           H        GLY  60  -4.674   3.619   6.168
  404   1HA   GLY  60          2HA       GLY  60  -5.632   6.092   5.312
  405   2HA   GLY  60          1HA       GLY  60  -4.910   5.775   6.877
  406    H    THR  61           H        THR  61  -2.378   5.124   6.326
  407    HA   THR  61           HA       THR  61  -1.049   7.507   5.696
  408    HB   THR  61           HB       THR  61  -0.086   4.676   5.714
  409    HG1  THR  61           1HG      THR  61  -0.905   5.649   7.717
  410   1HG2  THR  61          1HG2      THR  61   2.180   5.554   5.903
  411   2HG2  THR  61          2HG2      THR  61   1.562   7.200   5.762
  412   3HG2  THR  61          3HG2      THR  61   1.433   6.089   4.397
  413    H    TRP  62           H        TRP  62  -1.690   4.624   3.807
  414    HA   TRP  62           HA       TRP  62  -0.432   5.246   1.409
  415   1HB   TRP  62          2HB       TRP  62  -1.426   3.083   1.901
  416   2HB   TRP  62          1HB       TRP  62  -3.020   3.818   2.012
  417    HD1  TRP  62           HD       TRP  62  -4.270   4.394  -0.255
  418    HE1  TRP  62           1HE      TRP  62  -3.947   3.540  -2.663
  419    HE3  TRP  62           3HE      TRP  62   0.389   2.365   0.232
  420    HZ2  TRP  62           2HZ      TRP  62  -1.971   2.183  -4.168
  421    HZ3  TRP  62           3HZ      TRP  62   1.437   1.317  -1.727
  422    HH2  TRP  62           HH       TRP  62   0.296   1.221  -3.880
  423    H    GLU  63           H        GLU  63  -3.716   5.960   2.504
  424    HA   GLU  63           HA       GLU  63  -4.525   7.340   0.179
  425   1HB   GLU  63          2HB       GLU  63  -6.219   6.458   1.570
  426   2HB   GLU  63          1HB       GLU  63  -5.557   7.230   3.005
  427   1HG   GLU  63          2HG       GLU  63  -6.159   9.429   2.047
  428   2HG   GLU  63          1HG       GLU  63  -6.918   8.595   0.690
  429    H    ALA  64           H        ALA  64  -3.115   8.327   3.239
  430    HA   ALA  64           HA       ALA  64  -3.539  11.102   3.017
  431   1HB   ALA  64          1HB       ALA  64  -1.866  11.340   4.757
  432   2HB   ALA  64          2HB       ALA  64  -1.315   9.687   4.482
  433   3HB   ALA  64          3HB       ALA  64  -2.933   9.982   5.118
  434    H    ASN  65           H        ASN  65  -0.856   9.050   1.971
  435    HA   ASN  65           HA       ASN  65   0.656  11.241   0.930
  436   1HB   ASN  65          2HB       ASN  65   0.883   8.291   0.290
  437   2HB   ASN  65          1HB       ASN  65   2.088   9.526  -0.060
  438   1HD2  ASN  65          1HD2      ASN  65   1.589  10.883   2.519
  439   2HD2  ASN  65          2HD2      ASN  65   2.352   9.894   3.716
  440    H    GLY  66           H        GLY  66  -1.975   9.338  -0.177
  441   1HA   GLY  66          2HA       GLY  66  -3.332  10.117  -1.982
  442   2HA   GLY  66          1HA       GLY  66  -1.890  10.792  -2.729
  443    H    GLY  67           H        GLY  67  -2.425   7.532  -1.414
  444   1HA   GLY  67          2HA       GLY  67  -1.085   6.450  -3.727
  445   2HA   GLY  67          1HA       GLY  67  -1.652   5.555  -2.324
  446    H    LEU  68           H        LEU  68  -4.263   7.134  -2.873
  447    HA   LEU  68           HA       LEU  68  -5.597   4.898  -3.848
  448   1HB   LEU  68          2HB       LEU  68  -6.668   7.695  -3.779
  449   2HB   LEU  68          1HB       LEU  68  -7.583   6.206  -3.681
  450    HG   LEU  68           HG       LEU  68  -5.741   7.323  -1.565
  451   1HD1  LEU  68          1HD1      LEU  68  -7.888   8.462  -1.745
  452   2HD1  LEU  68          2HD1      LEU  68  -7.777   7.530  -0.253
  453   3HD1  LEU  68          3HD1      LEU  68  -8.725   6.917  -1.609
  454   1HD2  LEU  68          1HD2      LEU  68  -5.545   4.930  -1.555
  455   2HD2  LEU  68          2HD2      LEU  68  -7.300   4.747  -1.602
  456   3HD2  LEU  68          3HD2      LEU  68  -6.520   5.441  -0.179
  457    H    ARG  69           H        ARG  69  -4.240   7.637  -5.478
  458    HA   ARG  69           HA       ARG  69  -5.685   7.347  -7.903
  459   1HB   ARG  69          2HB       ARG  69  -4.083   8.821  -8.885
  460   2HB   ARG  69          1HB       ARG  69  -4.393   9.393  -7.253
  461   1HG   ARG  69          2HG       ARG  69  -2.264   9.154  -6.661
  462   2HG   ARG  69          1HG       ARG  69  -2.180   7.530  -7.352
  463   1HD   ARG  69          2HD       ARG  69  -0.596   9.040  -8.447
  464   2HD   ARG  69          1HD       ARG  69  -1.833   8.486  -9.574
  465    HE   ARG  69           HE       ARG  69  -1.862  11.155  -8.301
  466   1HH1  ARG  69          1HH1      ARG  69  -2.332   9.066 -11.082
  467   2HH1  ARG  69          2HH1      ARG  69  -2.906  10.348 -12.097
  468   1HH2  ARG  69          1HH2      ARG  69  -2.582  12.831  -9.629
  469   2HH2  ARG  69          2HH2      ARG  69  -3.051  12.507 -11.276
  470    H    TYR  70           H        TYR  70  -2.845   5.865  -6.520
  471    HA   TYR  70           HA       TYR  70  -1.926   4.634  -8.963
  472   1HB   TYR  70          2HB       TYR  70  -1.346   4.030  -6.052
  473   2HB   TYR  70          1HB       TYR  70  -0.415   3.433  -7.423
  474    HD1  TYR  70           1HD      TYR  70  -1.061   6.186  -5.202
  475    HD2  TYR  70           2HD      TYR  70   1.008   5.006  -8.718
  476    HE1  TYR  70           1HE      TYR  70   0.374   8.164  -5.009
  477    HE2  TYR  70           2HE      TYR  70   2.457   6.988  -8.542
  478    HH   TYR  70           HH       TYR  70   2.661   8.872  -5.764
  479    H    ALA  71           H        ALA  71  -3.868   4.055  -6.253
  480    HA   ALA  71           HA       ALA  71  -5.753   2.359  -7.154
  481   1HB   ALA  71          1HB       ALA  71  -5.116   0.116  -6.381
  482   2HB   ALA  71          2HB       ALA  71  -3.503   0.702  -5.982
  483   3HB   ALA  71          3HB       ALA  71  -4.033   0.658  -7.663
  484    HA   PRO  72           HA       PRO  72  -6.822   3.854  -3.110
  485   1HB   PRO  72          2HB       PRO  72  -8.993   1.941  -3.189
  486   2HB   PRO  72          1HB       PRO  72  -9.037   3.693  -3.080
  487   1HG   PRO  72          2HG       PRO  72  -9.678   2.229  -5.331
  488   2HG   PRO  72          1HG       PRO  72  -9.248   3.945  -5.309
  489   1HD   PRO  72          2HD       PRO  72  -7.725   1.667  -6.301
  490   2HD   PRO  72          1HD       PRO  72  -7.462   3.403  -6.561
  491    H    ARG  73           H        ARG  73  -5.790   0.764  -3.857
  492    HA   ARG  73           HA       ARG  73  -5.275   0.260  -1.041
  493   1HB   ARG  73          2HB       ARG  73  -6.056  -2.035  -1.138
  494   2HB   ARG  73          1HB       ARG  73  -7.375  -0.952  -1.566
  495   1HG   ARG  73          2HG       ARG  73  -6.759  -1.394  -3.977
  496   2HG   ARG  73          1HG       ARG  73  -5.735  -2.700  -3.363
  497   1HD   ARG  73          2HD       ARG  73  -8.691  -2.436  -2.807
  498   2HD   ARG  73          1HD       ARG  73  -8.009  -3.435  -4.089
  499    HE   ARG  73           HE       ARG  73  -6.711  -4.294  -1.864
  500   1HH1  ARG  73          1HH1      ARG  73 -10.114  -3.900  -2.660
  501   2HH1  ARG  73          2HH1      ARG  73 -10.632  -5.207  -1.636
  502   1HH2  ARG  73          1HH2      ARG  73  -7.383  -6.010  -0.549
  503   2HH2  ARG  73          2HH2      ARG  73  -9.077  -6.403  -0.415
  504    H    ALA  74           H        ALA  74  -3.343  -0.662  -0.720
  505    HA   ALA  74           HA       ALA  74  -1.397  -0.544  -2.731
  506   1HB   ALA  74          1HB       ALA  74  -0.975  -0.226  -0.295
  507   2HB   ALA  74          2HB       ALA  74   0.160  -1.319  -1.087
  508   3HB   ALA  74          3HB       ALA  74  -1.140  -1.970  -0.092
  509    H    ASP  75           H        ASP  75  -3.463  -3.133  -1.711
  510    HA   ASP  75           HA       ASP  75  -1.743  -5.123  -2.916
  511   1HB   ASP  75          2HB       ASP  75  -3.418  -6.775  -2.141
  512   2HB   ASP  75          1HB       ASP  75  -2.750  -5.801  -0.846
  513    H    LEU  76           H        LEU  76  -3.626  -2.926  -4.160
  514    HA   LEU  76           HA       LEU  76  -4.326  -4.649  -6.445
  515   1HB   LEU  76          2HB       LEU  76  -6.238  -3.384  -5.601
  516   2HB   LEU  76          1HB       LEU  76  -5.330  -1.891  -5.723
  517    HG   LEU  76           HG       LEU  76  -5.244  -2.177  -8.187
  518   1HD1  LEU  76          1HD1      LEU  76  -5.451  -4.595  -8.284
  519   2HD1  LEU  76          2HD1      LEU  76  -6.709  -3.816  -9.243
  520   3HD1  LEU  76          3HD1      LEU  76  -7.097  -4.493  -7.662
  521   1HD2  LEU  76          1HD2      LEU  76  -7.574  -1.591  -8.586
  522   2HD2  LEU  76          2HD2      LEU  76  -6.954  -0.791  -7.142
  523   3HD2  LEU  76          3HD2      LEU  76  -8.009  -2.196  -6.987
  524    H    ALA  77           H        ALA  77  -2.644  -1.797  -5.326
  525    HA   ALA  77           HA       ALA  77  -1.572  -1.077  -7.876
  526   1HB   ALA  77          1HB       ALA  77  -0.229   0.509  -6.571
  527   2HB   ALA  77          2HB       ALA  77  -0.799  -0.241  -5.080
  528   3HB   ALA  77          3HB       ALA  77  -1.936   0.598  -6.138
  529    H    THR  78           H        THR  78   0.673  -1.199  -8.426
  530    HA   THR  78           HA       THR  78   1.830  -3.698  -7.448
  531    HB   THR  78           HB       THR  78   3.133  -3.734  -9.475
  532    HG1  THR  78           1HG      THR  78   2.013  -1.157 -10.060
  533   1HG2  THR  78          1HG2      THR  78   0.864  -4.528  -9.708
  534   2HG2  THR  78          2HG2      THR  78   1.317  -3.658 -11.177
  535   3HG2  THR  78          3HG2      THR  78   0.280  -2.885  -9.974
  536    H    ARG  79           H        ARG  79   4.430  -3.453  -7.941
  537    HA   ARG  79           HA       ARG  79   5.506  -2.306  -5.691
  538   1HB   ARG  79          2HB       ARG  79   6.851  -2.805  -8.344
  539   2HB   ARG  79          1HB       ARG  79   7.694  -2.475  -6.835
  540   1HG   ARG  79          2HG       ARG  79   6.375  -4.478  -5.915
  541   2HG   ARG  79          1HG       ARG  79   6.099  -4.873  -7.611
  542   1HD   ARG  79          2HD       ARG  79   8.355  -5.228  -8.022
  543   2HD   ARG  79          1HD       ARG  79   8.853  -4.317  -6.598
  544    HE   ARG  79           HE       ARG  79   8.402  -6.137  -5.261
  545   1HH1  ARG  79          1HH1      ARG  79   7.562  -6.757  -8.613
  546   2HH1  ARG  79          2HH1      ARG  79   7.427  -8.479  -8.410
  547   1HH2  ARG  79          1HH2      ARG  79   8.243  -8.435  -5.001
  548   2HH2  ARG  79          2HH2      ARG  79   7.827  -9.420  -6.369
  549    H    GLU  80           H        GLU  80   5.532  -0.951  -8.958
  550    HA   GLU  80           HA       GLU  80   6.939   1.358  -8.304
  551   1HB   GLU  80          2HB       GLU  80   6.065   2.257 -10.458
  552   2HB   GLU  80          1HB       GLU  80   6.814   0.673 -10.568
  553   1HG   GLU  80          2HG       GLU  80   4.488  -0.294 -10.475
  554   2HG   GLU  80          1HG       GLU  80   3.901   1.354 -10.695
  555    H    GLU  81           H        GLU  81   3.370   0.897  -8.444
  556    HA   GLU  81           HA       GLU  81   2.702   3.486  -7.629
  557   1HB   GLU  81          2HB       GLU  81   1.349   0.842  -7.231
  558   2HB   GLU  81          1HB       GLU  81   0.649   2.351  -6.679
  559   1HG   GLU  81          2HG       GLU  81  -0.368   1.917  -8.700
  560   2HG   GLU  81          1HG       GLU  81   0.831   3.140  -9.078
  561    H    GLN  82           H        GLN  82   3.147   0.534  -5.670
  562    HA   GLN  82           HA       GLN  82   2.486   1.690  -3.205
  563   1HB   GLN  82          2HB       GLN  82   4.320  -0.627  -3.814
  564   2HB   GLN  82          1HB       GLN  82   3.832  -0.169  -2.191
  565   1HG   GLN  82          2HG       GLN  82   1.431  -0.460  -3.063
  566   2HG   GLN  82          1HG       GLN  82   2.188  -1.352  -4.386
  567   1HE2  GLN  82          1HE2      GLN  82   1.388  -3.340  -3.825
  568   2HE2  GLN  82          2HE2      GLN  82   1.844  -4.176  -2.375
  569    H    ILE  83           H        ILE  83   5.553   1.329  -4.850
  570    HA   ILE  83           HA       ILE  83   7.230   2.259  -2.824
  571    HB   ILE  83           HB       ILE  83   7.467   2.184  -5.819
  572   1HG1  ILE  83          2HG1      ILE  83   9.207   0.851  -3.758
  573   2HG1  ILE  83          1HG1      ILE  83   7.683   0.136  -4.260
  574   1HG2  ILE  83          1HG2      ILE  83   9.551   3.230  -3.912
  575   2HG2  ILE  83          2HG2      ILE  83   8.675   4.173  -5.117
  576   3HG2  ILE  83          3HG2      ILE  83   9.793   2.910  -5.630
  577   1HD1  ILE  83          1HD1      ILE  83  10.031   0.762  -6.031
  578   2HD1  ILE  83          2HD1      ILE  83   8.498   0.078  -6.573
  579   3HD1  ILE  83          3HD1      ILE  83   9.531  -0.836  -5.474
  580    H    ALA  84           H        ALA  84   5.439   3.967  -5.352
  581    HA   ALA  84           HA       ALA  84   6.616   6.507  -4.938
  582   1HB   ALA  84          1HB       ALA  84   5.384   5.901  -6.971
  583   2HB   ALA  84          2HB       ALA  84   4.750   7.375  -6.238
  584   3HB   ALA  84          3HB       ALA  84   3.887   5.849  -6.043
  585    H    VAL  85           H        VAL  85   3.691   5.004  -3.669
  586    HA   VAL  85           HA       VAL  85   2.785   7.189  -2.134
  587    HB   VAL  85           HB       VAL  85   2.389   4.249  -1.616
  588   1HG1  VAL  85          1HG1      VAL  85   0.338   4.940  -0.476
  589   2HG1  VAL  85          2HG1      VAL  85   0.729   6.631  -0.787
  590   3HG1  VAL  85          3HG1      VAL  85   1.756   5.668   0.275
  591   1HG2  VAL  85          1HG2      VAL  85   0.761   6.145  -3.296
  592   2HG2  VAL  85          2HG2      VAL  85   0.325   4.479  -2.911
  593   3HG2  VAL  85          3HG2      VAL  85   1.758   4.816  -3.885
  594    H    ALA  86           H        ALA  86   4.633   4.285  -1.174
  595    HA   ALA  86           HA       ALA  86   5.230   5.020   1.434
  596   1HB   ALA  86          1HB       ALA  86   5.641   2.788   0.529
  597   2HB   ALA  86          2HB       ALA  86   7.091   3.458   1.277
  598   3HB   ALA  86          3HB       ALA  86   6.935   3.436  -0.480
  599    H    GLU  87           H        GLU  87   6.570   6.045  -1.591
  600    HA   GLU  87           HA       GLU  87   9.023   7.104  -0.732
  601   1HB   GLU  87          2HB       GLU  87   7.204   7.782  -3.020
  602   2HB   GLU  87          1HB       GLU  87   8.595   8.801  -2.688
  603   1HG   GLU  87          2HG       GLU  87   8.675   5.855  -3.290
  604   2HG   GLU  87          1HG       GLU  87   9.036   7.153  -4.426
  605    H    VAL  88           H        VAL  88   5.807   8.602  -0.898
  606    HA   VAL  88           HA       VAL  88   6.651  11.163  -0.063
  607    HB   VAL  88           HB       VAL  88   3.946   9.871   0.345
  608   1HG1  VAL  88          1HG1      VAL  88   4.300  11.788   1.820
  609   2HG1  VAL  88          2HG1      VAL  88   3.099  12.150   0.576
  610   3HG1  VAL  88          3HG1      VAL  88   4.738  12.782   0.428
  611   1HG2  VAL  88          1HG2      VAL  88   4.960  11.653  -1.874
  612   2HG2  VAL  88          2HG2      VAL  88   3.290  11.125  -1.671
  613   3HG2  VAL  88          3HG2      VAL  88   4.553   9.942  -2.009
  614    H    THR  89           H        THR  89   5.300   8.435   1.771
  615    HA   THR  89           HA       THR  89   5.421   9.913   4.200
  616    HB   THR  89           HB       THR  89   3.701   8.185   3.782
  617    HG1  THR  89           1HG      THR  89   3.559   7.959   5.881
  618   1HG2  THR  89          1HG2      THR  89   4.150   5.873   3.938
  619   2HG2  THR  89          2HG2      THR  89   5.814   6.169   4.436
  620   3HG2  THR  89          3HG2      THR  89   5.316   6.519   2.778
  621    H    ARG  90           H        ARG  90   7.572   7.539   2.660
  622    HA   ARG  90           HA       ARG  90   9.167   6.971   4.914
  623   1HB   ARG  90          2HB       ARG  90  10.867   6.144   3.428
  624   2HB   ARG  90          1HB       ARG  90   9.311   5.723   2.721
  625   1HG   ARG  90          2HG       ARG  90   9.604   7.097   0.939
  626   2HG   ARG  90          1HG       ARG  90  10.586   8.251   1.847
  627   1HD   ARG  90          2HD       ARG  90  12.465   6.739   1.817
  628   2HD   ARG  90          1HD       ARG  90  11.495   5.492   1.039
  629    HE   ARG  90           HE       ARG  90  11.455   6.845  -0.948
  630   1HH1  ARG  90          1HH1      ARG  90  13.729   7.810   1.527
  631   2HH1  ARG  90          2HH1      ARG  90  14.757   8.680   0.441
  632   1HH2  ARG  90          1HH2      ARG  90  12.770   7.974  -2.392
  633   2HH2  ARG  90          2HH2      ARG  90  14.203   8.776  -1.814
  634    H    LEU  91           H        LEU  91   9.300   9.566   2.572
  635    HA   LEU  91           HA       LEU  91  11.891  10.443   3.341
  636   1HB   LEU  91          2HB       LEU  91  11.520  12.374   1.912
  637   2HB   LEU  91          1HB       LEU  91  11.089  10.883   1.109
  638    HG   LEU  91           HG       LEU  91   8.646  11.478   1.762
  639   1HD1  LEU  91          1HD1      LEU  91   9.951  14.192   1.998
  640   2HD1  LEU  91          2HD1      LEU  91   9.149  13.308   3.296
  641   3HD1  LEU  91          3HD1      LEU  91   8.216  13.887   1.916
  642   1HD2  LEU  91          1HD2      LEU  91  10.169  13.072  -0.295
  643   2HD2  LEU  91          2HD2      LEU  91   8.420  12.844  -0.260
  644   3HD2  LEU  91          3HD2      LEU  91   9.487  11.461  -0.515
  645    H    ARG  92           H        ARG  92   8.761  11.030   4.622
  646    HA   ARG  92           HA       ARG  92   9.464  13.497   5.913
  647   1HB   ARG  92          2HB       ARG  92   7.163  11.791   6.733
  648   2HB   ARG  92          1HB       ARG  92   7.313  13.539   6.791
  649   1HG   ARG  92          2HG       ARG  92   6.765  13.796   4.581
  650   2HG   ARG  92          1HG       ARG  92   7.276  12.156   4.152
  651   1HD   ARG  92          2HD       ARG  92   4.771  13.072   5.496
  652   2HD   ARG  92          1HD       ARG  92   4.975  11.959   4.133
  653    HE   ARG  92           HE       ARG  92   6.089  10.478   5.913
  654   1HH1  ARG  92          1HH1      ARG  92   3.403  12.656   6.557
  655   2HH1  ARG  92          2HH1      ARG  92   2.787  11.706   7.877
  656   1HH2  ARG  92          1HH2      ARG  92   5.235   9.214   7.628
  657   2HH2  ARG  92          2HH2      ARG  92   3.821   9.750   8.482
  658    H    GLN  93           H        GLN  93   8.989  10.132   6.757
  659    HA   GLN  93           HA       GLN  93   9.490  10.765   9.540
  660   1HB   GLN  93          2HB       GLN  93   8.471   8.629  10.044
  661   2HB   GLN  93          1HB       GLN  93   7.454   9.552   8.941
  662   1HG   GLN  93          2HG       GLN  93   8.623   8.209   7.085
  663   2HG   GLN  93          1HG       GLN  93   9.094   7.118   8.390
  664   1HE2  GLN  93          1HE2      GLN  93   7.308   6.674   6.119
  665   2HE2  GLN  93          2HE2      GLN  93   5.786   6.213   6.793
  666    H    GLY  94           H        GLY  94  10.908   8.869   6.934
  667   1HA   GLY  94          2HA       GLY  94  13.257   8.665   6.786
  668   2HA   GLY  94          1HA       GLY  94  13.369   8.912   8.523
  669    H    TRP  95           H        TRP  95  11.287   6.678   6.790
  670    HA   TRP  95           HA       TRP  95  11.044   4.447   6.805
  671   1HB   TRP  95          2HB       TRP  95  13.911   4.126   7.681
  672   2HB   TRP  95          1HB       TRP  95  12.934   3.032   6.702
  673    HD1  TRP  95           HD       TRP  95  14.789   6.388   6.417
  674    HE1  TRP  95           1HE      TRP  95  15.413   6.755   3.965
  675    HE3  TRP  95           3HE      TRP  95  12.337   2.406   4.382
  676    HZ2  TRP  95           2HZ      TRP  95  14.919   5.523   1.471
  677    HZ3  TRP  95           3HZ      TRP  95  12.453   2.076   1.949
  678    HH2  TRP  95           HH       TRP  95  13.717   3.604   0.524
  679    H    GLY  96           H        GLY  96  11.060   6.252   9.270
  680   1HA   GLY  96          2HA       GLY  96  11.577   4.594  11.510
  681   2HA   GLY  96          1HA       GLY  96  10.603   6.054  11.510
  682    H    ALA  97           H        ALA  97   8.763   5.025   9.472
  683    HA   ALA  97           HA       ALA  97   6.936   3.669  11.174
  684   1HB   ALA  97          1HB       ALA  97   6.173   5.150   9.386
  685   2HB   ALA  97          2HB       ALA  97   5.491   3.531   9.218
  686   3HB   ALA  97          3HB       ALA  97   6.828   4.038   8.184
  687    H    TRP  98           H        TRP  98   9.272   2.688   8.785
  688    HA   TRP  98           HA       TRP  98   8.398  -0.105   8.999
  689   1HB   TRP  98          2HB       TRP  98  10.443   1.255   7.224
  690   2HB   TRP  98          1HB       TRP  98  10.069  -0.464   7.180
  691    HD1  TRP  98           HD       TRP  98   7.657  -1.173   6.215
  692    HE1  TRP  98           1HE      TRP  98   6.108  -0.020   4.522
  693    HE3  TRP  98           3HE      TRP  98   9.590   3.615   6.441
  694    HZ2  TRP  98           2HZ      TRP  98   5.750   2.571   3.414
  695    HZ3  TRP  98           3HZ      TRP  98   8.572   5.340   5.011
  696    HH2  TRP  98           HH       TRP  98   6.706   4.801   3.540
  697    HA   PRO  99           HA       PRO  99  11.443   0.012  12.260
  698   1HB   PRO  99          2HB       PRO  99  10.412  -2.660  12.929
  699   2HB   PRO  99          1HB       PRO  99  10.457  -1.190  13.897
  700   1HG   PRO  99          2HG       PRO  99   8.157  -2.072  12.903
  701   2HG   PRO  99          1HG       PRO  99   8.543  -0.337  12.940
  702   1HD   PRO  99          2HD       PRO  99   8.796  -2.256  10.632
  703   2HD   PRO  99          1HD       PRO  99   8.006  -0.659  10.675
  704    H    VAL 100           H        VAL 100  11.316  -3.453  11.874
  705    HA   VAL 100           HA       VAL 100  14.167  -3.567  11.828
  706    HB   VAL 100           HB       VAL 100  12.143  -5.776  11.395
  707   1HG1  VAL 100          1HG1      VAL 100  13.950  -7.283  12.084
  708   2HG1  VAL 100          2HG1      VAL 100  15.058  -5.914  12.155
  709   3HG1  VAL 100          3HG1      VAL 100  14.355  -6.403  10.613
  710   1HG2  VAL 100          1HG2      VAL 100  12.446  -6.285  13.766
  711   2HG2  VAL 100          2HG2      VAL 100  11.803  -4.660  13.535
  712   3HG2  VAL 100          3HG2      VAL 100  13.505  -4.886  13.934
  713    H    CYS 101           H        CYS 101  11.633  -3.651   9.510
  714    HA   CYS 101           HA       CYS 101  13.108  -5.153   7.573
  715   1HB   CYS 101          2HB       CYS 101  10.424  -3.799   7.411
  716   2HB   CYS 101          1HB       CYS 101  11.116  -4.791   6.126
  717    H    ALA 102           H        ALA 102  12.572  -1.769   8.189
  718    HA   ALA 102           HA       ALA 102  13.401  -0.875   5.614
  719   1HB   ALA 102          1HB       ALA 102  13.736   1.299   6.679
  720   2HB   ALA 102          2HB       ALA 102  13.511   0.558   8.263
  721   3HB   ALA 102          3HB       ALA 102  12.176   0.599   7.110
  722    H    ALA 103           H        ALA 103  15.072  -1.358   8.699
  723    HA   ALA 103           HA       ALA 103  17.605  -0.486   7.815
  724   1HB   ALA 103          1HB       ALA 103  18.481  -1.564   9.818
  725   2HB   ALA 103          2HB       ALA 103  16.944  -2.398  10.050
  726   3HB   ALA 103          3HB       ALA 103  17.024  -0.643  10.185
  727    H    ARG 104           H        ARG 104  16.002  -3.608   7.783
  728    HA   ARG 104           HA       ARG 104  18.263  -5.098   6.957
  729   1HB   ARG 104          2HB       ARG 104  16.850  -6.889   7.150
  730   2HB   ARG 104          1HB       ARG 104  15.926  -5.721   8.087
  731   1HG   ARG 104          2HG       ARG 104  14.254  -6.462   6.792
  732   2HG   ARG 104          1HG       ARG 104  14.880  -5.244   5.678
  733   1HD   ARG 104          2HD       ARG 104  14.471  -7.383   4.560
  734   2HD   ARG 104          1HD       ARG 104  16.186  -6.955   4.545
  735    HE   ARG 104           HE       ARG 104  16.315  -8.464   6.581
  736   1HH1  ARG 104          1HH1      ARG 104  14.048  -8.952   3.963
  737   2HH1  ARG 104          2HH1      ARG 104  13.895 -10.661   4.231
  738   1HH2  ARG 104          1HH2      ARG 104  16.114 -10.707   6.948
  739   2HH2  ARG 104          2HH2      ARG 104  15.080 -11.665   5.931
  740    H    ALA 105           H        ALA 105  16.008  -3.068   5.371
  741    HA   ALA 105           HA       ALA 105  16.470  -4.216   2.710
  742   1HB   ALA 105          1HB       ALA 105  14.706  -1.946   3.592
  743   2HB   ALA 105          2HB       ALA 105  14.202  -3.626   3.403
  744   3HB   ALA 105          3HB       ALA 105  14.732  -2.702   1.999
  745    H    GLY 106           H        GLY 106  17.465  -1.578   4.721
  746   1HA   GLY 106          2HA       GLY 106  19.537  -0.431   3.996
  747   2HA   GLY 106          1HA       GLY 106  18.787  -0.294   2.412
  748    H    ALA 107           H        ALA 107  18.012   0.499   5.793
  749    HA   ALA 107           HA       ALA 107  16.273   2.629   5.216
  750   1HB   ALA 107          1HB       ALA 107  16.467   3.205   7.570
  751   2HB   ALA 107          2HB       ALA 107  17.880   2.163   7.727
  752   3HB   ALA 107          3HB       ALA 107  16.302   1.459   7.377
  753    H    ARG 108           H        ARG 108  16.592   4.872   5.308
  754    HA   ARG 108           HA       ARG 108  19.374   5.763   5.018
  755   1HB   ARG 108          2HB       ARG 108  17.193   6.669   3.153
  756   2HB   ARG 108          1HB       ARG 108  18.930   6.853   2.966
  757   1HG   ARG 108          2HG       ARG 108  19.180   4.489   2.551
  758   2HG   ARG 108          1HG       ARG 108  17.460   4.221   2.853
  759   1HD   ARG 108          2HD       ARG 108  17.801   4.297   0.479
  760   2HD   ARG 108          1HD       ARG 108  16.964   5.784   0.963
  761    HE   ARG 108           HE       ARG 108  19.858   5.976   0.867
  762   1HH1  ARG 108          1HH1      ARG 108  16.899   6.300  -1.001
  763   2HH1  ARG 108          2HH1      ARG 108  17.602   7.438  -2.119
  764   1HH2  ARG 108          1HH2      ARG 108  20.757   7.456  -0.586
  765   2HH2  ARG 108          2HH2      ARG 108  19.803   8.099  -1.887
  Start of MODEL    3
    1   1H    ASN   1          1HT       ASN   1  12.816  -8.781  25.450
    2   2H    ASN   1          2HT       ASN   1  11.348  -8.751  24.603
    3   3H    ASN   1          3HT       ASN   1  12.785  -9.146  23.796
    4    HA   ASN   1           HA       ASN   1  11.571 -10.726  25.989
    5   1HB   ASN   1          2HB       ASN   1  11.482 -11.051  22.991
    6   2HB   ASN   1          1HB       ASN   1  11.235 -12.413  24.081
    7   1HD2  ASN   1          1HD2      ASN   1   9.115 -12.727  23.433
    8   2HD2  ASN   1          2HD2      ASN   1   7.849 -11.628  23.875
    9    H    VAL   2           H        VAL   2  12.885 -12.119  26.895
   10    HA   VAL   2           HA       VAL   2  15.629 -12.327  26.064
   11    HB   VAL   2           HB       VAL   2  14.155 -13.912  28.182
   12   1HG1  VAL   2          1HG1      VAL   2  16.366 -14.386  29.090
   13   2HG1  VAL   2          2HG1      VAL   2  17.113 -13.489  27.768
   14   3HG1  VAL   2          3HG1      VAL   2  16.228 -14.976  27.433
   15   1HG2  VAL   2          1HG2      VAL   2  15.793 -11.394  28.434
   16   2HG2  VAL   2          2HG2      VAL   2  15.150 -12.332  29.780
   17   3HG2  VAL   2          3HG2      VAL   2  14.050 -11.534  28.656
   18    H    VAL   3           H        VAL   3  12.826 -14.489  26.178
   19    HA   VAL   3           HA       VAL   3  14.118 -16.550  24.713
   20    HB   VAL   3           HB       VAL   3  11.163 -16.147  25.201
   21   1HG1  VAL   3          1HG1      VAL   3  12.710 -18.600  24.365
   22   2HG1  VAL   3          2HG1      VAL   3  11.591 -17.676  23.364
   23   3HG1  VAL   3          3HG1      VAL   3  10.992 -18.562  24.766
   24   1HG2  VAL   3          1HG2      VAL   3  13.190 -17.743  26.767
   25   2HG2  VAL   3          2HG2      VAL   3  11.446 -17.773  27.030
   26   3HG2  VAL   3          3HG2      VAL   3  12.355 -16.287  27.307
   27    H    VAL   4           H        VAL   4  14.843 -15.799  22.771
   28    HA   VAL   4           HA       VAL   4  13.268 -14.060  21.123
   29    HB   VAL   4           HB       VAL   4  15.677 -15.626  20.226
   30   1HG1  VAL   4          1HG1      VAL   4  16.024 -13.727  18.720
   31   2HG1  VAL   4          2HG1      VAL   4  14.555 -12.975  19.344
   32   3HG1  VAL   4          3HG1      VAL   4  14.459 -14.497  18.461
   33   1HG2  VAL   4          1HG2      VAL   4  16.293 -14.527  22.298
   34   2HG2  VAL   4          2HG2      VAL   4  15.635 -12.999  21.711
   35   3HG2  VAL   4          3HG2      VAL   4  17.056 -13.704  20.940
   36    H    THR   5           H        THR   5  12.259 -14.552  19.206
   37    HA   THR   5           HA       THR   5  11.485 -17.361  18.947
   38    HB   THR   5           HB       THR   5   9.564 -16.351  17.577
   39    HG1  THR   5           1HG      THR   5   9.130 -14.137  18.145
   40   1HG2  THR   5          1HG2      THR   5   9.291 -17.266  19.836
   41   2HG2  THR   5          2HG2      THR   5   8.269 -15.850  19.587
   42   3HG2  THR   5          3HG2      THR   5   9.758 -15.708  20.522
   43    HA   PRO   6           HA       PRO   6  13.713 -17.070  15.037
   44   1HB   PRO   6          2HB       PRO   6  14.084 -19.884  15.128
   45   2HB   PRO   6          1HB       PRO   6  15.270 -18.640  15.523
   46   1HG   PRO   6          2HG       PRO   6  14.171 -20.439  17.326
   47   2HG   PRO   6          1HG       PRO   6  14.964 -18.914  17.757
   48   1HD   PRO   6          2HD       PRO   6  12.052 -19.531  17.487
   49   2HD   PRO   6          1HD       PRO   6  12.880 -18.512  18.687
   50    H    ALA   7           H        ALA   7  13.476 -18.285  13.044
   51    HA   ALA   7           HA       ALA   7  10.664 -18.654  12.451
   52   1HB   ALA   7          1HB       ALA   7  13.051 -18.786  10.628
   53   2HB   ALA   7          2HB       ALA   7  12.064 -17.357  10.932
   54   3HB   ALA   7          3HB       ALA   7  11.360 -18.763  10.134
   55    H    HIS   8           H        HIS   8  10.429 -20.510  13.750
   56    HA   HIS   8           HA       HIS   8  11.412 -23.028  12.801
   57   1HB   HIS   8          2HB       HIS   8   8.989 -22.404  14.520
   58   2HB   HIS   8          1HB       HIS   8   9.646 -24.010  14.237
   59    HD1  HIS   8           1HD      HIS   8   9.420 -22.393  17.057
   60    HD2  HIS   8           2HD      HIS   8  12.826 -23.114  14.785
   61    HE1  HIS   8           1HE      HIS   8  11.379 -22.232  18.645
   62    H    GLU   9           H        GLU   9   9.068 -20.743  11.925
   63    HA   GLU   9           HA       GLU   9   7.939 -22.610   9.964
   64   1HB   GLU   9          2HB       GLU   9   5.950 -21.256   9.913
   65   2HB   GLU   9          1HB       GLU   9   6.315 -21.659  11.584
   66   1HG   GLU   9          2HG       GLU   9   7.217 -19.459  11.967
   67   2HG   GLU   9          1HG       GLU   9   6.983 -19.042  10.269
   68    H    ALA  10           H        ALA  10   8.252 -22.157   7.862
   69    HA   ALA  10           HA       ALA  10   9.046 -19.485   7.041
   70   1HB   ALA  10          1HB       ALA  10  11.170 -20.536   7.621
   71   2HB   ALA  10          2HB       ALA  10  11.055 -20.292   5.876
   72   3HB   ALA  10          3HB       ALA  10  10.797 -21.897   6.561
   73    H    VAL  11           H        VAL  11   6.885 -19.802   6.219
   74    HA   VAL  11           HA       VAL  11   6.412 -21.682   4.131
   75    HB   VAL  11           HB       VAL  11   4.829 -19.251   4.866
   76   1HG1  VAL  11          1HG1      VAL  11   4.308 -20.035   2.628
   77   2HG1  VAL  11          2HG1      VAL  11   2.970 -20.372   3.724
   78   3HG1  VAL  11          3HG1      VAL  11   4.065 -21.669   3.245
   79   1HG2  VAL  11          1HG2      VAL  11   4.994 -20.730   6.761
   80   2HG2  VAL  11          2HG2      VAL  11   4.546 -22.110   5.760
   81   3HG2  VAL  11          3HG2      VAL  11   3.370 -20.833   6.079
   82    H    VAL  12           H        VAL  12   6.661 -18.162   4.193
   83    HA   VAL  12           HA       VAL  12   6.737 -16.685   2.453
   84    HB   VAL  12           HB       VAL  12   9.362 -18.002   2.821
   85   1HG1  VAL  12          1HG1      VAL  12   8.771 -15.357   1.498
   86   2HG1  VAL  12          2HG1      VAL  12   9.472 -16.777   0.724
   87   3HG1  VAL  12          3HG1      VAL  12  10.385 -15.904   1.956
   88   1HG2  VAL  12          1HG2      VAL  12   8.408 -17.051   4.828
   89   2HG2  VAL  12          2HG2      VAL  12   8.191 -15.505   4.007
   90   3HG2  VAL  12          3HG2      VAL  12   9.815 -16.118   4.319
   91    H    ARG  13           H        ARG  13   5.436 -17.475   0.883
   92    HA   ARG  13           HA       ARG  13   6.252 -19.327  -1.080
   93   1HB   ARG  13          2HB       ARG  13   4.221 -18.771  -2.269
   94   2HB   ARG  13          1HB       ARG  13   3.873 -18.974  -0.559
   95   1HG   ARG  13          2HG       ARG  13   3.820 -16.554  -0.273
   96   2HG   ARG  13          1HG       ARG  13   4.192 -16.345  -1.985
   97   1HD   ARG  13          2HD       ARG  13   1.842 -16.059  -1.724
   98   2HD   ARG  13          1HD       ARG  13   2.101 -17.618  -2.508
   99    HE   ARG  13           HE       ARG  13   1.929 -18.397   0.011
  100   1HH1  ARG  13          1HH1      ARG  13  -0.009 -16.104  -1.770
  101   2HH1  ARG  13          2HH1      ARG  13  -1.420 -16.310  -0.776
  102   1HH2  ARG  13          1HH2      ARG  13   0.087 -18.684   1.347
  103   2HH2  ARG  13          2HH2      ARG  13  -1.365 -17.779   1.008
  104    H    VAL  14           H        VAL  14   7.740 -18.959  -2.401
  105    HA   VAL  14           HA       VAL  14   8.654 -16.409  -3.219
  106    HB   VAL  14           HB       VAL  14  10.181 -18.262  -3.002
  107   1HG1  VAL  14          1HG1      VAL  14   8.757 -20.103  -3.656
  108   2HG1  VAL  14          2HG1      VAL  14  10.239 -20.114  -4.612
  109   3HG1  VAL  14          3HG1      VAL  14   8.740 -19.515  -5.319
  110   1HG2  VAL  14          1HG2      VAL  14  10.071 -17.361  -5.853
  111   2HG2  VAL  14          2HG2      VAL  14  11.475 -18.039  -5.030
  112   3HG2  VAL  14          3HG2      VAL  14  10.817 -16.482  -4.518
  113    H    GLY  15           H        GLY  15   8.957 -15.916  -5.445
  114   1HA   GLY  15          2HA       GLY  15   6.342 -15.932  -6.758
  115   2HA   GLY  15          1HA       GLY  15   7.680 -14.840  -7.103
  116    H    THR  16           H        THR  16   9.568 -15.801  -8.084
  117    HA   THR  16           HA       THR  16  10.660 -16.805  -9.681
  118    HB   THR  16           HB       THR  16   8.848 -18.976  -8.819
  119    HG1  THR  16           1HG      THR  16  11.445 -18.126  -8.079
  120   1HG2  THR  16          1HG2      THR  16   9.732 -19.548 -11.006
  121   2HG2  THR  16          2HG2      THR  16  10.514 -20.536  -9.772
  122   3HG2  THR  16          3HG2      THR  16  11.358 -19.148 -10.459
  123    H    LYS  17           H        LYS  17   7.238 -16.687 -10.086
  124    HA   LYS  17           HA       LYS  17   7.596 -16.929 -12.970
  125   1HB   LYS  17          2HB       LYS  17   5.010 -17.316 -12.881
  126   2HB   LYS  17          1HB       LYS  17   6.138 -18.608 -12.519
  127   1HG   LYS  17          2HG       LYS  17   4.455 -18.750 -10.891
  128   2HG   LYS  17          1HG       LYS  17   5.856 -18.044 -10.086
  129   1HD   LYS  17          2HD       LYS  17   4.640 -15.810 -10.900
  130   2HD   LYS  17          1HD       LYS  17   3.226 -16.856 -10.718
  131   1HE   LYS  17          2HE       LYS  17   5.316 -16.297  -8.628
  132   2HE   LYS  17          1HE       LYS  17   3.693 -15.605  -8.672
  133   1HZ   LYS  17          1HZ       LYS  17   2.781 -17.840  -8.412
  134   2HZ   LYS  17          2HZ       LYS  17   3.813 -17.442  -7.128
  135   3HZ   LYS  17          3HZ       LYS  17   4.351 -18.490  -8.348
  136    HA   PRO  18           HA       PRO  18   6.605 -12.432 -12.334
  137   1HB   PRO  18          2HB       PRO  18   8.617 -12.251 -14.504
  138   2HB   PRO  18          1HB       PRO  18   8.470 -11.306 -13.014
  139   1HG   PRO  18          2HG       PRO  18  10.365 -13.106 -13.177
  140   2HG   PRO  18          1HG       PRO  18   9.370 -13.007 -11.705
  141   1HD   PRO  18          2HD       PRO  18   9.033 -14.884 -14.040
  142   2HD   PRO  18          1HD       PRO  18   9.184 -15.290 -12.313
  143    H    GLY  19           H        GLY  19   4.827 -12.070 -13.190
  144   1HA   GLY  19          2HA       GLY  19   4.369 -12.556 -16.068
  145   2HA   GLY  19          1HA       GLY  19   3.106 -12.579 -14.842
  146    H    THR  20           H        THR  20   3.384 -10.403 -13.436
  147    HA   THR  20           HA       THR  20   2.501  -8.316 -15.130
  148    HB   THR  20           HB       THR  20   3.399  -8.052 -12.258
  149    HG1  THR  20           1HG      THR  20   0.998  -9.095 -13.387
  150   1HG2  THR  20          1HG2      THR  20   1.367  -6.556 -13.912
  151   2HG2  THR  20          2HG2      THR  20   2.943  -5.953 -13.397
  152   3HG2  THR  20          3HG2      THR  20   1.693  -6.286 -12.199
  153    H    GLU  21           H        GLU  21   5.523  -8.976 -13.439
  154    HA   GLU  21           HA       GLU  21   7.493  -7.891 -13.256
  155   1HB   GLU  21          2HB       GLU  21   6.779  -7.818 -16.122
  156   2HB   GLU  21          1HB       GLU  21   8.292  -7.111 -15.574
  157   1HG   GLU  21          2HG       GLU  21   8.806  -9.340 -14.529
  158   2HG   GLU  21          1HG       GLU  21   7.392  -9.970 -15.374
  159    H    VAL  22           H        VAL  22   6.971  -6.207 -11.953
  160    HA   VAL  22           HA       VAL  22   6.134  -3.658 -13.104
  161    HB   VAL  22           HB       VAL  22   6.655  -4.320 -10.199
  162   1HG1  VAL  22          1HG1      VAL  22   5.274  -2.337  -9.762
  163   2HG1  VAL  22          2HG1      VAL  22   5.170  -2.042 -11.497
  164   3HG1  VAL  22          3HG1      VAL  22   6.729  -1.948 -10.678
  165   1HG2  VAL  22          1HG2      VAL  22   4.899  -5.759 -11.084
  166   2HG2  VAL  22          2HG2      VAL  22   4.042  -4.349 -11.707
  167   3HG2  VAL  22          3HG2      VAL  22   4.235  -4.567  -9.968
  168    HA   PRO  23           HA       PRO  23  10.362  -2.435 -13.555
  169   1HB   PRO  23          2HB       PRO  23   9.196   0.287 -13.499
  170   2HB   PRO  23          1HB       PRO  23  10.251  -0.459 -14.705
  171   1HG   PRO  23          2HG       PRO  23   7.662  -0.131 -15.205
  172   2HG   PRO  23          1HG       PRO  23   8.501  -1.609 -15.716
  173   1HD   PRO  23          2HD       PRO  23   6.704  -1.178 -13.381
  174   2HD   PRO  23          1HD       PRO  23   6.794  -2.555 -14.490
  175    HA   PRO  24           HA       PRO  24  11.323  -1.478  -9.352
  176   1HB   PRO  24          2HB       PRO  24  14.092  -1.475 -10.321
  177   2HB   PRO  24          1HB       PRO  24  13.347  -2.448  -9.045
  178   1HG   PRO  24          2HG       PRO  24  13.985  -3.510 -11.412
  179   2HG   PRO  24          1HG       PRO  24  12.526  -4.007 -10.531
  180   1HD   PRO  24          2HD       PRO  24  12.779  -2.099 -12.813
  181   2HD   PRO  24          1HD       PRO  24  11.585  -3.366 -12.538
  182    H    VAL  25           H        VAL  25  11.726   0.311  -8.276
  183    HA   VAL  25           HA       VAL  25  12.701   2.682  -9.677
  184    HB   VAL  25           HB       VAL  25  11.320   2.515  -6.986
  185   1HG1  VAL  25          1HG1      VAL  25  11.002   4.942  -7.256
  186   2HG1  VAL  25          2HG1      VAL  25  11.960   4.890  -8.736
  187   3HG1  VAL  25          3HG1      VAL  25  12.708   4.499  -7.188
  188   1HG2  VAL  25          1HG2      VAL  25   9.814   1.816  -8.770
  189   2HG2  VAL  25          2HG2      VAL  25  10.185   3.287  -9.671
  190   3HG2  VAL  25          3HG2      VAL  25   9.337   3.390  -8.128
  191    H    ILE  26           H        ILE  26  14.260   4.046  -8.421
  192    HA   ILE  26           HA       ILE  26  16.529   2.546  -7.896
  193    HB   ILE  26           HB       ILE  26  15.940   5.371  -7.021
  194   1HG1  ILE  26          2HG1      ILE  26  15.822   5.049  -9.438
  195   2HG1  ILE  26          1HG1      ILE  26  17.248   5.991  -9.014
  196   1HG2  ILE  26          1HG2      ILE  26  17.763   4.485  -5.690
  197   2HG2  ILE  26          2HG2      ILE  26  18.384   5.646  -6.867
  198   3HG2  ILE  26          3HG2      ILE  26  18.579   3.916  -7.147
  199   1HD1  ILE  26          1HD1      ILE  26  17.186   3.067  -9.727
  200   2HD1  ILE  26          2HD1      ILE  26  18.623   3.971  -9.251
  201   3HD1  ILE  26          3HD1      ILE  26  17.774   4.387 -10.740
  202    H    ASP  27           H        ASP  27  14.154   3.789  -5.638
  203    HA   ASP  27           HA       ASP  27  15.656   2.551  -3.458
  204   1HB   ASP  27          2HB       ASP  27  13.481   4.632  -3.385
  205   2HB   ASP  27          1HB       ASP  27  14.128   3.839  -1.953
  206    H    GLY  28           H        GLY  28  13.487   1.790  -5.587
  207   1HA   GLY  28          2HA       GLY  28  11.415   0.555  -4.063
  208   2HA   GLY  28          1HA       GLY  28  11.805   0.232  -5.752
  209    H    SER  29           H        SER  29  14.645  -0.043  -4.434
  210    HA   SER  29           HA       SER  29  14.600  -2.904  -4.196
  211   1HB   SER  29          2HB       SER  29  16.822  -1.012  -3.448
  212   2HB   SER  29          1HB       SER  29  16.969  -2.713  -3.886
  213    HG   SER  29           HG       SER  29  17.420  -0.970  -5.544
  214    H    ILE  30           H        ILE  30  14.863  -0.140  -2.112
  215    HA   ILE  30           HA       ILE  30  15.209  -1.553   0.345
  216    HB   ILE  30           HB       ILE  30  13.810   1.065   0.467
  217   1HG1  ILE  30          2HG1      ILE  30  15.275   1.488  -1.474
  218   2HG1  ILE  30          1HG1      ILE  30  15.806   2.392  -0.062
  219   1HG2  ILE  30          1HG2      ILE  30  16.265  -0.031   1.803
  220   2HG2  ILE  30          2HG2      ILE  30  14.627  -0.009   2.454
  221   3HG2  ILE  30          3HG2      ILE  30  15.490   1.506   2.185
  222   1HD1  ILE  30          1HD1      ILE  30  17.038  -0.157  -1.079
  223   2HD1  ILE  30          2HD1      ILE  30  17.577   0.769   0.323
  224   3HD1  ILE  30          3HD1      ILE  30  17.684   1.470  -1.293
  225    H    TRP  31           H        TRP  31  12.592  -0.346  -1.571
  226    HA   TRP  31           HA       TRP  31  10.530  -0.823   0.326
  227   1HB   TRP  31          2HB       TRP  31  10.476  -0.221  -2.641
  228   2HB   TRP  31          1HB       TRP  31   9.023  -0.402  -1.662
  229    HD1  TRP  31           HD       TRP  31  10.982   2.297  -2.955
  230    HE1  TRP  31           1HE      TRP  31  10.826   4.422  -1.468
  231    HE3  TRP  31           3HE      TRP  31   9.132   0.168   1.251
  232    HZ2  TRP  31           2HZ      TRP  31  10.045   5.046   1.149
  233    HZ3  TRP  31           3HZ      TRP  31   8.716   1.571   3.224
  234    HH2  TRP  31           HH       TRP  31   9.167   3.968   3.170
  235    H    ASP  32           H        ASP  32  11.946  -2.644  -2.320
  236    HA   ASP  32           HA       ASP  32   9.994  -4.728  -2.218
  237   1HB   ASP  32          2HB       ASP  32  11.171  -4.397  -4.276
  238   2HB   ASP  32          1HB       ASP  32  12.737  -4.559  -3.474
  239    H    ALA  33           H        ALA  33  13.136  -4.119  -0.713
  240    HA   ALA  33           HA       ALA  33  13.383  -6.703   0.403
  241   1HB   ALA  33          1HB       ALA  33  15.309  -5.234   0.133
  242   2HB   ALA  33          2HB       ALA  33  15.116  -5.715   1.819
  243   3HB   ALA  33          3HB       ALA  33  14.619  -4.105   1.298
  244    H    ILE  34           H        ILE  34  11.899  -3.689   1.462
  245    HA   ILE  34           HA       ILE  34  11.176  -4.566   4.066
  246    HB   ILE  34           HB       ILE  34   9.962  -2.505   2.244
  247   1HG1  ILE  34          2HG1      ILE  34  11.699  -2.280   4.713
  248   2HG1  ILE  34          1HG1      ILE  34  12.221  -2.010   3.054
  249   1HG2  ILE  34          1HG2      ILE  34   8.219  -3.297   3.745
  250   2HG2  ILE  34          2HG2      ILE  34   8.716  -1.665   4.194
  251   3HG2  ILE  34          3HG2      ILE  34   9.277  -3.047   5.134
  252   1HD1  ILE  34          1HD1      ILE  34  10.208  -0.367   4.565
  253   2HD1  ILE  34          2HD1      ILE  34  10.713  -0.101   2.895
  254   3HD1  ILE  34          3HD1      ILE  34  11.876   0.086   4.207
  255    H    ALA  35           H        ALA  35   9.417  -4.533   0.978
  256    HA   ALA  35           HA       ALA  35   7.060  -5.748   1.851
  257   1HB   ALA  35          1HB       ALA  35   7.328  -4.691  -0.342
  258   2HB   ALA  35          2HB       ALA  35   6.688  -6.330  -0.476
  259   3HB   ALA  35          3HB       ALA  35   8.384  -6.012  -0.842
  260    H    GLY  36           H        GLY  36  10.119  -7.105   0.791
  261   1HA   GLY  36          2HA       GLY  36   9.209  -9.837   0.899
  262   2HA   GLY  36          1HA       GLY  36  10.873  -9.299   0.718
  263    H    CYS  37           H        CYS  37   9.975  -7.609   3.247
  264    HA   CYS  37           HA       CYS  37  11.034  -9.567   5.126
  265   1HB   CYS  37          2HB       CYS  37  12.299  -7.616   5.227
  266   2HB   CYS  37          1HB       CYS  37  10.891  -6.578   5.040
  267    H    GLU  38           H        GLU  38   8.430  -7.124   5.018
  268    HA   GLU  38           HA       GLU  38   7.357  -8.214   7.493
  269   1HB   GLU  38          2HB       GLU  38   7.605  -5.704   6.931
  270   2HB   GLU  38          1HB       GLU  38   6.179  -5.930   5.927
  271   1HG   GLU  38          2HG       GLU  38   5.574  -5.057   8.102
  272   2HG   GLU  38          1HG       GLU  38   4.917  -6.679   7.880
  273    H    ALA  39           H        ALA  39   6.638  -8.006   4.092
  274    HA   ALA  39           HA       ALA  39   4.044  -9.234   4.516
  275   1HB   ALA  39          1HB       ALA  39   5.265  -8.211   1.969
  276   2HB   ALA  39          2HB       ALA  39   4.131  -7.335   2.997
  277   3HB   ALA  39          3HB       ALA  39   3.614  -8.799   2.162
  278    H    GLY  40           H        GLY  40   7.198 -10.128   3.870
  279   1HA   GLY  40          2HA       GLY  40   8.060 -12.273   3.570
  280   2HA   GLY  40          1HA       GLY  40   6.421 -12.865   3.299
  281    H    GLY  41           H        GLY  41   6.783 -10.138   1.575
  282   1HA   GLY  41          2HA       GLY  41   7.447  -9.670  -0.590
  283   2HA   GLY  41          1HA       GLY  41   7.888 -11.362  -0.827
  284    H    ASN  42           H        ASN  42   4.948  -9.546   0.050
  285    HA   ASN  42           HA       ASN  42   3.539 -10.800  -2.164
  286   1HB   ASN  42          2HB       ASN  42   3.308 -12.096   0.121
  287   2HB   ASN  42          1HB       ASN  42   2.218 -10.778   0.532
  288   1HD2  ASN  42          1HD2      ASN  42   1.730 -10.871  -2.615
  289   2HD2  ASN  42          2HD2      ASN  42   0.491 -12.068  -2.721
  290    H    TRP  43           H        TRP  43   3.267  -8.860  -3.149
  291    HA   TRP  43           HA       TRP  43   2.616  -6.480  -1.676
  292   1HB   TRP  43          2HB       TRP  43   2.723  -7.015  -4.646
  293   2HB   TRP  43          1HB       TRP  43   2.547  -5.424  -3.914
  294    HD1  TRP  43           HD       TRP  43   5.077  -8.358  -3.787
  295    HE1  TRP  43           1HE      TRP  43   7.462  -7.367  -3.617
  296    HE3  TRP  43           3HE      TRP  43   3.860  -3.408  -3.585
  297    HZ2  TRP  43           2HZ      TRP  43   8.648  -4.784  -3.431
  298    HZ3  TRP  43           3HZ      TRP  43   5.652  -1.741  -3.417
  299    HH2  TRP  43           HH       TRP  43   7.999  -2.414  -3.345
  300    H    ALA  44           H        ALA  44   0.896  -9.049  -2.818
  301    HA   ALA  44           HA       ALA  44  -1.585  -7.508  -3.137
  302   1HB   ALA  44          1HB       ALA  44  -2.488  -9.451  -4.300
  303   2HB   ALA  44          2HB       ALA  44  -0.984 -10.327  -4.016
  304   3HB   ALA  44          3HB       ALA  44  -0.990  -8.897  -5.051
  305    H    ILE  45           H        ILE  45  -0.184  -8.598  -0.591
  306    HA   ILE  45           HA       ILE  45  -2.015 -10.583   0.353
  307    HB   ILE  45           HB       ILE  45   0.503 -10.449   0.855
  308   1HG1  ILE  45          2HG1      ILE  45  -1.429 -10.825   3.141
  309   2HG1  ILE  45          1HG1      ILE  45  -1.080 -12.018   1.895
  310   1HG2  ILE  45          1HG2      ILE  45   0.590  -8.129   1.588
  311   2HG2  ILE  45          2HG2      ILE  45   1.117  -9.212   2.877
  312   3HG2  ILE  45          3HG2      ILE  45  -0.496  -8.500   2.928
  313   1HD1  ILE  45          1HD1      ILE  45   0.126 -12.515   3.944
  314   2HD1  ILE  45          2HD1      ILE  45   0.885 -10.924   3.893
  315   3HD1  ILE  45          3HD1      ILE  45   1.247 -12.111   2.642
  316    H    ASN  46           H        ASN  46  -3.547 -10.341   1.907
  317    HA   ASN  46           HA       ASN  46  -3.982  -7.681   3.097
  318   1HB   ASN  46          2HB       ASN  46  -6.060  -9.404   1.725
  319   2HB   ASN  46          1HB       ASN  46  -6.487  -8.163   2.891
  320   1HD2  ASN  46          1HD2      ASN  46  -4.353  -6.363   1.961
  321   2HD2  ASN  46          2HD2      ASN  46  -4.918  -5.718   0.453
  322    H    THR  47           H        THR  47  -3.052  -8.475   4.953
  323    HA   THR  47           HA       THR  47  -3.888 -10.871   6.181
  324    HB   THR  47           HB       THR  47  -2.832  -9.618   8.257
  325    HG1  THR  47           1HG      THR  47  -1.299  -8.029   7.413
  326   1HG2  THR  47          1HG2      THR  47  -0.609 -10.301   7.492
  327   2HG2  THR  47          2HG2      THR  47  -1.205 -10.413   5.836
  328   3HG2  THR  47          3HG2      THR  47  -1.813 -11.517   7.072
  329    H    GLY  48           H        GLY  48  -5.090  -7.634   6.148
  330   1HA   GLY  48          2HA       GLY  48  -7.346  -7.125   6.621
  331   2HA   GLY  48          1HA       GLY  48  -7.413  -8.529   7.684
  332    H    ASN  49           H        ASN  49  -4.667  -6.498   7.892
  333    HA   ASN  49           HA       ASN  49  -5.505  -5.821  10.609
  334   1HB   ASN  49          2HB       ASN  49  -3.151  -5.347  11.047
  335   2HB   ASN  49          1HB       ASN  49  -3.325  -6.936  10.313
  336   1HD2  ASN  49          1HD2      ASN  49  -1.004  -5.218  10.415
  337   2HD2  ASN  49          2HD2      ASN  49  -0.551  -4.914   8.770
  338    H    GLY  50           H        GLY  50  -6.114  -4.427   7.901
  339   1HA   GLY  50          2HA       GLY  50  -6.875  -2.245   7.564
  340   2HA   GLY  50          1HA       GLY  50  -5.929  -1.727   8.958
  341    H    TYR  51           H        TYR  51  -3.776  -3.530   7.572
  342    HA   TYR  51           HA       TYR  51  -2.777  -1.403   5.806
  343   1HB   TYR  51          2HB       TYR  51  -1.053  -3.543   7.065
  344   2HB   TYR  51          1HB       TYR  51  -0.549  -2.046   6.316
  345    HD1  TYR  51           1HD      TYR  51  -3.194  -0.928   8.149
  346    HD2  TYR  51           2HD      TYR  51   0.687  -2.601   8.741
  347    HE1  TYR  51           1HE      TYR  51  -3.062   0.129  10.377
  348    HE2  TYR  51           2HE      TYR  51   0.820  -1.544  10.956
  349    HH   TYR  51           HH       TYR  51  -0.171   0.372  12.144
  350    H    TYR  52           H        TYR  52  -1.649  -2.138   3.885
  351    HA   TYR  52           HA       TYR  52  -2.949  -4.598   2.950
  352   1HB   TYR  52          2HB       TYR  52  -2.544  -2.005   1.453
  353   2HB   TYR  52          1HB       TYR  52  -3.162  -3.492   0.724
  354    HD1  TYR  52           1HD      TYR  52  -5.456  -3.913   0.759
  355    HD2  TYR  52           2HD      TYR  52  -3.832  -1.143   3.545
  356    HE1  TYR  52           1HE      TYR  52  -7.724  -3.383   1.546
  357    HE2  TYR  52           2HE      TYR  52  -6.088  -0.610   4.352
  358    HH   TYR  52           HH       TYR  52  -8.418  -0.704   3.487
  359    H    GLY  53           H        GLY  53  -1.926  -5.301   0.753
  360   1HA   GLY  53          2HA       GLY  53   0.416  -6.536   1.575
  361   2HA   GLY  53          1HA       GLY  53  -0.195  -6.530  -0.067
  362    H    GLY  54           H        GLY  54   2.452  -6.656   0.419
  363   1HA   GLY  54          2HA       GLY  54   4.232  -5.745  -0.774
  364   2HA   GLY  54          1HA       GLY  54   3.327  -4.250  -0.953
  365    H    VAL  55           H        VAL  55   3.697  -2.601   0.395
  366    HA   VAL  55           HA       VAL  55   5.985  -2.838   2.165
  367    HB   VAL  55           HB       VAL  55   4.364  -0.334   1.849
  368   1HG1  VAL  55          1HG1      VAL  55   7.331  -0.777   2.105
  369   2HG1  VAL  55          2HG1      VAL  55   6.247  -0.490   3.461
  370   3HG1  VAL  55          3HG1      VAL  55   6.464   0.755   2.233
  371   1HG2  VAL  55          1HG2      VAL  55   5.694   0.251  -0.128
  372   2HG2  VAL  55          2HG2      VAL  55   4.687  -1.166  -0.423
  373   3HG2  VAL  55          3HG2      VAL  55   6.413  -1.359  -0.118
  374    H    GLN  56           H        GLN  56   2.733  -3.304   2.417
  375    HA   GLN  56           HA       GLN  56   1.383  -3.842   4.143
  376   1HB   GLN  56          2HB       GLN  56   4.081  -4.547   4.979
  377   2HB   GLN  56          1HB       GLN  56   3.006  -4.260   6.341
  378   1HG   GLN  56          2HG       GLN  56   2.340  -6.096   4.057
  379   2HG   GLN  56          1HG       GLN  56   3.122  -6.625   5.547
  380   1HE2  GLN  56          1HE2      GLN  56   0.188  -5.391   4.129
  381   2HE2  GLN  56          2HE2      GLN  56  -0.854  -5.786   5.453
  382    H    PHE  57           H        PHE  57   1.622  -1.063   3.809
  383    HA   PHE  57           HA       PHE  57   1.319  -0.285   6.613
  384   1HB   PHE  57          2HB       PHE  57   1.788   2.030   6.018
  385   2HB   PHE  57          1HB       PHE  57   3.124   0.956   5.658
  386    HD1  PHE  57           1HD      PHE  57   2.917   0.021   3.045
  387    HD2  PHE  57           2HD      PHE  57   1.495   3.735   4.571
  388    HE1  PHE  57           1HE      PHE  57   3.137   1.021   0.808
  389    HE2  PHE  57           2HE      PHE  57   1.701   4.732   2.334
  390    HZ   PHE  57           HZ       PHE  57   2.537   3.381   0.448
  391    H    ASP  58           H        ASP  58  -0.210   1.703   6.809
  392    HA   ASP  58           HA       ASP  58  -2.660   0.314   6.324
  393   1HB   ASP  58          2HB       ASP  58  -3.663   1.980   7.806
  394   2HB   ASP  58          1HB       ASP  58  -2.209   1.281   8.508
  395    H    GLN  59           H        GLN  59  -4.549   1.196   5.612
  396    HA   GLN  59           HA       GLN  59  -4.475   2.363   3.079
  397   1HB   GLN  59          2HB       GLN  59  -6.248   0.950   3.599
  398   2HB   GLN  59          1HB       GLN  59  -6.562   1.740   5.133
  399   1HG   GLN  59          2HG       GLN  59  -8.340   2.199   3.580
  400   2HG   GLN  59          1HG       GLN  59  -7.449   3.677   3.923
  401   1HE2  GLN  59          1HE2      GLN  59  -6.071   1.311   1.849
  402   2HE2  GLN  59          2HE2      GLN  59  -6.315   2.145   0.353
  403    H    GLY  60           H        GLY  60  -4.888   3.680   6.261
  404   1HA   GLY  60          2HA       GLY  60  -5.926   6.216   5.543
  405   2HA   GLY  60          1HA       GLY  60  -5.118   5.828   7.057
  406    H    THR  61           H        THR  61  -2.633   5.190   6.364
  407    HA   THR  61           HA       THR  61  -1.381   7.613   5.679
  408    HB   THR  61           HB       THR  61  -0.284   4.833   5.772
  409    HG1  THR  61           1HG      THR  61  -0.658   5.139   7.831
  410   1HG2  THR  61          1HG2      THR  61   1.914   5.888   6.068
  411   2HG2  THR  61          2HG2      THR  61   1.174   7.475   5.852
  412   3HG2  THR  61          3HG2      THR  61   1.199   6.324   4.515
  413    H    TRP  62           H        TRP  62  -2.003   4.657   3.854
  414    HA   TRP  62           HA       TRP  62  -0.680   5.260   1.481
  415   1HB   TRP  62          2HB       TRP  62  -1.692   3.079   1.945
  416   2HB   TRP  62          1HB       TRP  62  -3.291   3.814   1.963
  417    HD1  TRP  62           HD       TRP  62  -4.396   4.431  -0.370
  418    HE1  TRP  62           1HE      TRP  62  -3.932   3.607  -2.758
  419    HE3  TRP  62           3HE      TRP  62   0.209   2.370   0.390
  420    HZ2  TRP  62           2HZ      TRP  62  -1.843   2.238  -4.171
  421    HZ3  TRP  62           3HZ      TRP  62   1.382   1.335  -1.499
  422    HH2  TRP  62           HH       TRP  62   0.385   1.270  -3.730
  423    H    GLU  63           H        GLU  63  -3.986   5.934   2.508
  424    HA   GLU  63           HA       GLU  63  -4.706   7.385   0.198
  425   1HB   GLU  63          2HB       GLU  63  -6.422   6.400   1.537
  426   2HB   GLU  63          1HB       GLU  63  -5.873   7.241   2.981
  427   1HG   GLU  63          2HG       GLU  63  -6.630   9.336   2.140
  428   2HG   GLU  63          1HG       GLU  63  -6.958   8.646   0.549
  429    H    ALA  64           H        ALA  64  -3.225   8.247   3.245
  430    HA   ALA  64           HA       ALA  64  -3.615  11.038   3.144
  431   1HB   ALA  64          1HB       ALA  64  -2.949   9.898   5.188
  432   2HB   ALA  64          2HB       ALA  64  -1.794  11.168   4.778
  433   3HB   ALA  64          3HB       ALA  64  -1.397   9.478   4.463
  434    H    ASN  65           H        ASN  65  -1.018   8.964   1.908
  435    HA   ASN  65           HA       ASN  65   0.427  11.168   0.753
  436   1HB   ASN  65          2HB       ASN  65   0.663   8.265  -0.045
  437   2HB   ASN  65          1HB       ASN  65   1.883   9.526  -0.180
  438   1HD2  ASN  65          1HD2      ASN  65   1.527  10.609   2.456
  439   2HD2  ASN  65          2HD2      ASN  65   2.160   9.427   3.562
  440    H    GLY  66           H        GLY  66  -2.336   9.423  -0.004
  441   1HA   GLY  66          2HA       GLY  66  -3.838   9.768  -1.734
  442   2HA   GLY  66          1HA       GLY  66  -2.625  10.755  -2.552
  443    H    GLY  67           H        GLY  67  -2.688   7.375  -1.430
  444   1HA   GLY  67          2HA       GLY  67  -1.162   6.567  -3.727
  445   2HA   GLY  67          1HA       GLY  67  -1.716   5.537  -2.416
  446    H    LEU  68           H        LEU  68  -4.457   6.891  -3.053
  447    HA   LEU  68           HA       LEU  68  -5.552   4.665  -4.252
  448   1HB   LEU  68          2HB       LEU  68  -6.558   7.450  -3.904
  449   2HB   LEU  68          1HB       LEU  68  -7.559   6.190  -4.595
  450    HG   LEU  68           HG       LEU  68  -7.048   4.913  -2.405
  451   1HD1  LEU  68          1HD1      LEU  68  -5.308   6.313  -1.544
  452   2HD1  LEU  68          2HD1      LEU  68  -6.706   6.407  -0.475
  453   3HD1  LEU  68          3HD1      LEU  68  -6.364   7.724  -1.597
  454   1HD2  LEU  68          1HD2      LEU  68  -9.246   5.771  -3.024
  455   2HD2  LEU  68          2HD2      LEU  68  -8.809   7.358  -2.389
  456   3HD2  LEU  68          3HD2      LEU  68  -8.941   5.978  -1.300
  457    H    ARG  69           H        ARG  69  -4.239   7.553  -5.661
  458    HA   ARG  69           HA       ARG  69  -5.368   7.346  -8.239
  459   1HB   ARG  69          2HB       ARG  69  -3.452   8.737  -8.953
  460   2HB   ARG  69          1HB       ARG  69  -4.257   9.377  -7.525
  461   1HG   ARG  69          2HG       ARG  69  -2.532   8.690  -6.106
  462   2HG   ARG  69          1HG       ARG  69  -1.838   7.625  -7.329
  463   1HD   ARG  69          2HD       ARG  69  -0.539   9.691  -7.004
  464   2HD   ARG  69          1HD       ARG  69  -1.157   9.529  -8.648
  465    HE   ARG  69           HE       ARG  69  -2.712  11.129  -6.755
  466   1HH1  ARG  69          1HH1      ARG  69  -0.560  10.978  -9.526
  467   2HH1  ARG  69          2HH1      ARG  69  -0.871  12.620 -10.007
  468   1HH2  ARG  69          1HH2      ARG  69  -3.136  13.279  -7.418
  469   2HH2  ARG  69          2HH2      ARG  69  -2.321  13.928  -8.811
  470    H    TYR  70           H        TYR  70  -2.700   5.799  -6.638
  471    HA   TYR  70           HA       TYR  70  -1.649   4.536  -9.017
  472   1HB   TYR  70          2HB       TYR  70  -1.251   3.976  -6.071
  473   2HB   TYR  70          1HB       TYR  70  -0.221   3.376  -7.377
  474    HD1  TYR  70           1HD      TYR  70  -1.008   6.085  -5.164
  475    HD2  TYR  70           2HD      TYR  70   1.254   5.012  -8.587
  476    HE1  TYR  70           1HE      TYR  70   0.372   8.081  -4.856
  477    HE2  TYR  70           2HE      TYR  70   2.654   7.020  -8.298
  478    HH   TYR  70           HH       TYR  70   2.655   8.862  -5.468
  479    H    ALA  71           H        ALA  71  -3.735   4.016  -6.353
  480    HA   ALA  71           HA       ALA  71  -5.578   2.287  -7.285
  481   1HB   ALA  71          1HB       ALA  71  -3.339   0.676  -6.036
  482   2HB   ALA  71          2HB       ALA  71  -3.810   0.624  -7.735
  483   3HB   ALA  71          3HB       ALA  71  -4.928   0.062  -6.493
  484    HA   PRO  72           HA       PRO  72  -6.804   3.800  -3.324
  485   1HB   PRO  72          2HB       PRO  72  -8.903   1.805  -3.365
  486   2HB   PRO  72          1HB       PRO  72  -9.007   3.556  -3.320
  487   1HG   PRO  72          2HG       PRO  72  -9.595   2.046  -5.520
  488   2HG   PRO  72          1HG       PRO  72  -9.088   3.742  -5.576
  489   1HD   PRO  72          2HD       PRO  72  -7.600   1.310  -6.301
  490   2HD   PRO  72          1HD       PRO  72  -7.351   2.993  -6.809
  491    H    ARG  73           H        ARG  73  -5.668   0.712  -3.889
  492    HA   ARG  73           HA       ARG  73  -5.125   0.386  -1.054
  493   1HB   ARG  73          2HB       ARG  73  -5.902  -1.897  -0.944
  494   2HB   ARG  73          1HB       ARG  73  -7.232  -0.877  -1.475
  495   1HG   ARG  73          2HG       ARG  73  -6.524  -1.538  -3.845
  496   2HG   ARG  73          1HG       ARG  73  -5.606  -2.819  -3.053
  497   1HD   ARG  73          2HD       ARG  73  -8.557  -2.358  -2.638
  498   2HD   ARG  73          1HD       ARG  73  -7.901  -3.475  -3.832
  499    HE   ARG  73           HE       ARG  73  -6.759  -4.503  -1.751
  500   1HH1  ARG  73          1HH1      ARG  73  -9.932  -3.001  -1.771
  501   2HH1  ARG  73          2HH1      ARG  73 -10.583  -4.082  -0.573
  502   1HH2  ARG  73          1HH2      ARG  73  -7.630  -5.930  -0.190
  503   2HH2  ARG  73          2HH2      ARG  73  -9.284  -5.738   0.320
  504    H    ALA  74           H        ALA  74  -3.220  -0.540  -0.688
  505    HA   ALA  74           HA       ALA  74  -1.217  -0.432  -2.573
  506   1HB   ALA  74          1HB       ALA  74   0.220  -1.441  -0.916
  507   2HB   ALA  74          2HB       ALA  74  -1.177  -2.039  -0.024
  508   3HB   ALA  74          3HB       ALA  74  -0.878  -0.305  -0.134
  509    H    ASP  75           H        ASP  75  -3.308  -3.122  -1.782
  510    HA   ASP  75           HA       ASP  75  -1.541  -5.040  -3.026
  511   1HB   ASP  75          2HB       ASP  75  -3.212  -6.708  -2.452
  512   2HB   ASP  75          1HB       ASP  75  -2.850  -5.699  -1.059
  513    H    LEU  76           H        LEU  76  -3.733  -2.840  -4.136
  514    HA   LEU  76           HA       LEU  76  -4.307  -4.386  -6.561
  515   1HB   LEU  76          2HB       LEU  76  -6.194  -3.168  -5.586
  516   2HB   LEU  76          1HB       LEU  76  -5.283  -1.671  -5.647
  517    HG   LEU  76           HG       LEU  76  -5.268  -1.817  -8.126
  518   1HD1  LEU  76          1HD1      LEU  76  -6.778  -3.394  -9.227
  519   2HD1  LEU  76          2HD1      LEU  76  -7.112  -4.159  -7.674
  520   3HD1  LEU  76          3HD1      LEU  76  -5.489  -4.225  -8.357
  521   1HD2  LEU  76          1HD2      LEU  76  -6.955  -0.501  -6.932
  522   2HD2  LEU  76          2HD2      LEU  76  -8.012  -1.911  -6.878
  523   3HD2  LEU  76          3HD2      LEU  76  -7.592  -1.182  -8.428
  524    H    ALA  77           H        ALA  77  -2.537  -1.718  -5.249
  525    HA   ALA  77           HA       ALA  77  -1.439  -0.826  -7.729
  526   1HB   ALA  77          1HB       ALA  77  -0.606  -0.286  -4.880
  527   2HB   ALA  77          2HB       ALA  77  -1.714   0.694  -5.837
  528   3HB   ALA  77          3HB       ALA  77  -0.020   0.570  -6.305
  529    H    THR  78           H        THR  78   0.871  -0.919  -8.147
  530    HA   THR  78           HA       THR  78   1.870  -3.596  -7.539
  531    HB   THR  78           HB       THR  78   3.272  -3.300  -9.526
  532    HG1  THR  78           1HG      THR  78   2.255  -1.127 -10.637
  533   1HG2  THR  78          1HG2      THR  78   1.433  -3.113 -11.209
  534   2HG2  THR  78          2HG2      THR  78   0.356  -2.594  -9.906
  535   3HG2  THR  78          3HG2      THR  78   1.063  -4.211  -9.880
  536    H    ARG  79           H        ARG  79   4.469  -3.474  -7.865
  537    HA   ARG  79           HA       ARG  79   5.597  -2.499  -5.572
  538   1HB   ARG  79          2HB       ARG  79   6.943  -2.821  -8.257
  539   2HB   ARG  79          1HB       ARG  79   7.792  -2.620  -6.733
  540   1HG   ARG  79          2HG       ARG  79   6.765  -4.711  -5.925
  541   2HG   ARG  79          1HG       ARG  79   6.022  -4.921  -7.514
  542   1HD   ARG  79          2HD       ARG  79   8.091  -6.223  -7.290
  543   2HD   ARG  79          1HD       ARG  79   8.213  -5.003  -8.556
  544    HE   ARG  79           HE       ARG  79   9.226  -4.192  -5.975
  545   1HH1  ARG  79          1HH1      ARG  79   9.983  -5.655  -9.064
  546   2HH1  ARG  79          2HH1      ARG  79  11.690  -5.384  -8.924
  547   1HH2  ARG  79          1HH2      ARG  79  11.471  -3.809  -5.792
  548   2HH2  ARG  79          2HH2      ARG  79  12.542  -4.325  -7.061
  549    H    GLU  80           H        GLU  80   5.640  -0.927  -8.747
  550    HA   GLU  80           HA       GLU  80   7.201   1.266  -7.984
  551   1HB   GLU  80          2HB       GLU  80   6.588   2.265 -10.082
  552   2HB   GLU  80          1HB       GLU  80   6.815   0.540 -10.324
  553   1HG   GLU  80          2HG       GLU  80   4.363   0.247 -10.216
  554   2HG   GLU  80          1HG       GLU  80   4.195   1.999 -10.112
  555    H    GLU  81           H        GLU  81   3.714   0.796  -7.921
  556    HA   GLU  81           HA       GLU  81   3.048   3.502  -7.339
  557   1HB   GLU  81          2HB       GLU  81   1.380   1.188  -6.425
  558   2HB   GLU  81          1HB       GLU  81   0.864   2.774  -6.966
  559   1HG   GLU  81          2HG       GLU  81   2.016   0.646  -8.734
  560   2HG   GLU  81          1HG       GLU  81   0.298   0.962  -8.495
  561    H    GLN  82           H        GLN  82   3.331   0.573  -5.360
  562    HA   GLN  82           HA       GLN  82   2.751   1.765  -2.892
  563   1HB   GLN  82          2HB       GLN  82   4.515  -0.615  -3.466
  564   2HB   GLN  82          1HB       GLN  82   3.903  -0.166  -1.882
  565   1HG   GLN  82          2HG       GLN  82   1.578  -0.360  -3.016
  566   2HG   GLN  82          1HG       GLN  82   2.452  -1.321  -4.215
  567   1HE2  GLN  82          1HE2      GLN  82   1.553  -3.285  -3.691
  568   2HE2  GLN  82          2HE2      GLN  82   1.806  -4.067  -2.162
  569    H    ILE  83           H        ILE  83   5.730   1.459  -4.718
  570    HA   ILE  83           HA       ILE  83   7.512   2.404  -2.770
  571    HB   ILE  83           HB       ILE  83   7.556   2.561  -5.785
  572   1HG1  ILE  83          2HG1      ILE  83   9.474   1.075  -4.016
  573   2HG1  ILE  83          1HG1      ILE  83   7.901   0.383  -4.389
  574   1HG2  ILE  83          1HG2      ILE  83   9.896   3.299  -5.628
  575   2HG2  ILE  83          2HG2      ILE  83   9.718   3.465  -3.882
  576   3HG2  ILE  83          3HG2      ILE  83   8.781   4.494  -4.964
  577   1HD1  ILE  83          1HD1      ILE  83   8.424   0.470  -6.766
  578   2HD1  ILE  83          2HD1      ILE  83   9.637  -0.450  -5.875
  579   3HD1  ILE  83          3HD1      ILE  83   9.988   1.196  -6.399
  580    H    ALA  84           H        ALA  84   5.582   4.101  -5.229
  581    HA   ALA  84           HA       ALA  84   6.590   6.679  -4.701
  582   1HB   ALA  84          1HB       ALA  84   3.919   5.883  -5.843
  583   2HB   ALA  84          2HB       ALA  84   5.416   6.082  -6.751
  584   3HB   ALA  84          3HB       ALA  84   4.669   7.477  -5.969
  585    H    VAL  85           H        VAL  85   3.718   5.009  -3.469
  586    HA   VAL  85           HA       VAL  85   2.741   7.170  -1.924
  587    HB   VAL  85           HB       VAL  85   2.370   4.226  -1.407
  588   1HG1  VAL  85          1HG1      VAL  85   1.632   5.606   0.447
  589   2HG1  VAL  85          2HG1      VAL  85   0.234   4.933  -0.393
  590   3HG1  VAL  85          3HG1      VAL  85   0.694   6.618  -0.650
  591   1HG2  VAL  85          1HG2      VAL  85   0.336   4.421  -2.772
  592   2HG2  VAL  85          2HG2      VAL  85   1.803   4.730  -3.702
  593   3HG2  VAL  85          3HG2      VAL  85   0.789   6.076  -3.180
  594    H    ALA  86           H        ALA  86   4.624   4.285  -0.978
  595    HA   ALA  86           HA       ALA  86   5.137   5.005   1.655
  596   1HB   ALA  86          1HB       ALA  86   7.033   3.461   1.517
  597   2HB   ALA  86          2HB       ALA  86   6.872   3.426  -0.239
  598   3HB   ALA  86          3HB       ALA  86   5.585   2.780   0.777
  599    H    GLU  87           H        GLU  87   6.513   6.088  -1.337
  600    HA   GLU  87           HA       GLU  87   8.949   7.152  -0.426
  601   1HB   GLU  87          2HB       GLU  87   7.175   7.847  -2.743
  602   2HB   GLU  87          1HB       GLU  87   8.567   8.851  -2.375
  603   1HG   GLU  87          2HG       GLU  87   8.673   5.898  -2.940
  604   2HG   GLU  87          1HG       GLU  87   8.991   7.168  -4.119
  605    H    VAL  88           H        VAL  88   5.715   8.660  -0.628
  606    HA   VAL  88           HA       VAL  88   6.531  11.214   0.227
  607    HB   VAL  88           HB       VAL  88   3.865   9.841   0.674
  608   1HG1  VAL  88          1HG1      VAL  88   2.977  12.057   1.153
  609   2HG1  VAL  88          2HG1      VAL  88   4.584  12.761   0.969
  610   3HG1  VAL  88          3HG1      VAL  88   4.258  11.647   2.301
  611   1HG2  VAL  88          1HG2      VAL  88   4.452  10.155  -1.681
  612   2HG2  VAL  88          2HG2      VAL  88   4.746  11.869  -1.384
  613   3HG2  VAL  88          3HG2      VAL  88   3.120  11.210  -1.208
  614    H    THR  89           H        THR  89   5.333   8.443   2.059
  615    HA   THR  89           HA       THR  89   5.436   9.717   4.569
  616    HB   THR  89           HB       THR  89   5.542   6.746   4.010
  617    HG1  THR  89           1HG      THR  89   3.671   7.249   3.066
  618   1HG2  THR  89          1HG2      THR  89   4.214   8.132   6.315
  619   2HG2  THR  89          2HG2      THR  89   5.915   7.695   6.371
  620   3HG2  THR  89          3HG2      THR  89   4.693   6.439   6.170
  621    H    ARG  90           H        ARG  90   7.740   7.606   2.866
  622    HA   ARG  90           HA       ARG  90   9.522   7.235   4.994
  623   1HB   ARG  90          2HB       ARG  90  11.059   6.340   3.443
  624   2HB   ARG  90          1HB       ARG  90   9.468   5.922   2.836
  625   1HG   ARG  90          2HG       ARG  90   9.993   6.811   0.891
  626   2HG   ARG  90          1HG       ARG  90  10.174   8.386   1.666
  627   1HD   ARG  90          2HD       ARG  90  12.473   8.098   1.984
  628   2HD   ARG  90          1HD       ARG  90  12.380   6.354   1.726
  629    HE   ARG  90           HE       ARG  90  11.683   7.081  -0.657
  630   1HH1  ARG  90          1HH1      ARG  90  14.092   8.650   1.366
  631   2HH1  ARG  90          2HH1      ARG  90  14.970   9.299   0.012
  632   1HH2  ARG  90          1HH2      ARG  90  12.818   7.919  -2.407
  633   2HH2  ARG  90          2HH2      ARG  90  14.256   8.871  -2.146
  634    H    LEU  91           H        LEU  91   9.262   9.846   2.692
  635    HA   LEU  91           HA       LEU  91  11.821  11.001   3.062
  636   1HB   LEU  91          2HB       LEU  91   9.295  12.553   2.507
  637   2HB   LEU  91          1HB       LEU  91  10.937  13.023   2.119
  638    HG   LEU  91           HG       LEU  91   9.392  10.780   0.852
  639   1HD1  LEU  91          1HD1      LEU  91   9.402  12.197  -1.135
  640   2HD1  LEU  91          2HD1      LEU  91  10.224  13.468  -0.233
  641   3HD1  LEU  91          3HD1      LEU  91   8.585  12.990   0.211
  642   1HD2  LEU  91          1HD2      LEU  91  12.162  11.840   0.282
  643   2HD2  LEU  91          2HD2      LEU  91  11.294  10.683  -0.727
  644   3HD2  LEU  91          3HD2      LEU  91  11.753  10.247   0.918
  645    H    ARG  92           H        ARG  92   8.903  11.087   4.887
  646    HA   ARG  92           HA       ARG  92   9.525  13.542   6.238
  647   1HB   ARG  92          2HB       ARG  92   7.342  11.643   7.002
  648   2HB   ARG  92          1HB       ARG  92   7.394  13.390   7.198
  649   1HG   ARG  92          2HG       ARG  92   6.970  13.777   4.936
  650   2HG   ARG  92          1HG       ARG  92   7.385  12.118   4.490
  651   1HD   ARG  92          2HD       ARG  92   4.903  13.187   5.735
  652   2HD   ARG  92          1HD       ARG  92   5.100  12.026   4.417
  653    HE   ARG  92           HE       ARG  92   6.143  10.734   6.549
  654   1HH1  ARG  92          1HH1      ARG  92   3.050  12.249   5.879
  655   2HH1  ARG  92          2HH1      ARG  92   2.175  11.263   7.020
  656   1HH2  ARG  92          1HH2      ARG  92   4.980   9.472   8.103
  657   2HH2  ARG  92          2HH2      ARG  92   3.275   9.739   8.313
  658    H    GLN  93           H        GLN  93   9.176  10.133   7.066
  659    HA   GLN  93           HA       GLN  93  10.100  10.814   9.725
  660   1HB   GLN  93          2HB       GLN  93   8.898   9.099  10.557
  661   2HB   GLN  93          1HB       GLN  93   8.010   9.356   9.061
  662   1HG   GLN  93          2HG       GLN  93  10.190   7.315   9.376
  663   2HG   GLN  93          1HG       GLN  93   8.486   6.979   9.660
  664   1HE2  GLN  93          1HE2      GLN  93   7.057   7.052   7.896
  665   2HE2  GLN  93          2HE2      GLN  93   7.637   6.830   6.280
  666    H    GLY  94           H        GLY  94  11.229   9.053   6.934
  667   1HA   GLY  94          2HA       GLY  94  13.532   8.815   6.490
  668   2HA   GLY  94          1HA       GLY  94  13.867   9.051   8.201
  669    H    TRP  95           H        TRP  95  11.601   6.818   6.718
  670    HA   TRP  95           HA       TRP  95  11.404   4.578   6.688
  671   1HB   TRP  95          2HB       TRP  95  14.347   4.353   7.335
  672   2HB   TRP  95          1HB       TRP  95  13.318   3.155   6.554
  673    HD1  TRP  95           HD       TRP  95  15.014   6.519   5.831
  674    HE1  TRP  95           1HE      TRP  95  15.321   6.747   3.301
  675    HE3  TRP  95           3HE      TRP  95  12.448   2.360   4.357
  676    HZ2  TRP  95           2HZ      TRP  95  14.563   5.342   0.964
  677    HZ3  TRP  95           3HZ      TRP  95  12.282   1.876   1.951
  678    HH2  TRP  95           HH       TRP  95  13.318   3.338   0.291
  679    H    GLY  96           H        GLY  96  11.813   6.371   9.243
  680   1HA   GLY  96          2HA       GLY  96  12.338   4.503  11.329
  681   2HA   GLY  96          1HA       GLY  96  11.601   6.088  11.521
  682    H    ALA  97           H        ALA  97   9.508   5.291   9.502
  683    HA   ALA  97           HA       ALA  97   7.601   4.229  11.342
  684   1HB   ALA  97          1HB       ALA  97   6.031   4.317   9.473
  685   2HB   ALA  97          2HB       ALA  97   7.362   4.639   8.360
  686   3HB   ALA  97          3HB       ALA  97   6.944   5.821   9.601
  687    H    TRP  98           H        TRP  98   9.657   2.972   8.868
  688    HA   TRP  98           HA       TRP  98   8.475   0.302   9.122
  689   1HB   TRP  98          2HB       TRP  98  10.525   1.442   7.201
  690   2HB   TRP  98          1HB       TRP  98   9.970  -0.227   7.186
  691    HD1  TRP  98           HD       TRP  98   7.492  -0.697   6.317
  692    HE1  TRP  98           1HE      TRP  98   5.923   0.638   4.781
  693    HE3  TRP  98           3HE      TRP  98   9.796   3.908   6.582
  694    HZ2  TRP  98           2HZ      TRP  98   5.686   3.300   3.804
  695    HZ3  TRP  98           3HZ      TRP  98   8.817   5.773   5.304
  696    HH2  TRP  98           HH       TRP  98   6.810   5.466   3.963
  697    HA   PRO  99           HA       PRO  99  11.743   0.078  12.167
  698   1HB   PRO  99          2HB       PRO  99  10.452  -2.412  13.014
  699   2HB   PRO  99          1HB       PRO  99  10.697  -0.908  13.898
  700   1HG   PRO  99          2HG       PRO  99   8.269  -1.607  13.048
  701   2HG   PRO  99          1HG       PRO  99   8.825   0.082  13.014
  702   1HD   PRO  99          2HD       PRO  99   8.763  -1.905  10.754
  703   2HD   PRO  99          1HD       PRO  99   8.139  -0.236  10.793
  704    H    VAL 100           H        VAL 100  11.020  -3.339  11.756
  705    HA   VAL 100           HA       VAL 100  13.806  -3.915  11.773
  706    HB   VAL 100           HB       VAL 100  11.463  -5.749  11.228
  707   1HG1  VAL 100          1HG1      VAL 100  13.000  -7.560  11.861
  708   2HG1  VAL 100          2HG1      VAL 100  14.322  -6.394  11.932
  709   3HG1  VAL 100          3HG1      VAL 100  13.517  -6.721  10.397
  710   1HG2  VAL 100          1HG2      VAL 100  11.702  -6.408  13.575
  711   2HG2  VAL 100          2HG2      VAL 100  11.328  -4.692  13.417
  712   3HG2  VAL 100          3HG2      VAL 100  12.976  -5.205  13.780
  713    H    CYS 101           H        CYS 101  11.432  -3.456   9.316
  714    HA   CYS 101           HA       CYS 101  12.800  -5.104   7.383
  715   1HB   CYS 101          2HB       CYS 101  10.384  -3.319   7.135
  716   2HB   CYS 101          1HB       CYS 101  11.012  -4.318   5.823
  717    H    ALA 102           H        ALA 102  12.512  -1.624   7.972
  718    HA   ALA 102           HA       ALA 102  13.690  -0.877   5.490
  719   1HB   ALA 102          1HB       ALA 102  12.301   0.665   6.805
  720   2HB   ALA 102          2HB       ALA 102  13.885   1.343   6.426
  721   3HB   ALA 102          3HB       ALA 102  13.558   0.721   8.043
  722    H    ALA 103           H        ALA 103  14.967  -1.377   8.749
  723    HA   ALA 103           HA       ALA 103  17.616  -0.612   8.236
  724   1HB   ALA 103          1HB       ALA 103  18.201  -1.895  10.210
  725   2HB   ALA 103          2HB       ALA 103  16.651  -2.732  10.152
  726   3HB   ALA 103          3HB       ALA 103  16.707  -1.001  10.489
  727    H    ARG 104           H        ARG 104  15.943  -3.662   7.815
  728    HA   ARG 104           HA       ARG 104  18.185  -5.146   6.887
  729   1HB   ARG 104          2HB       ARG 104  15.358  -5.547   7.420
  730   2HB   ARG 104          1HB       ARG 104  15.861  -6.365   5.947
  731   1HG   ARG 104          2HG       ARG 104  15.960  -7.719   8.044
  732   2HG   ARG 104          1HG       ARG 104  17.439  -7.677   7.096
  733   1HD   ARG 104          2HD       ARG 104  17.926  -7.491   9.468
  734   2HD   ARG 104          1HD       ARG 104  18.369  -6.010   8.627
  735    HE   ARG 104           HE       ARG 104  15.863  -5.491   9.530
  736   1HH1  ARG 104          1HH1      ARG 104  18.752  -6.719  11.085
  737   2HH1  ARG 104          2HH1      ARG 104  18.420  -5.943  12.606
  738   1HH2  ARG 104          1HH2      ARG 104  15.436  -4.456  11.535
  739   2HH2  ARG 104          2HH2      ARG 104  16.553  -4.638  12.852
  740    H    ALA 105           H        ALA 105  16.152  -2.821   5.440
  741    HA   ALA 105           HA       ALA 105  16.400  -3.941   2.748
  742   1HB   ALA 105          1HB       ALA 105  14.843  -1.564   3.737
  743   2HB   ALA 105          2HB       ALA 105  14.213  -3.197   3.515
  744   3HB   ALA 105          3HB       ALA 105  14.766  -2.270   2.121
  745    H    GLY 106           H        GLY 106  17.736  -1.399   4.713
  746   1HA   GLY 106          2HA       GLY 106  19.797  -0.331   4.008
  747   2HA   GLY 106          1HA       GLY 106  19.210  -0.409   2.354
  748    H    ALA 107           H        ALA 107  18.282   0.967   5.487
  749    HA   ALA 107           HA       ALA 107  16.545   2.917   4.352
  750   1HB   ALA 107          1HB       ALA 107  17.659   2.775   7.148
  751   2HB   ALA 107          2HB       ALA 107  16.218   1.922   6.593
  752   3HB   ALA 107          3HB       ALA 107  16.245   3.685   6.618
  753    H    ARG 108           H        ARG 108  16.796   5.192   4.377
  754    HA   ARG 108           HA       ARG 108  19.374   6.315   4.868
  755   1HB   ARG 108          2HB       ARG 108  19.393   7.097   2.320
  756   2HB   ARG 108          1HB       ARG 108  20.205   5.646   2.877
  757   1HG   ARG 108          2HG       ARG 108  19.111   4.950   0.958
  758   2HG   ARG 108          1HG       ARG 108  18.031   4.419   2.256
  759   1HD   ARG 108          2HD       ARG 108  17.040   5.611   0.159
  760   2HD   ARG 108          1HD       ARG 108  16.450   6.051   1.761
  761    HE   ARG 108           HE       ARG 108  18.006   7.981   1.624
  762   1HH1  ARG 108          1HH1      ARG 108  16.809   6.486  -1.316
  763   2HH1  ARG 108          2HH1      ARG 108  17.071   7.910  -2.279
  764   1HH2  ARG 108          1HH2      ARG 108  18.328   9.844   0.356
  765   2HH2  ARG 108          2HH2      ARG 108  17.915   9.821  -1.331
  Start of MODEL    4
    1   1H    ASN   1          1HT       ASN   1 -17.083 -22.929 -24.380
    2   2H    ASN   1          2HT       ASN   1 -18.093 -21.569 -24.351
    3   3H    ASN   1          3HT       ASN   1 -16.412 -21.371 -24.375
    4    HA   ASN   1           HA       ASN   1 -18.072 -22.547 -26.519
    5   1HB   ASN   1          2HB       ASN   1 -17.690 -20.574 -27.770
    6   2HB   ASN   1          1HB       ASN   1 -18.095 -20.002 -26.156
    7   1HD2  ASN   1          1HD2      ASN   1 -15.720 -20.165 -28.610
    8   2HD2  ASN   1          2HD2      ASN   1 -14.513 -19.212 -27.812
    9    H    VAL   2           H        VAL   2 -17.043 -23.591 -28.075
   10    HA   VAL   2           HA       VAL   2 -14.680 -24.932 -27.384
   11    HB   VAL   2           HB       VAL   2 -16.001 -24.804 -30.096
   12   1HG1  VAL   2          1HG1      VAL   2 -13.749 -25.714 -30.238
   13   2HG1  VAL   2          2HG1      VAL   2 -14.939 -26.998 -30.461
   14   3HG1  VAL   2          3HG1      VAL   2 -14.100 -26.832 -28.918
   15   1HG2  VAL   2          1HG2      VAL   2 -17.551 -25.497 -28.345
   16   2HG2  VAL   2          2HG2      VAL   2 -16.408 -26.733 -27.815
   17   3HG2  VAL   2          3HG2      VAL   2 -17.154 -26.847 -29.410
   18    H    VAL   3           H        VAL   3 -15.199 -22.186 -29.549
   19    HA   VAL   3           HA       VAL   3 -12.721 -22.232 -30.824
   20    HB   VAL   3           HB       VAL   3 -14.466 -19.840 -30.226
   21   1HG1  VAL   3          1HG1      VAL   3 -12.172 -19.167 -30.750
   22   2HG1  VAL   3          2HG1      VAL   3 -13.277 -18.734 -32.053
   23   3HG1  VAL   3          3HG1      VAL   3 -12.219 -20.135 -32.224
   24   1HG2  VAL   3          1HG2      VAL   3 -14.263 -21.592 -32.673
   25   2HG2  VAL   3          2HG2      VAL   3 -15.235 -20.127 -32.542
   26   3HG2  VAL   3          3HG2      VAL   3 -15.615 -21.528 -31.540
   27    H    VAL   4           H        VAL   4 -10.840 -22.287 -29.771
   28    HA   VAL   4           HA       VAL   4 -10.441 -20.728 -27.342
   29    HB   VAL   4           HB       VAL   4  -8.354 -22.339 -28.804
   30   1HG1  VAL   4          1HG1      VAL   4  -8.609 -21.539 -25.913
   31   2HG1  VAL   4          2HG1      VAL   4  -7.504 -20.841 -27.097
   32   3HG1  VAL   4          3HG1      VAL   4  -7.317 -22.523 -26.600
   33   1HG2  VAL   4          1HG2      VAL   4  -8.911 -24.231 -27.343
   34   2HG2  VAL   4          2HG2      VAL   4 -10.251 -23.806 -28.409
   35   3HG2  VAL   4          3HG2      VAL   4 -10.287 -23.329 -26.711
   36    H    THR   5           H        THR   5  -8.931 -19.080 -27.150
   37    HA   THR   5           HA       THR   5  -8.466 -17.623 -29.628
   38    HB   THR   5           HB       THR   5  -7.750 -15.773 -28.048
   39    HG1  THR   5           1HG      THR   5  -7.363 -16.562 -26.101
   40   1HG2  THR   5          1HG2      THR   5 -10.546 -16.878 -27.746
   41   2HG2  THR   5          2HG2      THR   5  -9.982 -15.821 -29.040
   42   3HG2  THR   5          3HG2      THR   5 -10.054 -15.225 -27.382
   43    HA   PRO   6           HA       PRO   6  -4.181 -18.958 -29.361
   44   1HB   PRO   6          2HB       PRO   6  -3.790 -17.846 -31.984
   45   2HB   PRO   6          1HB       PRO   6  -3.892 -19.548 -31.523
   46   1HG   PRO   6          2HG       PRO   6  -5.764 -18.259 -33.044
   47   2HG   PRO   6          1HG       PRO   6  -6.103 -19.682 -32.043
   48   1HD   PRO   6          2HD       PRO   6  -6.586 -16.785 -31.443
   49   2HD   PRO   6          1HD       PRO   6  -7.644 -18.184 -31.146
   50    H    ALA   7           H        ALA   7  -2.168 -17.926 -29.543
   51    HA   ALA   7           HA       ALA   7  -2.140 -15.022 -29.523
   52   1HB   ALA   7          1HB       ALA   7  -1.298 -16.587 -27.097
   53   2HB   ALA   7          2HB       ALA   7  -2.754 -15.601 -27.230
   54   3HB   ALA   7          3HB       ALA   7  -1.163 -14.845 -27.319
   55    H    HIS   8           H        HIS   8  -0.852 -15.404 -31.345
   56    HA   HIS   8           HA       HIS   8   1.951 -15.870 -30.624
   57   1HB   HIS   8          2HB       HIS   8   1.094 -16.967 -32.715
   58   2HB   HIS   8          1HB       HIS   8   0.761 -15.370 -33.370
   59    HD1  HIS   8           1HD      HIS   8   3.650 -17.632 -32.460
   60    HD2  HIS   8           2HD      HIS   8   2.913 -14.044 -34.430
   61    HE1  HIS   8           1HE      HIS   8   5.802 -17.009 -33.633
   62    H    GLU   9           H        GLU   9  -0.447 -13.632 -30.894
   63    HA   GLU   9           HA       GLU   9   1.125 -11.370 -31.788
   64   1HB   GLU   9          2HB       GLU   9  -0.998 -10.119 -31.363
   65   2HB   GLU   9          1HB       GLU   9  -1.175 -11.463 -32.486
   66   1HG   GLU   9          2HG       GLU   9  -2.157 -12.835 -30.773
   67   2HG   GLU   9          1HG       GLU   9  -1.862 -11.594 -29.559
   68    H    ALA  10           H        ALA  10   1.421  -9.489 -30.573
   69    HA   ALA  10           HA       ALA  10   0.898  -9.631 -27.698
   70   1HB   ALA  10          1HB       ALA  10   3.274 -10.234 -28.012
   71   2HB   ALA  10          2HB       ALA  10   3.085  -8.700 -27.163
   72   3HB   ALA  10          3HB       ALA  10   3.530  -8.713 -28.868
   73    H    VAL  11           H        VAL  11  -0.885  -8.409 -28.623
   74    HA   VAL  11           HA       VAL  11  -0.221  -5.709 -29.459
   75    HB   VAL  11           HB       VAL  11  -2.884  -7.063 -29.511
   76   1HG1  VAL  11          1HG1      VAL  11  -3.058  -4.646 -29.488
   77   2HG1  VAL  11          2HG1      VAL  11  -3.509  -5.275 -31.073
   78   3HG1  VAL  11          3HG1      VAL  11  -1.924  -4.536 -30.837
   79   1HG2  VAL  11          1HG2      VAL  11  -1.334  -8.243 -30.957
   80   2HG2  VAL  11          2HG2      VAL  11  -0.897  -6.726 -31.743
   81   3HG2  VAL  11          3HG2      VAL  11  -2.530  -7.367 -31.912
   82    H    VAL  12           H        VAL  12  -2.855  -7.139 -27.599
   83    HA   VAL  12           HA       VAL  12  -4.332  -5.964 -26.294
   84    HB   VAL  12           HB       VAL  12  -1.906  -6.689 -24.749
   85   1HG1  VAL  12          1HG1      VAL  12  -3.260  -5.131 -23.421
   86   2HG1  VAL  12          2HG1      VAL  12  -3.338  -6.761 -22.744
   87   3HG1  VAL  12          3HG1      VAL  12  -4.682  -6.135 -23.703
   88   1HG2  VAL  12          1HG2      VAL  12  -2.903  -8.523 -25.954
   89   2HG2  VAL  12          2HG2      VAL  12  -4.481  -8.147 -25.259
   90   3HG2  VAL  12          3HG2      VAL  12  -3.176  -8.727 -24.222
   91    H    ARG  13           H        ARG  13  -4.275  -3.953 -27.269
   92    HA   ARG  13           HA       ARG  13  -2.411  -1.992 -26.259
   93   1HB   ARG  13          2HB       ARG  13  -3.326  -0.495 -27.949
   94   2HB   ARG  13          1HB       ARG  13  -2.749  -2.007 -28.633
   95   1HG   ARG  13          2HG       ARG  13  -5.229  -2.734 -28.375
   96   2HG   ARG  13          1HG       ARG  13  -5.525  -0.997 -28.331
   97   1HD   ARG  13          2HD       ARG  13  -4.314  -2.635 -30.542
   98   2HD   ARG  13          1HD       ARG  13  -5.751  -1.615 -30.599
   99    HE   ARG  13           HE       ARG  13  -2.987  -0.595 -30.378
  100   1HH1  ARG  13          1HH1      ARG  13  -6.276  -0.346 -31.576
  101   2HH1  ARG  13          2HH1      ARG  13  -6.000   1.174 -32.384
  102   1HH2  ARG  13          1HH2      ARG  13  -2.621   1.388 -31.453
  103   2HH2  ARG  13          2HH2      ARG  13  -3.920   2.165 -32.303
  104    H    VAL  14           H        VAL  14  -2.938  -1.503 -24.346
  105    HA   VAL  14           HA       VAL  14  -5.475  -0.181 -23.786
  106    HB   VAL  14           HB       VAL  14  -3.955  -1.712 -21.710
  107   1HG1  VAL  14          1HG1      VAL  14  -6.134  -1.733 -20.547
  108   2HG1  VAL  14          2HG1      VAL  14  -6.811  -0.779 -21.870
  109   3HG1  VAL  14          3HG1      VAL  14  -5.531  -0.103 -20.860
  110   1HG2  VAL  14          1HG2      VAL  14  -4.514  -3.347 -23.409
  111   2HG2  VAL  14          2HG2      VAL  14  -6.190  -2.799 -23.414
  112   3HG2  VAL  14          3HG2      VAL  14  -5.526  -3.592 -21.986
  113    H    GLY  15           H        GLY  15  -5.282   1.312 -22.001
  114   1HA   GLY  15          2HA       GLY  15  -4.094   2.834 -20.665
  115   2HA   GLY  15          1HA       GLY  15  -2.605   2.357 -21.480
  116    H    THR  16           H        THR  16  -5.732   3.766 -22.189
  117    HA   THR  16           HA       THR  16  -4.824   5.091 -24.525
  118    HB   THR  16           HB       THR  16  -7.401   5.519 -23.026
  119    HG1  THR  16           1HG      THR  16  -8.004   3.853 -24.819
  120   1HG2  THR  16          1HG2      THR  16  -6.669   5.809 -25.929
  121   2HG2  THR  16          2HG2      THR  16  -6.944   7.122 -24.787
  122   3HG2  THR  16          3HG2      THR  16  -8.275   6.057 -25.245
  123    H    LYS  17           H        LYS  17  -5.024   5.854 -21.241
  124    HA   LYS  17           HA       LYS  17  -4.192   8.587 -21.741
  125   1HB   LYS  17          2HB       LYS  17  -5.563   9.410 -19.885
  126   2HB   LYS  17          1HB       LYS  17  -6.540   8.700 -21.157
  127   1HG   LYS  17          2HG       LYS  17  -5.782   7.148 -18.709
  128   2HG   LYS  17          1HG       LYS  17  -7.191   8.206 -18.748
  129   1HD   LYS  17          2HD       LYS  17  -6.687   5.929 -20.656
  130   2HD   LYS  17          1HD       LYS  17  -7.730   5.835 -19.234
  131   1HE   LYS  17          2HE       LYS  17  -8.097   7.627 -21.635
  132   2HE   LYS  17          1HE       LYS  17  -9.054   6.204 -21.233
  133   1HZ   LYS  17          1HZ       LYS  17  -8.947   8.780 -19.767
  134   2HZ   LYS  17          2HZ       LYS  17  -9.688   7.389 -19.141
  135   3HZ   LYS  17          3HZ       LYS  17 -10.277   8.097 -20.569
  136    HA   PRO  18           HA       PRO  18  -0.978   7.023 -19.039
  137   1HB   PRO  18          2HB       PRO  18   0.326   9.571 -19.575
  138   2HB   PRO  18          1HB       PRO  18   0.832   7.944 -20.035
  139   1HG   PRO  18          2HG       PRO  18  -0.025   9.760 -21.840
  140   2HG   PRO  18          1HG       PRO  18  -0.293   8.018 -22.034
  141   1HD   PRO  18          2HD       PRO  18  -2.185  10.122 -21.045
  142   2HD   PRO  18          1HD       PRO  18  -2.483   8.788 -22.182
  143    H    GLY  19           H        GLY  19   0.308   7.953 -17.312
  144   1HA   GLY  19          2HA       GLY  19   0.318   9.997 -15.764
  145   2HA   GLY  19          1HA       GLY  19  -1.388   9.612 -15.583
  146    H    THR  20           H        THR  20  -1.141   6.857 -15.648
  147    HA   THR  20           HA       THR  20  -0.867   6.262 -12.945
  148    HB   THR  20           HB       THR  20  -0.726   4.303 -15.237
  149    HG1  THR  20           1HG      THR  20  -2.853   4.548 -15.458
  150   1HG2  THR  20          1HG2      THR  20  -1.752   4.016 -12.415
  151   2HG2  THR  20          2HG2      THR  20  -0.241   3.353 -13.037
  152   3HG2  THR  20          3HG2      THR  20  -1.782   2.769 -13.664
  153    H    GLU  21           H        GLU  21   1.458   5.997 -15.567
  154    HA   GLU  21           HA       GLU  21   3.244   4.218 -14.411
  155   1HB   GLU  21          2HB       GLU  21   4.956   5.252 -15.944
  156   2HB   GLU  21          1HB       GLU  21   3.507   4.641 -16.728
  157   1HG   GLU  21          2HG       GLU  21   3.512   7.484 -15.950
  158   2HG   GLU  21          1HG       GLU  21   4.574   7.010 -17.277
  159    H    VAL  22           H        VAL  22   4.381   4.348 -12.783
  160    HA   VAL  22           HA       VAL  22   4.936   6.834 -11.402
  161    HB   VAL  22           HB       VAL  22   5.677   3.999 -10.647
  162   1HG1  VAL  22          1HG1      VAL  22   5.887   4.908  -8.375
  163   2HG1  VAL  22          2HG1      VAL  22   5.573   6.526  -9.004
  164   3HG1  VAL  22          3HG1      VAL  22   7.027   5.656  -9.494
  165   1HG2  VAL  22          1HG2      VAL  22   3.254   4.293 -10.904
  166   2HG2  VAL  22          2HG2      VAL  22   3.308   5.650  -9.777
  167   3HG2  VAL  22          3HG2      VAL  22   3.712   4.025  -9.219
  168    HA   PRO  23           HA       PRO  23   8.981   7.388 -13.249
  169   1HB   PRO  23          2HB       PRO  23   9.483   8.726 -10.639
  170   2HB   PRO  23          1HB       PRO  23   9.752   9.323 -12.280
  171   1HG   PRO  23          2HG       PRO  23   7.692  10.184 -10.813
  172   2HG   PRO  23          1HG       PRO  23   7.545   9.940 -12.563
  173   1HD   PRO  23          2HD       PRO  23   6.523   8.291 -10.315
  174   2HD   PRO  23          1HD       PRO  23   5.815   8.579 -11.916
  175    HA   PRO  24           HA       PRO  24  11.184   3.942 -11.705
  176   1HB   PRO  24          2HB       PRO  24  13.768   4.878 -12.203
  177   2HB   PRO  24          1HB       PRO  24  12.737   4.027 -13.360
  178   1HG   PRO  24          2HG       PRO  24  13.168   6.967 -13.009
  179   2HG   PRO  24          1HG       PRO  24  13.015   6.023 -14.506
  180   1HD   PRO  24          2HD       PRO  24  10.957   7.444 -13.646
  181   2HD   PRO  24          1HD       PRO  24  10.701   5.797 -14.262
  182    H    VAL  25           H        VAL  25  11.961   3.294  -9.859
  183    HA   VAL  25           HA       VAL  25  12.805   5.298  -7.902
  184    HB   VAL  25           HB       VAL  25  10.766   4.016  -7.384
  185   1HG1  VAL  25          1HG1      VAL  25  11.283   1.938  -8.491
  186   2HG1  VAL  25          2HG1      VAL  25  10.905   1.653  -6.793
  187   3HG1  VAL  25          3HG1      VAL  25  12.581   1.626  -7.339
  188   1HG2  VAL  25          1HG2      VAL  25  12.266   4.909  -5.613
  189   2HG2  VAL  25          2HG2      VAL  25  13.006   3.311  -5.509
  190   3HG2  VAL  25          3HG2      VAL  25  11.303   3.518  -5.110
  191    H    ILE  26           H        ILE  26  14.797   5.296  -7.164
  192    HA   ILE  26           HA       ILE  26  16.673   3.249  -7.946
  193    HB   ILE  26           HB       ILE  26  17.128   5.665  -6.185
  194   1HG1  ILE  26          2HG1      ILE  26  16.342   6.370  -8.373
  195   2HG1  ILE  26          1HG1      ILE  26  18.063   6.707  -8.237
  196   1HG2  ILE  26          1HG2      ILE  26  19.493   5.367  -6.770
  197   2HG2  ILE  26          2HG2      ILE  26  19.082   3.900  -7.660
  198   3HG2  ILE  26          3HG2      ILE  26  18.847   3.967  -5.914
  199   1HD1  ILE  26          1HD1      ILE  26  18.554   4.712  -9.555
  200   2HD1  ILE  26          2HD1      ILE  26  17.510   5.833 -10.429
  201   3HD1  ILE  26          3HD1      ILE  26  16.828   4.383  -9.693
  202    H    ASP  27           H        ASP  27  14.725   3.975  -5.239
  203    HA   ASP  27           HA       ASP  27  16.343   2.330  -3.451
  204   1HB   ASP  27          2HB       ASP  27  14.199   4.307  -2.671
  205   2HB   ASP  27          1HB       ASP  27  15.353   3.505  -1.612
  206    H    GLY  28           H        GLY  28  14.136   1.761  -5.505
  207   1HA   GLY  28          2HA       GLY  28  11.935   0.718  -4.029
  208   2HA   GLY  28          1HA       GLY  28  12.338   0.339  -5.701
  209    H    SER  29           H        SER  29  15.103  -0.163  -4.348
  210    HA   SER  29           HA       SER  29  14.793  -3.016  -4.105
  211   1HB   SER  29          2HB       SER  29  17.174  -1.313  -3.396
  212   2HB   SER  29          1HB       SER  29  17.172  -3.045  -3.716
  213    HG   SER  29           HG       SER  29  16.963  -2.691  -5.828
  214    H    ILE  30           H        ILE  30  15.160  -0.277  -2.039
  215    HA   ILE  30           HA       ILE  30  15.429  -1.695   0.432
  216    HB   ILE  30           HB       ILE  30  14.176   1.005   0.497
  217   1HG1  ILE  30          2HG1      ILE  30  15.720   1.302  -1.395
  218   2HG1  ILE  30          1HG1      ILE  30  16.259   2.198   0.014
  219   1HG2  ILE  30          1HG2      ILE  30  14.858  -0.079   2.531
  220   2HG2  ILE  30          2HG2      ILE  30  15.825   1.371   2.265
  221   3HG2  ILE  30          3HG2      ILE  30  16.512  -0.220   1.937
  222   1HD1  ILE  30          1HD1      ILE  30  18.114   1.136  -1.145
  223   2HD1  ILE  30          2HD1      ILE  30  17.371  -0.446  -0.904
  224   3HD1  ILE  30          3HD1      ILE  30  17.927   0.490   0.486
  225    H    TRP  31           H        TRP  31  12.923  -0.401  -1.556
  226    HA   TRP  31           HA       TRP  31  10.801  -0.696   0.305
  227   1HB   TRP  31          2HB       TRP  31  10.877  -0.138  -2.669
  228   2HB   TRP  31          1HB       TRP  31   9.367  -0.339  -1.784
  229    HD1  TRP  31           HD       TRP  31  11.385   2.355  -2.945
  230    HE1  TRP  31           1HE      TRP  31  11.075   4.489  -1.505
  231    HE3  TRP  31           3HE      TRP  31   9.266   0.235   1.132
  232    HZ2  TRP  31           2HZ      TRP  31  10.086   5.128   1.038
  233    HZ3  TRP  31           3HZ      TRP  31   8.678   1.648   3.052
  234    HH2  TRP  31           HH       TRP  31   9.085   4.049   3.002
  235    H    ASP  32           H        ASP  32  12.134  -2.691  -2.247
  236    HA   ASP  32           HA       ASP  32  10.050  -4.633  -2.138
  237   1HB   ASP  32          2HB       ASP  32  11.304  -4.377  -4.166
  238   2HB   ASP  32          1HB       ASP  32  12.827  -4.667  -3.320
  239    H    ALA  33           H        ALA  33  13.235  -4.239  -0.632
  240    HA   ALA  33           HA       ALA  33  13.256  -6.820   0.523
  241   1HB   ALA  33          1HB       ALA  33  15.312  -5.547   0.192
  242   2HB   ALA  33          2HB       ALA  33  15.108  -6.013   1.882
  243   3HB   ALA  33          3HB       ALA  33  14.766  -4.360   1.377
  244    H    ILE  34           H        ILE  34  12.080  -3.659   1.582
  245    HA   ILE  34           HA       ILE  34  11.357  -4.415   4.219
  246    HB   ILE  34           HB       ILE  34  10.170  -2.353   2.369
  247   1HG1  ILE  34          2HG1      ILE  34  12.008  -2.113   4.764
  248   2HG1  ILE  34          1HG1      ILE  34  12.488  -1.940   3.079
  249   1HG2  ILE  34          1HG2      ILE  34   8.461  -3.002   3.953
  250   2HG2  ILE  34          2HG2      ILE  34   9.076  -1.403   4.374
  251   3HG2  ILE  34          3HG2      ILE  34   9.592  -2.818   5.294
  252   1HD1  ILE  34          1HD1      ILE  34  12.267   0.218   4.155
  253   2HD1  ILE  34          2HD1      ILE  34  10.591  -0.145   4.569
  254   3HD1  ILE  34          3HD1      ILE  34  11.064   0.030   2.880
  255    H    ALA  35           H        ALA  35   9.583  -4.448   1.158
  256    HA   ALA  35           HA       ALA  35   7.175  -5.526   2.083
  257   1HB   ALA  35          1HB       ALA  35   6.807  -6.234  -0.223
  258   2HB   ALA  35          2HB       ALA  35   8.507  -5.947  -0.589
  259   3HB   ALA  35          3HB       ALA  35   7.457  -4.597  -0.159
  260    H    GLY  36           H        GLY  36  10.228  -6.991   1.237
  261   1HA   GLY  36          2HA       GLY  36   9.257  -9.706   1.403
  262   2HA   GLY  36          1HA       GLY  36  10.933  -9.200   1.239
  263    H    CYS  37           H        CYS  37   9.591  -7.507   3.734
  264    HA   CYS  37           HA       CYS  37  10.691  -9.379   5.702
  265   1HB   CYS  37          2HB       CYS  37  11.904  -7.314   5.678
  266   2HB   CYS  37          1HB       CYS  37  10.417  -6.373   5.726
  267    H    GLU  38           H        GLU  38   8.066  -6.989   5.322
  268    HA   GLU  38           HA       GLU  38   6.730  -8.089   7.656
  269   1HB   GLU  38          2HB       GLU  38   6.197  -5.699   5.906
  270   2HB   GLU  38          1HB       GLU  38   5.013  -6.262   7.075
  271   1HG   GLU  38          2HG       GLU  38   7.822  -5.389   7.708
  272   2HG   GLU  38          1HG       GLU  38   6.362  -4.431   7.948
  273    H    ALA  39           H        ALA  39   6.461  -8.036   4.184
  274    HA   ALA  39           HA       ALA  39   3.879  -9.376   4.383
  275   1HB   ALA  39          1HB       ALA  39   3.900  -7.341   3.043
  276   2HB   ALA  39          2HB       ALA  39   3.495  -8.759   2.075
  277   3HB   ALA  39          3HB       ALA  39   5.111  -8.060   1.983
  278    H    GLY  40           H        GLY  40   7.099 -10.071   3.874
  279   1HA   GLY  40          2HA       GLY  40   8.125 -12.077   3.325
  280   2HA   GLY  40          1HA       GLY  40   6.525 -12.773   3.058
  281    H    GLY  41           H        GLY  41   7.180  -9.807   1.604
  282   1HA   GLY  41          2HA       GLY  41   7.488  -9.137  -0.530
  283   2HA   GLY  41          1HA       GLY  41   8.097 -10.745  -0.929
  284    H    ASN  42           H        ASN  42   5.037  -9.170   0.007
  285    HA   ASN  42           HA       ASN  42   3.689 -10.470  -2.216
  286   1HB   ASN  42          2HB       ASN  42   3.582 -11.919  -0.026
  287   2HB   ASN  42          1HB       ASN  42   2.424 -10.702   0.501
  288   1HD2  ASN  42          1HD2      ASN  42   0.430 -10.570  -0.511
  289   2HD2  ASN  42          2HD2      ASN  42  -0.160 -11.802  -1.578
  290    H    TRP  43           H        TRP  43   3.037  -8.650  -3.164
  291    HA   TRP  43           HA       TRP  43   2.481  -6.318  -1.536
  292   1HB   TRP  43          2HB       TRP  43   2.568  -6.657  -4.535
  293   2HB   TRP  43          1HB       TRP  43   2.420  -5.122  -3.676
  294    HD1  TRP  43           HD       TRP  43   4.889  -8.123  -3.712
  295    HE1  TRP  43           1HE      TRP  43   7.300  -7.214  -3.483
  296    HE3  TRP  43           3HE      TRP  43   3.832  -3.146  -3.279
  297    HZ2  TRP  43           2HZ      TRP  43   8.577  -4.687  -3.170
  298    HZ3  TRP  43           3HZ      TRP  43   5.679  -1.554  -3.027
  299    HH2  TRP  43           HH       TRP  43   8.001  -2.311  -2.977
  300    H    ALA  44           H        ALA  44   0.776  -8.841  -2.595
  301    HA   ALA  44           HA       ALA  44  -1.744  -7.339  -2.786
  302   1HB   ALA  44          1HB       ALA  44  -2.671  -9.268  -3.948
  303   2HB   ALA  44          2HB       ALA  44  -1.143 -10.129  -3.761
  304   3HB   ALA  44          3HB       ALA  44  -1.221  -8.681  -4.765
  305    H    ILE  45           H        ILE  45  -0.118  -8.436  -0.396
  306    HA   ILE  45           HA       ILE  45  -1.813 -10.447   0.708
  307    HB   ILE  45           HB       ILE  45   0.699 -10.213   1.101
  308   1HG1  ILE  45          2HG1      ILE  45  -1.120 -10.476   3.487
  309   2HG1  ILE  45          1HG1      ILE  45  -0.736 -11.750   2.337
  310   1HG2  ILE  45          1HG2      ILE  45  -0.230  -8.133   3.074
  311   2HG2  ILE  45          2HG2      ILE  45   0.780  -7.850   1.656
  312   3HG2  ILE  45          3HG2      ILE  45   1.392  -8.820   2.995
  313   1HD1  ILE  45          1HD1      ILE  45   0.551 -12.033   4.352
  314   2HD1  ILE  45          2HD1      ILE  45   1.187 -10.396   4.206
  315   3HD1  ILE  45          3HD1      ILE  45   1.621 -11.619   3.012
  316    H    ASN  46           H        ASN  46  -3.368 -10.218   2.207
  317    HA   ASN  46           HA       ASN  46  -3.739  -7.929   3.827
  318   1HB   ASN  46          2HB       ASN  46  -4.486  -6.866   1.737
  319   2HB   ASN  46          1HB       ASN  46  -5.666  -8.154   1.500
  320   1HD2  ASN  46          1HD2      ASN  46  -7.436  -6.814   1.565
  321   2HD2  ASN  46          2HD2      ASN  46  -7.955  -6.018   3.013
  322    H    THR  47           H        THR  47  -4.184  -9.172   5.517
  323    HA   THR  47           HA       THR  47  -6.036 -11.358   5.352
  324    HB   THR  47           HB       THR  47  -5.654 -11.453   7.854
  325    HG1  THR  47           1HG      THR  47  -4.689  -9.800   8.733
  326   1HG2  THR  47          1HG2      THR  47  -4.362 -12.850   6.338
  327   2HG2  THR  47          2HG2      THR  47  -3.330 -12.263   7.641
  328   3HG2  THR  47          3HG2      THR  47  -3.237 -11.525   6.042
  329    H    GLY  48           H        GLY  48  -6.326  -8.040   5.686
  330   1HA   GLY  48          2HA       GLY  48  -8.463  -6.974   5.893
  331   2HA   GLY  48          1HA       GLY  48  -8.984  -8.303   6.921
  332    H    ASN  49           H        ASN  49  -5.844  -7.030   7.394
  333    HA   ASN  49           HA       ASN  49  -6.535  -6.210  10.069
  334   1HB   ASN  49          2HB       ASN  49  -4.100  -5.820  10.334
  335   2HB   ASN  49          1HB       ASN  49  -4.462  -7.437   9.733
  336   1HD2  ASN  49          1HD2      ASN  49  -3.853  -8.012   7.669
  337   2HD2  ASN  49          2HD2      ASN  49  -2.812  -7.021   6.698
  338    H    GLY  50           H        GLY  50  -6.611  -4.697   7.128
  339   1HA   GLY  50          2HA       GLY  50  -7.442  -2.494   6.887
  340   2HA   GLY  50          1HA       GLY  50  -6.716  -2.085   8.437
  341    H    TYR  51           H        TYR  51  -4.297  -3.692   7.269
  342    HA   TYR  51           HA       TYR  51  -3.233  -1.458   5.684
  343   1HB   TYR  51          2HB       TYR  51  -1.496  -3.472   7.116
  344   2HB   TYR  51          1HB       TYR  51  -1.039  -1.918   6.461
  345    HD1  TYR  51           1HD      TYR  51  -3.982  -1.123   7.997
  346    HD2  TYR  51           2HD      TYR  51  -0.045  -2.387   9.004
  347    HE1  TYR  51           1HE      TYR  51  -4.229  -0.125  10.231
  348    HE2  TYR  51           2HE      TYR  51  -0.287  -1.385  11.237
  349    HH   TYR  51           HH       TYR  51  -3.209  -0.490  12.536
  350    H    TYR  52           H        TYR  52  -1.774  -2.095   3.926
  351    HA   TYR  52           HA       TYR  52  -2.942  -4.521   2.751
  352   1HB   TYR  52          2HB       TYR  52  -2.405  -1.877   1.408
  353   2HB   TYR  52          1HB       TYR  52  -3.023  -3.319   0.601
  354    HD1  TYR  52           1HD      TYR  52  -3.762  -0.908   3.315
  355    HD2  TYR  52           2HD      TYR  52  -5.334  -3.778   0.606
  356    HE1  TYR  52           1HE      TYR  52  -6.027  -0.270   3.982
  357    HE2  TYR  52           2HE      TYR  52  -7.625  -3.146   1.258
  358    HH   TYR  52           HH       TYR  52  -8.799  -2.098   3.103
  359    H    GLY  53           H        GLY  53  -1.754  -5.074   0.606
  360   1HA   GLY  53          2HA       GLY  53   0.516  -6.343   1.587
  361   2HA   GLY  53          1HA       GLY  53   0.003  -6.333  -0.086
  362    H    GLY  54           H        GLY  54   2.555  -6.538   0.371
  363   1HA   GLY  54          2HA       GLY  54   4.392  -5.635  -0.724
  364   2HA   GLY  54          1HA       GLY  54   3.559  -4.088  -0.811
  365    H    VAL  55           H        VAL  55   4.164  -2.541   0.545
  366    HA   VAL  55           HA       VAL  55   6.171  -3.157   2.533
  367    HB   VAL  55           HB       VAL  55   5.951  -0.587   2.935
  368   1HG1  VAL  55          1HG1      VAL  55   7.898  -1.713   1.991
  369   2HG1  VAL  55          2HG1      VAL  55   7.573  -0.211   1.126
  370   3HG1  VAL  55          3HG1      VAL  55   7.120  -1.758   0.410
  371   1HG2  VAL  55          1HG2      VAL  55   5.210   0.680   1.034
  372   2HG2  VAL  55          2HG2      VAL  55   3.893  -0.370   1.555
  373   3HG2  VAL  55          3HG2      VAL  55   4.853  -0.794   0.138
  374    H    GLN  56           H        GLN  56   2.933  -3.210   2.453
  375    HA   GLN  56           HA       GLN  56   1.435  -3.799   4.036
  376   1HB   GLN  56          2HB       GLN  56   3.346  -5.281   4.632
  377   2HB   GLN  56          1HB       GLN  56   3.846  -4.095   5.822
  378   1HG   GLN  56          2HG       GLN  56   2.707  -5.695   7.049
  379   2HG   GLN  56          1HG       GLN  56   1.540  -4.394   6.845
  380   1HE2  GLN  56          1HE2      GLN  56   0.883  -5.065   4.104
  381   2HE2  GLN  56          2HE2      GLN  56  -0.051  -6.515   4.169
  382    H    PHE  57           H        PHE  57   1.448  -1.078   3.788
  383    HA   PHE  57           HA       PHE  57   1.054  -0.367   6.595
  384   1HB   PHE  57          2HB       PHE  57   1.428   1.977   6.116
  385   2HB   PHE  57          1HB       PHE  57   2.846   1.001   5.808
  386    HD1  PHE  57           1HD      PHE  57   1.416   3.811   4.802
  387    HD2  PHE  57           2HD      PHE  57   2.594   0.105   3.082
  388    HE1  PHE  57           1HE      PHE  57   1.732   4.926   2.635
  389    HE2  PHE  57           2HE      PHE  57   2.904   1.212   0.909
  390    HZ   PHE  57           HZ       PHE  57   2.498   3.633   0.677
  391    H    ASP  58           H        ASP  58  -0.507   1.642   6.742
  392    HA   ASP  58           HA       ASP  58  -2.922   0.193   6.228
  393   1HB   ASP  58          2HB       ASP  58  -3.962   1.791   7.748
  394   2HB   ASP  58          1HB       ASP  58  -2.476   1.135   8.426
  395    H    GLN  59           H        GLN  59  -4.942   1.288   5.713
  396    HA   GLN  59           HA       GLN  59  -4.944   2.439   3.176
  397   1HB   GLN  59          2HB       GLN  59  -6.846   1.233   3.954
  398   2HB   GLN  59          1HB       GLN  59  -7.002   2.252   5.371
  399   1HG   GLN  59          2HG       GLN  59  -8.713   2.713   3.706
  400   2HG   GLN  59          1HG       GLN  59  -7.675   4.106   3.987
  401   1HE2  GLN  59          1HE2      GLN  59  -6.572   1.415   2.127
  402   2HE2  GLN  59          2HE2      GLN  59  -6.617   2.180   0.572
  403    H    GLY  60           H        GLY  60  -5.083   3.843   6.376
  404   1HA   GLY  60          2HA       GLY  60  -5.977   6.420   5.608
  405   2HA   GLY  60          1HA       GLY  60  -5.183   6.017   7.126
  406    H    THR  61           H        THR  61  -2.765   5.200   6.444
  407    HA   THR  61           HA       THR  61  -1.355   7.524   5.716
  408    HB   THR  61           HB       THR  61  -0.429   4.686   5.853
  409    HG1  THR  61           1HG      THR  61  -0.842   5.031   7.900
  410   1HG2  THR  61          1HG2      THR  61   1.818   5.638   6.201
  411   2HG2  THR  61          2HG2      THR  61   1.161   7.249   5.921
  412   3HG2  THR  61          3HG2      THR  61   1.168   6.061   4.619
  413    H    TRP  62           H        TRP  62  -2.142   4.576   3.920
  414    HA   TRP  62           HA       TRP  62  -0.735   5.080   1.568
  415   1HB   TRP  62          2HB       TRP  62  -1.861   2.961   2.024
  416   2HB   TRP  62          1HB       TRP  62  -3.421   3.776   2.023
  417    HD1  TRP  62           HD       TRP  62  -4.559   4.261  -0.263
  418    HE1  TRP  62           1HE      TRP  62  -4.090   3.475  -2.661
  419    HE3  TRP  62           3HE      TRP  62   0.127   2.362   0.423
  420    HZ2  TRP  62           2HZ      TRP  62  -1.978   2.198  -4.122
  421    HZ3  TRP  62           3HZ      TRP  62   1.305   1.384  -1.489
  422    HH2  TRP  62           HH       TRP  62   0.295   1.297  -3.706
  423    H    GLU  63           H        GLU  63  -3.996   5.963   2.535
  424    HA   GLU  63           HA       GLU  63  -4.664   7.375   0.195
  425   1HB   GLU  63          2HB       GLU  63  -6.398   6.532   1.581
  426   2HB   GLU  63          1HB       GLU  63  -5.769   7.349   3.003
  427   1HG   GLU  63          2HG       GLU  63  -6.319   9.519   1.919
  428   2HG   GLU  63          1HG       GLU  63  -7.081   8.617   0.607
  429    H    ALA  64           H        ALA  64  -3.116   8.273   3.208
  430    HA   ALA  64           HA       ALA  64  -3.447  11.076   3.017
  431   1HB   ALA  64          1HB       ALA  64  -2.873   9.975   5.118
  432   2HB   ALA  64          2HB       ALA  64  -1.690  11.221   4.713
  433   3HB   ALA  64          3HB       ALA  64  -1.301   9.519   4.458
  434    H    ASN  65           H        ASN  65  -0.827   8.922   1.964
  435    HA   ASN  65           HA       ASN  65   0.634  11.118   0.809
  436   1HB   ASN  65          2HB       ASN  65   1.078   8.132   0.560
  437   2HB   ASN  65          1HB       ASN  65   2.197   9.382   0.024
  438   1HD2  ASN  65          1HD2      ASN  65   0.840   7.735   2.769
  439   2HD2  ASN  65          2HD2      ASN  65   1.986   8.329   3.931
  440    H    GLY  66           H        GLY  66  -2.001   9.233  -0.122
  441   1HA   GLY  66          2HA       GLY  66  -3.329   9.807  -1.972
  442   2HA   GLY  66          1HA       GLY  66  -1.919  10.524  -2.739
  443    H    GLY  67           H        GLY  67  -2.630   7.255  -1.477
  444   1HA   GLY  67          2HA       GLY  67  -1.233   6.089  -3.700
  445   2HA   GLY  67          1HA       GLY  67  -1.968   5.235  -2.354
  446    H    LEU  68           H        LEU  68  -4.541   6.708  -2.853
  447    HA   LEU  68           HA       LEU  68  -5.793   4.624  -4.128
  448   1HB   LEU  68          2HB       LEU  68  -6.692   7.417  -3.549
  449   2HB   LEU  68          1HB       LEU  68  -7.758   6.239  -4.288
  450    HG   LEU  68           HG       LEU  68  -7.248   4.784  -2.244
  451   1HD1  LEU  68          1HD1      LEU  68  -6.336   7.447  -1.207
  452   2HD1  LEU  68          2HD1      LEU  68  -5.361   5.987  -1.380
  453   3HD1  LEU  68          3HD1      LEU  68  -6.684   6.031  -0.216
  454   1HD2  LEU  68          1HD2      LEU  68  -8.817   7.336  -1.930
  455   2HD2  LEU  68          2HD2      LEU  68  -8.998   5.887  -0.940
  456   3HD2  LEU  68          3HD2      LEU  68  -9.402   5.839  -2.656
  457    H    ARG  69           H        ARG  69  -4.328   7.421  -5.468
  458    HA   ARG  69           HA       ARG  69  -5.704   7.480  -7.937
  459   1HB   ARG  69          2HB       ARG  69  -3.862   8.840  -8.744
  460   2HB   ARG  69          1HB       ARG  69  -4.341   9.368  -7.138
  461   1HG   ARG  69          2HG       ARG  69  -2.439   8.534  -6.145
  462   2HG   ARG  69          1HG       ARG  69  -2.134   7.397  -7.460
  463   1HD   ARG  69          2HD       ARG  69  -1.779  10.398  -7.524
  464   2HD   ARG  69          1HD       ARG  69  -0.507   9.171  -7.534
  465    HE   ARG  69           HE       ARG  69  -2.462   9.348  -9.736
  466   1HH1  ARG  69          1HH1      ARG  69   0.869   9.409  -8.613
  467   2HH1  ARG  69          2HH1      ARG  69   1.533   9.317 -10.219
  468   1HH2  ARG  69          1HH2      ARG  69  -1.599   9.235 -11.807
  469   2HH2  ARG  69          2HH2      ARG  69   0.126   9.204 -12.039
  470    H    TYR  70           H        TYR  70  -3.006   5.667  -6.674
  471    HA   TYR  70           HA       TYR  70  -2.318   4.489  -9.237
  472   1HB   TYR  70          2HB       TYR  70  -1.546   3.724  -6.416
  473   2HB   TYR  70          1HB       TYR  70  -0.720   3.222  -7.890
  474    HD1  TYR  70           1HD      TYR  70   0.578   4.944  -9.184
  475    HD2  TYR  70           2HD      TYR  70  -1.075   5.736  -5.340
  476    HE1  TYR  70           1HE      TYR  70   2.066   6.885  -8.946
  477    HE2  TYR  70           2HE      TYR  70   0.400   7.669  -5.099
  478    HH   TYR  70           HH       TYR  70   2.507   8.527  -5.988
  479    H    ALA  71           H        ALA  71  -4.033   3.926  -6.317
  480    HA   ALA  71           HA       ALA  71  -5.943   2.140  -7.096
  481   1HB   ALA  71          1HB       ALA  71  -3.500   0.694  -6.043
  482   2HB   ALA  71          2HB       ALA  71  -4.183   0.532  -7.660
  483   3HB   ALA  71          3HB       ALA  71  -5.094  -0.028  -6.259
  484    HA   PRO  72           HA       PRO  72  -6.909   3.729  -3.089
  485   1HB   PRO  72          2HB       PRO  72  -8.964   1.686  -2.974
  486   2HB   PRO  72          1HB       PRO  72  -9.103   3.436  -2.932
  487   1HG   PRO  72          2HG       PRO  72  -9.802   1.904  -5.076
  488   2HG   PRO  72          1HG       PRO  72  -9.327   3.611  -5.174
  489   1HD   PRO  72          2HD       PRO  72  -7.848   1.198  -5.982
  490   2HD   PRO  72          1HD       PRO  72  -7.666   2.881  -6.517
  491    H    ARG  73           H        ARG  73  -5.763   0.635  -3.699
  492    HA   ARG  73           HA       ARG  73  -5.005   0.386  -0.914
  493   1HB   ARG  73          2HB       ARG  73  -5.812  -1.833  -0.586
  494   2HB   ARG  73          1HB       ARG  73  -7.169  -0.862  -1.139
  495   1HG   ARG  73          2HG       ARG  73  -6.935  -1.769  -3.375
  496   2HG   ARG  73          1HG       ARG  73  -5.532  -2.703  -2.855
  497   1HD   ARG  73          2HD       ARG  73  -6.917  -3.940  -1.282
  498   2HD   ARG  73          1HD       ARG  73  -8.315  -2.976  -1.746
  499    HE   ARG  73           HE       ARG  73  -7.012  -5.062  -3.339
  500   1HH1  ARG  73          1HH1      ARG  73  -9.578  -2.697  -2.957
  501   2HH1  ARG  73          2HH1      ARG  73 -10.530  -3.327  -4.271
  502   1HH2  ARG  73          1HH2      ARG  73  -8.263  -5.904  -5.055
  503   2HH2  ARG  73          2HH2      ARG  73  -9.768  -5.131  -5.488
  504    H    ALA  74           H        ALA  74  -3.104  -0.576  -0.643
  505    HA   ALA  74           HA       ALA  74  -1.252  -0.692  -2.681
  506   1HB   ALA  74          1HB       ALA  74   0.272  -1.562  -1.068
  507   2HB   ALA  74          2HB       ALA  74  -1.050  -2.150  -0.060
  508   3HB   ALA  74          3HB       ALA  74  -0.793  -0.415  -0.254
  509    H    ASP  75           H        ASP  75  -3.469  -3.184  -1.706
  510    HA   ASP  75           HA       ASP  75  -1.881  -5.330  -2.764
  511   1HB   ASP  75          2HB       ASP  75  -3.212  -6.370  -1.332
  512   2HB   ASP  75          1HB       ASP  75  -4.413  -5.082  -1.341
  513    H    LEU  76           H        LEU  76  -4.130  -3.078  -4.004
  514    HA   LEU  76           HA       LEU  76  -4.531  -4.533  -6.484
  515   1HB   LEU  76          2HB       LEU  76  -6.353  -3.178  -5.502
  516   2HB   LEU  76          1HB       LEU  76  -5.363  -1.742  -5.674
  517    HG   LEU  76           HG       LEU  76  -5.389  -2.035  -8.125
  518   1HD1  LEU  76          1HD1      LEU  76  -7.304  -4.281  -7.511
  519   2HD1  LEU  76          2HD1      LEU  76  -5.701  -4.438  -8.227
  520   3HD1  LEU  76          3HD1      LEU  76  -6.984  -3.617  -9.113
  521   1HD2  LEU  76          1HD2      LEU  76  -7.011  -0.588  -7.001
  522   2HD2  LEU  76          2HD2      LEU  76  -8.120  -1.951  -6.851
  523   3HD2  LEU  76          3HD2      LEU  76  -7.693  -1.333  -8.447
  524    H    ALA  77           H        ALA  77  -2.716  -1.858  -5.163
  525    HA   ALA  77           HA       ALA  77  -1.492  -1.100  -7.626
  526   1HB   ALA  77          1HB       ALA  77  -1.858   0.478  -5.797
  527   2HB   ALA  77          2HB       ALA  77  -0.146   0.355  -6.205
  528   3HB   ALA  77          3HB       ALA  77  -0.772  -0.458  -4.771
  529    H    THR  78           H        THR  78   0.819  -1.241  -8.008
  530    HA   THR  78           HA       THR  78   1.868  -3.841  -7.151
  531    HB   THR  78           HB       THR  78   3.264  -3.780  -9.131
  532    HG1  THR  78           1HG      THR  78   2.101  -1.194  -9.601
  533   1HG2  THR  78          1HG2      THR  78   0.407  -2.974  -9.664
  534   2HG2  THR  78          2HG2      THR  78   1.013  -4.614  -9.422
  535   3HG2  THR  78          3HG2      THR  78   1.482  -3.701 -10.859
  536    H    ARG  79           H        ARG  79   4.514  -3.625  -7.606
  537    HA   ARG  79           HA       ARG  79   5.570  -2.663  -5.252
  538   1HB   ARG  79          2HB       ARG  79   6.965  -2.885  -7.931
  539   2HB   ARG  79          1HB       ARG  79   7.784  -2.672  -6.393
  540   1HG   ARG  79          2HG       ARG  79   6.858  -4.822  -5.634
  541   2HG   ARG  79          1HG       ARG  79   6.119  -5.032  -7.222
  542   1HD   ARG  79          2HD       ARG  79   8.225  -6.256  -7.067
  543   2HD   ARG  79          1HD       ARG  79   8.322  -4.972  -8.269
  544    HE   ARG  79           HE       ARG  79   9.336  -4.439  -5.576
  545   1HH1  ARG  79          1HH1      ARG  79   9.979  -4.990  -8.974
  546   2HH1  ARG  79          2HH1      ARG  79  11.661  -4.551  -8.854
  547   1HH2  ARG  79          1HH2      ARG  79  11.544  -3.818  -5.438
  548   2HH2  ARG  79          2HH2      ARG  79  12.541  -3.883  -6.856
  549    H    GLU  80           H        GLU  80   5.613  -1.024  -8.396
  550    HA   GLU  80           HA       GLU  80   7.073   1.219  -7.533
  551   1HB   GLU  80          2HB       GLU  80   6.455   2.228  -9.646
  552   2HB   GLU  80          1HB       GLU  80   6.847   0.530  -9.887
  553   1HG   GLU  80          2HG       GLU  80   4.347   0.100  -9.754
  554   2HG   GLU  80          1HG       GLU  80   4.155   1.846  -9.925
  555    H    GLU  81           H        GLU  81   3.632   0.538  -7.535
  556    HA   GLU  81           HA       GLU  81   2.830   3.200  -6.917
  557   1HB   GLU  81          2HB       GLU  81   1.486   0.525  -6.752
  558   2HB   GLU  81          1HB       GLU  81   0.694   1.998  -6.203
  559   1HG   GLU  81          2HG       GLU  81   0.364   2.763  -8.279
  560   2HG   GLU  81          1HG       GLU  81   1.888   2.122  -8.879
  561    H    GLN  82           H        GLN  82   3.241   0.261  -4.917
  562    HA   GLN  82           HA       GLN  82   2.755   1.513  -2.448
  563   1HB   GLN  82          2HB       GLN  82   4.212  -0.934  -3.280
  564   2HB   GLN  82          1HB       GLN  82   4.607  -0.278  -1.696
  565   1HG   GLN  82          2HG       GLN  82   2.949  -1.712  -1.153
  566   2HG   GLN  82          1HG       GLN  82   2.018  -0.240  -1.411
  567   1HE2  GLN  82          1HE2      GLN  82   2.484  -3.469  -2.302
  568   2HE2  GLN  82          2HE2      GLN  82   1.359  -3.506  -3.623
  569    H    ILE  83           H        ILE  83   5.622   1.185  -4.389
  570    HA   ILE  83           HA       ILE  83   7.456   2.384  -2.664
  571    HB   ILE  83           HB       ILE  83   7.318   2.085  -5.639
  572   1HG1  ILE  83          2HG1      ILE  83   9.446   1.155  -3.718
  573   2HG1  ILE  83          1HG1      ILE  83   7.977   0.230  -3.990
  574   1HG2  ILE  83          1HG2      ILE  83   9.478   3.560  -4.147
  575   2HG2  ILE  83          2HG2      ILE  83   8.351   4.251  -5.315
  576   3HG2  ILE  83          3HG2      ILE  83   9.553   3.072  -5.839
  577   1HD1  ILE  83          1HD1      ILE  83   8.537   0.037  -6.356
  578   2HD1  ILE  83          2HD1      ILE  83   9.816  -0.613  -5.330
  579   3HD1  ILE  83          3HD1      ILE  83  10.007   0.972  -6.082
  580    H    ALA  84           H        ALA  84   5.412   3.881  -5.210
  581    HA   ALA  84           HA       ALA  84   6.422   6.489  -4.905
  582   1HB   ALA  84          1HB       ALA  84   4.451   7.225  -6.104
  583   2HB   ALA  84          2HB       ALA  84   3.652   5.688  -5.779
  584   3HB   ALA  84          3HB       ALA  84   5.075   5.737  -6.820
  585    H    VAL  85           H        VAL  85   3.614   4.950  -3.400
  586    HA   VAL  85           HA       VAL  85   2.740   7.228  -1.963
  587    HB   VAL  85           HB       VAL  85   2.326   4.311  -1.330
  588   1HG1  VAL  85          1HG1      VAL  85   0.764   6.755  -0.489
  589   2HG1  VAL  85          2HG1      VAL  85   1.749   5.730   0.554
  590   3HG1  VAL  85          3HG1      VAL  85   0.281   5.086  -0.184
  591   1HG2  VAL  85          1HG2      VAL  85   0.683   6.191  -3.017
  592   2HG2  VAL  85          2HG2      VAL  85   0.214   4.551  -2.568
  593   3HG2  VAL  85          3HG2      VAL  85   1.626   4.817  -3.592
  594    H    ALA  86           H        ALA  86   4.610   4.370  -0.975
  595    HA   ALA  86           HA       ALA  86   5.288   5.199   1.594
  596   1HB   ALA  86          1HB       ALA  86   5.598   2.919   0.782
  597   2HB   ALA  86          2HB       ALA  86   7.093   3.573   1.456
  598   3HB   ALA  86          3HB       ALA  86   6.880   3.478  -0.293
  599    H    GLU  87           H        GLU  87   6.510   6.115  -1.506
  600    HA   GLU  87           HA       GLU  87   9.029   7.137  -0.784
  601   1HB   GLU  87          2HB       GLU  87   7.126   7.793  -3.010
  602   2HB   GLU  87          1HB       GLU  87   8.527   8.821  -2.753
  603   1HG   GLU  87          2HG       GLU  87   8.585   5.862  -3.298
  604   2HG   GLU  87          1HG       GLU  87   8.904   7.134  -4.473
  605    H    VAL  88           H        VAL  88   5.843   8.745  -0.894
  606    HA   VAL  88           HA       VAL  88   6.817  11.217   0.111
  607    HB   VAL  88           HB       VAL  88   4.013  10.101   0.465
  608   1HG1  VAL  88          1HG1      VAL  88   3.371  12.433   0.801
  609   2HG1  VAL  88          2HG1      VAL  88   5.049  12.941   0.613
  610   3HG1  VAL  88          3HG1      VAL  88   4.581  11.944   1.995
  611   1HG2  VAL  88          1HG2      VAL  88   3.442  11.437  -1.506
  612   2HG2  VAL  88          2HG2      VAL  88   4.644  10.207  -1.898
  613   3HG2  VAL  88          3HG2      VAL  88   5.136  11.890  -1.701
  614    H    THR  89           H        THR  89   5.547   8.317   1.622
  615    HA   THR  89           HA       THR  89   5.344   9.329   4.237
  616    HB   THR  89           HB       THR  89   5.961   6.445   3.745
  617    HG1  THR  89           1HG      THR  89   3.910   7.927   2.592
  618   1HG2  THR  89          1HG2      THR  89   4.247   6.134   5.419
  619   2HG2  THR  89          2HG2      THR  89   3.866   7.857   5.383
  620   3HG2  THR  89          3HG2      THR  89   5.431   7.315   5.987
  621    H    ARG  90           H        ARG  90   7.939   7.582   2.585
  622    HA   ARG  90           HA       ARG  90   9.542   7.280   4.907
  623   1HB   ARG  90          2HB       ARG  90  11.238   6.428   3.482
  624   2HB   ARG  90          1HB       ARG  90   9.700   5.850   2.870
  625   1HG   ARG  90          2HG       ARG  90   9.939   6.914   0.910
  626   2HG   ARG  90          1HG       ARG  90  10.613   8.361   1.665
  627   1HD   ARG  90          2HD       ARG  90  12.777   7.443   1.740
  628   2HD   ARG  90          1HD       ARG  90  12.184   5.814   1.419
  629    HE   ARG  90           HE       ARG  90  11.468   7.016  -0.822
  630   1HH1  ARG  90          1HH1      ARG  90  14.499   7.272   0.933
  631   2HH1  ARG  90          2HH1      ARG  90  15.448   7.488  -0.504
  632   1HH2  ARG  90          1HH2      ARG  90  12.695   7.297  -2.684
  633   2HH2  ARG  90          2HH2      ARG  90  14.429   7.445  -2.569
  634    H    LEU  91           H        LEU  91   9.265   9.791   2.511
  635    HA   LEU  91           HA       LEU  91  11.878  10.848   2.983
  636   1HB   LEU  91          2HB       LEU  91  11.203  12.789   1.671
  637   2HB   LEU  91          1HB       LEU  91  10.823  11.287   0.864
  638    HG   LEU  91           HG       LEU  91   8.417  11.671   1.799
  639   1HD1  LEU  91          1HD1      LEU  91   9.509  14.483   1.875
  640   2HD1  LEU  91          2HD1      LEU  91   8.997  13.539   3.276
  641   3HD1  LEU  91          3HD1      LEU  91   7.817  14.013   2.052
  642   1HD2  LEU  91          1HD2      LEU  91   9.042  11.710  -0.561
  643   2HD2  LEU  91          2HD2      LEU  91   9.561  13.388  -0.404
  644   3HD2  LEU  91          3HD2      LEU  91   7.861  12.967  -0.192
  645    H    ARG  92           H        ARG  92   8.854  11.188   4.514
  646    HA   ARG  92           HA       ARG  92   9.572  13.505   6.080
  647   1HB   ARG  92          2HB       ARG  92   7.381  11.603   6.779
  648   2HB   ARG  92          1HB       ARG  92   7.435  13.349   6.990
  649   1HG   ARG  92          2HG       ARG  92   6.855  13.763   4.796
  650   2HG   ARG  92          1HG       ARG  92   7.392  12.174   4.246
  651   1HD   ARG  92          2HD       ARG  92   4.876  12.942   5.655
  652   2HD   ARG  92          1HD       ARG  92   5.099  11.949   4.212
  653    HE   ARG  92           HE       ARG  92   6.314  10.497   6.170
  654   1HH1  ARG  92          1HH1      ARG  92   3.100  11.857   5.686
  655   2HH1  ARG  92          2HH1      ARG  92   2.321  10.736   6.769
  656   1HH2  ARG  92          1HH2      ARG  92   5.227   9.028   7.641
  657   2HH2  ARG  92          2HH2      ARG  92   3.513   9.153   7.857
  658    H    GLN  93           H        GLN  93   9.308  10.060   6.364
  659    HA   GLN  93           HA       GLN  93   9.668  10.061   9.223
  660   1HB   GLN  93          2HB       GLN  93   9.014   8.070   7.120
  661   2HB   GLN  93          1HB       GLN  93   9.364   7.536   8.763
  662   1HG   GLN  93          2HG       GLN  93   7.514   8.844   9.589
  663   2HG   GLN  93          1HG       GLN  93   7.223   9.494   7.976
  664   1HE2  GLN  93          1HE2      GLN  93   7.728   6.939   6.630
  665   2HE2  GLN  93          2HE2      GLN  93   6.363   5.947   6.986
  666    H    GLY  94           H        GLY  94  11.586   9.217   6.413
  667   1HA   GLY  94          2HA       GLY  94  13.866   8.801   6.253
  668   2HA   GLY  94          1HA       GLY  94  13.993   9.040   7.993
  669    H    TRP  95           H        TRP  95  11.829   6.794   6.434
  670    HA   TRP  95           HA       TRP  95  11.581   4.554   6.479
  671   1HB   TRP  95          2HB       TRP  95  14.517   4.318   7.161
  672   2HB   TRP  95          1HB       TRP  95  13.484   3.092   6.430
  673    HD1  TRP  95           HD       TRP  95  15.275   6.365   5.572
  674    HE1  TRP  95           1HE      TRP  95  15.608   6.474   3.033
  675    HE3  TRP  95           3HE      TRP  95  12.547   2.263   4.262
  676    HZ2  TRP  95           2HZ      TRP  95  14.791   5.002   0.753
  677    HZ3  TRP  95           3HZ      TRP  95  12.366   1.680   1.883
  678    HH2  TRP  95           HH       TRP  95  13.464   3.022   0.164
  679    H    GLY  96           H        GLY  96  12.114   6.423   9.002
  680   1HA   GLY  96          2HA       GLY  96  12.777   4.798  11.161
  681   2HA   GLY  96          1HA       GLY  96  11.790   6.245  11.261
  682    H    ALA  97           H        ALA  97   9.566   5.440   9.786
  683    HA   ALA  97           HA       ALA  97   8.164   3.950  11.755
  684   1HB   ALA  97          1HB       ALA  97   7.257   4.667   8.973
  685   2HB   ALA  97          2HB       ALA  97   7.099   5.700  10.394
  686   3HB   ALA  97          3HB       ALA  97   6.234   4.166  10.319
  687    H    TRP  98           H        TRP  98   9.891   3.102   8.917
  688    HA   TRP  98           HA       TRP  98   8.783   0.419   8.840
  689   1HB   TRP  98          2HB       TRP  98  10.814   1.881   7.152
  690   2HB   TRP  98          1HB       TRP  98  10.543   0.147   6.999
  691    HD1  TRP  98           HD       TRP  98   8.117  -0.636   6.089
  692    HE1  TRP  98           1HE      TRP  98   6.418   0.557   4.573
  693    HE3  TRP  98           3HE      TRP  98   9.860   4.173   6.547
  694    HZ2  TRP  98           2HZ      TRP  98   5.885   3.197   3.672
  695    HZ3  TRP  98           3HZ      TRP  98   8.700   5.948   5.330
  696    HH2  TRP  98           HH       TRP  98   6.755   5.478   3.930
  697    HA   PRO  99           HA       PRO  99  11.564  -0.377  12.175
  698   1HB   PRO  99          2HB       PRO  99  10.582  -3.149  11.726
  699   2HB   PRO  99          1HB       PRO  99  10.590  -2.182  13.208
  700   1HG   PRO  99          2HG       PRO  99   8.322  -2.545  11.917
  701   2HG   PRO  99          1HG       PRO  99   8.735  -0.935  12.549
  702   1HD   PRO  99          2HD       PRO  99   8.989  -1.969   9.741
  703   2HD   PRO  99          1HD       PRO  99   8.305  -0.427  10.312
  704    H    VAL 100           H        VAL 100  12.336  -3.315  12.208
  705    HA   VAL 100           HA       VAL 100  14.969  -3.053  11.374
  706    HB   VAL 100           HB       VAL 100  13.886  -4.801  12.900
  707   1HG1  VAL 100          1HG1      VAL 100  13.577  -6.241  10.285
  708   2HG1  VAL 100          2HG1      VAL 100  12.292  -5.758  11.392
  709   3HG1  VAL 100          3HG1      VAL 100  13.454  -6.994  11.876
  710   1HG2  VAL 100          1HG2      VAL 100  15.724  -6.380  12.561
  711   2HG2  VAL 100          2HG2      VAL 100  16.280  -4.710  12.441
  712   3HG2  VAL 100          3HG2      VAL 100  16.038  -5.666  10.979
  713    H    CYS 101           H        CYS 101  12.161  -3.957   9.644
  714    HA   CYS 101           HA       CYS 101  13.171  -5.232   7.401
  715   1HB   CYS 101          2HB       CYS 101  10.901  -3.233   7.435
  716   2HB   CYS 101          1HB       CYS 101  11.154  -4.524   6.261
  717    H    ALA 102           H        ALA 102  13.014  -1.759   8.116
  718    HA   ALA 102           HA       ALA 102  13.888  -0.938   5.525
  719   1HB   ALA 102          1HB       ALA 102  14.188   1.264   6.521
  720   2HB   ALA 102          2HB       ALA 102  13.973   0.574   8.132
  721   3HB   ALA 102          3HB       ALA 102  12.634   0.568   6.982
  722    H    ALA 103           H        ALA 103  15.493  -1.500   8.623
  723    HA   ALA 103           HA       ALA 103  18.069  -0.680   7.817
  724   1HB   ALA 103          1HB       ALA 103  18.882  -1.924   9.757
  725   2HB   ALA 103          2HB       ALA 103  17.309  -2.703   9.922
  726   3HB   ALA 103          3HB       ALA 103  17.462  -0.964  10.167
  727    H    ARG 104           H        ARG 104  16.455  -3.810   7.806
  728    HA   ARG 104           HA       ARG 104  18.541  -5.367   6.754
  729   1HB   ARG 104          2HB       ARG 104  15.538  -5.618   6.647
  730   2HB   ARG 104          1HB       ARG 104  16.609  -6.834   5.965
  731   1HG   ARG 104          2HG       ARG 104  17.537  -7.303   8.137
  732   2HG   ARG 104          1HG       ARG 104  16.613  -5.978   8.854
  733   1HD   ARG 104          2HD       ARG 104  15.666  -8.324   9.144
  734   2HD   ARG 104          1HD       ARG 104  14.562  -7.087   8.532
  735    HE   ARG 104           HE       ARG 104  15.835  -8.411   6.379
  736   1HH1  ARG 104          1HH1      ARG 104  13.411  -9.020   8.842
  737   2HH1  ARG 104          2HH1      ARG 104  12.489 -10.093   7.835
  738   1HH2  ARG 104          1HH2      ARG 104  14.597  -9.814   5.057
  739   2HH2  ARG 104          2HH2      ARG 104  13.153 -10.543   5.704
  740    H    ALA 105           H        ALA 105  16.237  -3.219   5.284
  741    HA   ALA 105           HA       ALA 105  16.724  -4.144   2.583
  742   1HB   ALA 105          1HB       ALA 105  15.128  -2.440   1.958
  743   2HB   ALA 105          2HB       ALA 105  15.163  -1.774   3.591
  744   3HB   ALA 105          3HB       ALA 105  14.510  -3.389   3.310
  745    H    GLY 106           H        GLY 106  17.993  -1.782   4.751
  746   1HA   GLY 106          2HA       GLY 106  20.089  -0.701   4.317
  747   2HA   GLY 106          1HA       GLY 106  19.693  -0.704   2.603
  748    H    ALA 107           H        ALA 107  18.485   0.602   5.680
  749    HA   ALA 107           HA       ALA 107  16.835   2.589   4.659
  750   1HB   ALA 107          1HB       ALA 107  18.352   2.662   7.262
  751   2HB   ALA 107          2HB       ALA 107  16.830   1.813   6.998
  752   3HB   ALA 107          3HB       ALA 107  16.893   3.571   6.865
  753    H    ARG 108           H        ARG 108  17.090   4.861   4.456
  754    HA   ARG 108           HA       ARG 108  19.674   6.055   4.327
  755   1HB   ARG 108          2HB       ARG 108  19.316   6.357   1.710
  756   2HB   ARG 108          1HB       ARG 108  20.207   4.991   2.369
  757   1HG   ARG 108          2HG       ARG 108  18.332   3.540   2.121
  758   2HG   ARG 108          1HG       ARG 108  17.270   4.894   1.716
  759   1HD   ARG 108          2HD       ARG 108  17.974   3.549  -0.245
  760   2HD   ARG 108          1HD       ARG 108  18.405   5.254  -0.354
  761    HE   ARG 108           HE       ARG 108  20.502   3.603   0.722
  762   1HH1  ARG 108          1HH1      ARG 108  18.989   4.728  -2.237
  763   2HH1  ARG 108          2HH1      ARG 108  20.467   4.658  -3.164
  764   1HH2  ARG 108          1HH2      ARG 108  22.436   3.483  -0.497
  765   2HH2  ARG 108          2HH2      ARG 108  22.413   3.916  -2.176
  Start of MODEL    5
    1   1H    ASN   1          1HT       ASN   1   8.247   7.213 -31.179
    2   2H    ASN   1          2HT       ASN   1   9.289   5.926 -30.829
    3   3H    ASN   1          3HT       ASN   1   9.533   6.859 -32.224
    4    HA   ASN   1           HA       ASN   1   9.797   7.778 -29.421
    5   1HB   ASN   1          2HB       ASN   1  11.824   7.198 -31.582
    6   2HB   ASN   1          1HB       ASN   1  12.198   8.174 -30.167
    7   1HD2  ASN   1          1HD2      ASN   1  13.236   5.581 -31.105
    8   2HD2  ASN   1          2HD2      ASN   1  13.016   4.493 -29.769
    9    H    VAL   2           H        VAL   2   9.122   9.779 -29.239
   10    HA   VAL   2           HA       VAL   2   9.348  11.610 -31.502
   11    HB   VAL   2           HB       VAL   2   8.091  12.097 -28.792
   12   1HG1  VAL   2          1HG1      VAL   2   8.738  14.152 -29.911
   13   2HG1  VAL   2          2HG1      VAL   2   6.983  13.985 -29.911
   14   3HG1  VAL   2          3HG1      VAL   2   7.901  13.641 -31.375
   15   1HG2  VAL   2          1HG2      VAL   2   5.941  11.760 -29.908
   16   2HG2  VAL   2          2HG2      VAL   2   6.934  10.303 -29.967
   17   3HG2  VAL   2          3HG2      VAL   2   6.782  11.325 -31.395
   18    H    VAL   3           H        VAL   3  10.434  11.118 -28.203
   19    HA   VAL   3           HA       VAL   3  12.010  13.403 -27.954
   20    HB   VAL   3           HB       VAL   3  11.351  12.119 -26.010
   21   1HG1  VAL   3          1HG1      VAL   3  11.370   9.884 -26.960
   22   2HG1  VAL   3          2HG1      VAL   3  12.344   9.942 -25.489
   23   3HG1  VAL   3          3HG1      VAL   3  13.130   9.928 -27.068
   24   1HG2  VAL   3          1HG2      VAL   3  13.512  11.971 -24.842
   25   2HG2  VAL   3          2HG2      VAL   3  13.354  13.455 -25.782
   26   3HG2  VAL   3          3HG2      VAL   3  14.341  12.126 -26.391
   27    H    VAL   4           H        VAL   4  13.854  13.938 -28.903
   28    HA   VAL   4           HA       VAL   4  15.200  12.158 -30.677
   29    HB   VAL   4           HB       VAL   4  15.113  14.470 -31.251
   30   1HG1  VAL   4          1HG1      VAL   4  14.942  15.455 -29.038
   31   2HG1  VAL   4          2HG1      VAL   4  16.238  16.226 -29.953
   32   3HG1  VAL   4          3HG1      VAL   4  16.622  15.040 -28.708
   33   1HG2  VAL   4          1HG2      VAL   4  17.930  13.703 -30.532
   34   2HG2  VAL   4          2HG2      VAL   4  17.483  14.997 -31.641
   35   3HG2  VAL   4          3HG2      VAL   4  17.084  13.325 -32.034
   36    H    THR   5           H        THR   5  17.256  11.369 -30.550
   37    HA   THR   5           HA       THR   5  18.448  11.271 -27.854
   38    HB   THR   5           HB       THR   5  19.259   8.982 -28.390
   39    HG1  THR   5           1HG      THR   5  18.922   9.370 -30.764
   40   1HG2  THR   5          1HG2      THR   5  16.259   9.295 -28.548
   41   2HG2  THR   5          2HG2      THR   5  17.220   9.262 -27.068
   42   3HG2  THR   5          3HG2      THR   5  17.122   7.826 -28.087
   43    HA   PRO   6           HA       PRO   6  21.731  13.562 -29.846
   44   1HB   PRO   6          2HB       PRO   6  23.064  12.122 -27.582
   45   2HB   PRO   6          1HB       PRO   6  23.314  13.775 -28.169
   46   1HG   PRO   6          2HG       PRO   6  21.767  13.378 -26.077
   47   2HG   PRO   6          1HG       PRO   6  21.282  14.523 -27.342
   48   1HD   PRO   6          2HD       PRO   6  20.209  11.815 -26.749
   49   2HD   PRO   6          1HD       PRO   6  19.396  13.228 -27.445
   50    H    ALA   7           H        ALA   7  22.369  12.843 -31.621
   51    HA   ALA   7           HA       ALA   7  23.687  10.223 -31.818
   52   1HB   ALA   7          1HB       ALA   7  22.360  11.821 -34.002
   53   2HB   ALA   7          2HB       ALA   7  21.657  10.429 -33.180
   54   3HB   ALA   7          3HB       ALA   7  23.092  10.229 -34.186
   55    H    HIS   8           H        HIS   8  24.699  12.929 -31.088
   56    HA   HIS   8           HA       HIS   8  26.735  13.439 -33.036
   57   1HB   HIS   8          2HB       HIS   8  25.814  15.103 -31.313
   58   2HB   HIS   8          1HB       HIS   8  26.779  14.237 -30.121
   59    HD1  HIS   8           1HD      HIS   8  27.142  16.431 -33.180
   60    HD2  HIS   8           2HD      HIS   8  29.462  14.838 -30.111
   61    HE1  HIS   8           1HE      HIS   8  29.403  17.558 -33.332
   62    H    GLU   9           H        GLU   9  26.077  11.007 -30.895
   63    HA   GLU   9           HA       GLU   9  28.791  10.477 -30.032
   64   1HB   GLU   9          2HB       GLU   9  27.876   8.516 -28.919
   65   2HB   GLU   9          1HB       GLU   9  26.888   9.921 -28.553
   66   1HG   GLU   9          2HG       GLU   9  25.135   9.191 -29.900
   67   2HG   GLU   9          1HG       GLU   9  26.160   8.051 -30.771
   68    H    ALA  10           H        ALA  10  30.142   8.919 -30.793
   69    HA   ALA  10           HA       ALA  10  29.260   7.501 -33.214
   70   1HB   ALA  10          1HB       ALA  10  31.156   9.031 -33.587
   71   2HB   ALA  10          2HB       ALA  10  31.614   7.350 -33.858
   72   3HB   ALA  10          3HB       ALA  10  32.083   8.162 -32.366
   73    H    VAL  11           H        VAL  11  28.316   6.399 -31.203
   74    HA   VAL  11           HA       VAL  11  30.020   4.133 -30.536
   75    HB   VAL  11           HB       VAL  11  27.961   5.427 -28.795
   76   1HG1  VAL  11          1HG1      VAL  11  27.956   3.006 -28.497
   77   2HG1  VAL  11          2HG1      VAL  11  28.624   3.808 -27.075
   78   3HG1  VAL  11          3HG1      VAL  11  29.700   3.031 -28.236
   79   1HG2  VAL  11          1HG2      VAL  11  29.851   5.916 -27.291
   80   2HG2  VAL  11          2HG2      VAL  11  29.999   6.715 -28.856
   81   3HG2  VAL  11          3HG2      VAL  11  30.949   5.273 -28.510
   82    H    VAL  12           H        VAL  12  26.635   5.083 -30.278
   83    HA   VAL  12           HA       VAL  12  24.780   3.778 -30.328
   84    HB   VAL  12           HB       VAL  12  25.796   4.151 -33.076
   85   1HG1  VAL  12          1HG1      VAL  12  22.988   3.432 -32.228
   86   2HG1  VAL  12          2HG1      VAL  12  24.089   2.385 -33.125
   87   3HG1  VAL  12          3HG1      VAL  12  23.474   3.862 -33.870
   88   1HG2  VAL  12          1HG2      VAL  12  24.253   6.066 -33.083
   89   2HG2  VAL  12          2HG2      VAL  12  25.491   6.184 -31.832
   90   3HG2  VAL  12          3HG2      VAL  12  23.849   5.701 -31.405
   91    H    ARG  13           H        ARG  13  25.462   1.949 -29.270
   92    HA   ARG  13           HA       ARG  13  25.757  -0.399 -30.941
   93   1HB   ARG  13          2HB       ARG  13  26.815  -1.409 -28.892
   94   2HB   ARG  13          1HB       ARG  13  27.738  -0.129 -29.669
   95   1HG   ARG  13          2HG       ARG  13  27.244   1.415 -27.996
   96   2HG   ARG  13          1HG       ARG  13  25.916   0.431 -27.375
   97   1HD   ARG  13          2HD       ARG  13  28.775  -0.490 -27.333
   98   2HD   ARG  13          1HD       ARG  13  28.051   0.431 -26.013
   99    HE   ARG  13           HE       ARG  13  26.388  -1.400 -25.868
  100   1HH1  ARG  13          1HH1      ARG  13  29.493  -2.030 -27.375
  101   2HH1  ARG  13          2HH1      ARG  13  29.506  -3.713 -26.938
  102   1HH2  ARG  13          1HH2      ARG  13  26.395  -3.623 -25.306
  103   2HH2  ARG  13          2HH2      ARG  13  27.743  -4.619 -25.782
  104    H    VAL  14           H        VAL  14  24.236  -1.852 -30.751
  105    HA   VAL  14           HA       VAL  14  22.043  -1.366 -28.921
  106    HB   VAL  14           HB       VAL  14  22.004  -3.439 -31.068
  107   1HG1  VAL  14          1HG1      VAL  14  19.856  -1.686 -29.890
  108   2HG1  VAL  14          2HG1      VAL  14  20.139  -3.388 -29.522
  109   3HG1  VAL  14          3HG1      VAL  14  19.610  -2.911 -31.137
  110   1HG2  VAL  14          1HG2      VAL  14  22.820  -1.441 -32.195
  111   2HG2  VAL  14          2HG2      VAL  14  21.490  -0.500 -31.517
  112   3HG2  VAL  14          3HG2      VAL  14  21.158  -1.785 -32.679
  113    H    GLY  15           H        GLY  15  21.062  -3.198 -27.941
  114   1HA   GLY  15          2HA       GLY  15  22.111  -5.718 -27.655
  115   2HA   GLY  15          1HA       GLY  15  22.854  -4.700 -26.431
  116    H    THR  16           H        THR  16  21.552  -3.689 -24.880
  117    HA   THR  16           HA       THR  16  19.045  -5.027 -24.380
  118    HB   THR  16           HB       THR  16  20.434  -2.971 -22.674
  119    HG1  THR  16           1HG      THR  16  20.842  -5.298 -21.601
  120   1HG2  THR  16          1HG2      THR  16  18.406  -5.105 -22.059
  121   2HG2  THR  16          2HG2      THR  16  18.099  -3.373 -22.152
  122   3HG2  THR  16          3HG2      THR  16  19.140  -4.016 -20.884
  123    H    LYS  17           H        LYS  17  20.358  -1.831 -24.710
  124    HA   LYS  17           HA       LYS  17  19.374   0.256 -24.731
  125   1HB   LYS  17          2HB       LYS  17  18.232  -1.164 -27.117
  126   2HB   LYS  17          1HB       LYS  17  18.271   0.586 -26.934
  127   1HG   LYS  17          2HG       LYS  17  20.622  -1.284 -27.142
  128   2HG   LYS  17          1HG       LYS  17  20.066  -0.143 -28.363
  129   1HD   LYS  17          2HD       LYS  17  20.923   0.777 -25.637
  130   2HD   LYS  17          1HD       LYS  17  22.096   0.490 -26.917
  131   1HE   LYS  17          2HE       LYS  17  21.585   2.807 -26.948
  132   2HE   LYS  17          1HE       LYS  17  20.797   2.087 -28.347
  133   1HZ   LYS  17          1HZ       LYS  17  18.701   2.215 -27.282
  134   2HZ   LYS  17          2HZ       LYS  17  19.440   3.724 -27.066
  135   3HZ   LYS  17          3HZ       LYS  17  19.394   2.613 -25.787
  136    HA   PRO  18           HA       PRO  18  15.692  -0.972 -22.153
  137   1HB   PRO  18          2HB       PRO  18  16.339   1.939 -21.738
  138   2HB   PRO  18          1HB       PRO  18  15.662   0.774 -20.585
  139   1HG   PRO  18          2HG       PRO  18  18.245   1.228 -20.541
  140   2HG   PRO  18          1HG       PRO  18  17.644  -0.441 -20.455
  141   1HD   PRO  18          2HD       PRO  18  18.974   0.962 -22.717
  142   2HD   PRO  18          1HD       PRO  18  18.981  -0.760 -22.288
  143    H    GLY  19           H        GLY  19  13.931  -1.193 -23.073
  144   1HA   GLY  19          2HA       GLY  19  12.303   1.018 -23.892
  145   2HA   GLY  19          1HA       GLY  19  12.806  -0.009 -25.230
  146    H    THR  20           H        THR  20  12.716  -2.461 -24.347
  147    HA   THR  20           HA       THR  20   9.957  -3.093 -24.178
  148    HB   THR  20           HB       THR  20  12.303  -4.922 -23.635
  149    HG1  THR  20           1HG      THR  20  11.099  -4.791 -26.170
  150   1HG2  THR  20          1HG2      THR  20  10.118  -5.847 -23.059
  151   2HG2  THR  20          2HG2      THR  20  10.804  -6.666 -24.462
  152   3HG2  THR  20          3HG2      THR  20   9.527  -5.471 -24.676
  153    H    GLU  21           H        GLU  21  12.546  -2.818 -21.851
  154    HA   GLU  21           HA       GLU  21  10.780  -3.642 -19.691
  155   1HB   GLU  21          2HB       GLU  21  13.777  -3.276 -19.707
  156   2HB   GLU  21          1HB       GLU  21  12.825  -3.772 -18.316
  157   1HG   GLU  21          2HG       GLU  21  12.152  -5.796 -19.537
  158   2HG   GLU  21          1HG       GLU  21  13.187  -5.300 -20.878
  159    H    VAL  22           H        VAL  22   9.826  -2.069 -18.674
  160    HA   VAL  22           HA       VAL  22  10.741   0.651 -18.789
  161    HB   VAL  22           HB       VAL  22   8.595  -0.556 -17.028
  162   1HG1  VAL  22          1HG1      VAL  22   9.129   2.302 -17.838
  163   2HG1  VAL  22          2HG1      VAL  22   9.326   1.612 -16.226
  164   3HG1  VAL  22          3HG1      VAL  22   7.717   1.745 -16.938
  165   1HG2  VAL  22          1HG2      VAL  22   7.016   0.194 -18.735
  166   2HG2  VAL  22          2HG2      VAL  22   8.165  -0.970 -19.401
  167   3HG2  VAL  22          3HG2      VAL  22   8.354   0.750 -19.736
  168    HA   PRO  23           HA       PRO  23  13.818   0.269 -15.630
  169   1HB   PRO  23          2HB       PRO  23  13.221   3.162 -15.265
  170   2HB   PRO  23          1HB       PRO  23  14.770   2.356 -15.534
  171   1HG   PRO  23          2HG       PRO  23  13.571   3.708 -17.492
  172   2HG   PRO  23          1HG       PRO  23  14.450   2.202 -17.819
  173   1HD   PRO  23          2HD       PRO  23  11.524   2.710 -17.675
  174   2HD   PRO  23          1HD       PRO  23  12.425   1.595 -18.718
  175    HA   PRO  24           HA       PRO  24  11.301  -0.295 -11.970
  176   1HB   PRO  24          2HB       PRO  24  13.522  -0.632 -10.340
  177   2HB   PRO  24          1HB       PRO  24  12.710  -1.922 -11.237
  178   1HG   PRO  24          2HG       PRO  24  15.131  -0.323 -11.986
  179   2HG   PRO  24          1HG       PRO  24  14.837  -2.067 -12.161
  180   1HD   PRO  24          2HD       PRO  24  14.592  -0.499 -14.267
  181   2HD   PRO  24          1HD       PRO  24  13.380  -1.759 -13.957
  182    H    VAL  25           H        VAL  25  11.047   0.715  -9.959
  183    HA   VAL  25           HA       VAL  25  11.823   3.490  -9.929
  184    HB   VAL  25           HB       VAL  25  10.059   1.885  -8.045
  185   1HG1  VAL  25          1HG1      VAL  25   9.481   4.021  -7.004
  186   2HG1  VAL  25          2HG1      VAL  25  10.671   4.848  -8.011
  187   3HG1  VAL  25          3HG1      VAL  25  11.199   3.672  -6.805
  188   1HG2  VAL  25          1HG2      VAL  25   9.451   4.031 -10.075
  189   2HG2  VAL  25          2HG2      VAL  25   8.280   3.251  -9.013
  190   3HG2  VAL  25          3HG2      VAL  25   9.115   2.308 -10.245
  191    H    ILE  26           H        ILE  26  13.359   4.372  -8.763
  192    HA   ILE  26           HA       ILE  26  15.599   2.800  -8.434
  193    HB   ILE  26           HB       ILE  26  15.160   5.604  -7.430
  194   1HG1  ILE  26          2HG1      ILE  26  14.710   5.374  -9.822
  195   2HG1  ILE  26          1HG1      ILE  26  16.197   6.279  -9.560
  196   1HG2  ILE  26          1HG2      ILE  26  17.128   4.612  -6.402
  197   2HG2  ILE  26          2HG2      ILE  26  17.592   5.851  -7.568
  198   3HG2  ILE  26          3HG2      ILE  26  17.739   4.141  -7.987
  199   1HD1  ILE  26          1HD1      ILE  26  16.418   4.710 -11.399
  200   2HD1  ILE  26          2HD1      ILE  26  16.014   3.374 -10.322
  201   3HD1  ILE  26          3HD1      ILE  26  17.502   4.288 -10.073
  202    H    ASP  27           H        ASP  27  13.421   3.884  -5.917
  203    HA   ASP  27           HA       ASP  27  15.326   2.960  -3.920
  204   1HB   ASP  27          2HB       ASP  27  12.911   4.735  -3.587
  205   2HB   ASP  27          1HB       ASP  27  13.997   4.238  -2.293
  206    H    GLY  28           H        GLY  28  13.023   1.792  -5.677
  207   1HA   GLY  28          2HA       GLY  28  11.295   0.538  -3.793
  208   2HA   GLY  28          1HA       GLY  28  11.460   0.124  -5.495
  209    H    SER  29           H        SER  29  14.486   0.172  -4.409
  210    HA   SER  29           HA       SER  29  14.700  -2.679  -4.185
  211   1HB   SER  29          2HB       SER  29  16.756  -0.601  -3.454
  212   2HB   SER  29          1HB       SER  29  17.049  -2.292  -3.858
  213    HG   SER  29           HG       SER  29  17.406  -0.668  -5.582
  214    H    ILE  30           H        ILE  30  14.823   0.047  -2.033
  215    HA   ILE  30           HA       ILE  30  15.289  -1.449   0.355
  216    HB   ILE  30           HB       ILE  30  13.822   1.051   0.799
  217   1HG1  ILE  30          2HG1      ILE  30  14.914   1.696  -1.350
  218   2HG1  ILE  30          1HG1      ILE  30  15.511   2.614   0.021
  219   1HG2  ILE  30          1HG2      ILE  30  16.578   0.138   1.585
  220   2HG2  ILE  30          2HG2      ILE  30  15.092  -0.105   2.504
  221   3HG2  ILE  30          3HG2      ILE  30  15.714   1.525   2.249
  222   1HD1  ILE  30          1HD1      ILE  30  17.284   1.967  -1.530
  223   2HD1  ILE  30          2HD1      ILE  30  16.915   0.270  -1.225
  224   3HD1  ILE  30          3HD1      ILE  30  17.522   1.287   0.085
  225    H    TRP  31           H        TRP  31  12.568  -0.307  -1.469
  226    HA   TRP  31           HA       TRP  31  10.594  -0.942   0.480
  227   1HB   TRP  31          2HB       TRP  31  10.367  -0.328  -2.476
  228   2HB   TRP  31          1HB       TRP  31   8.993  -0.525  -1.394
  229    HD1  TRP  31           HD       TRP  31  10.823   2.180  -2.841
  230    HE1  TRP  31           1HE      TRP  31  10.730   4.326  -1.381
  231    HE3  TRP  31           3HE      TRP  31   9.238   0.101   1.487
  232    HZ2  TRP  31           2HZ      TRP  31  10.077   4.985   1.257
  233    HZ3  TRP  31           3HZ      TRP  31   8.909   1.536   3.453
  234    HH2  TRP  31           HH       TRP  31   9.322   3.932   3.334
  235    H    ASP  32           H        ASP  32  11.990  -2.627  -2.268
  236    HA   ASP  32           HA       ASP  32  10.184  -4.821  -2.192
  237   1HB   ASP  32          2HB       ASP  32  11.161  -4.975  -4.213
  238   2HB   ASP  32          1HB       ASP  32  12.555  -4.022  -3.692
  239    H    ALA  33           H        ALA  33  13.297  -4.090  -0.673
  240    HA   ALA  33           HA       ALA  33  13.618  -6.664   0.436
  241   1HB   ALA  33          1HB       ALA  33  15.342  -5.662   1.827
  242   2HB   ALA  33          2HB       ALA  33  14.794  -4.052   1.361
  243   3HB   ALA  33          3HB       ALA  33  15.491  -5.131   0.152
  244    H    ILE  34           H        ILE  34  12.107  -3.681   1.597
  245    HA   ILE  34           HA       ILE  34  11.446  -4.658   4.183
  246    HB   ILE  34           HB       ILE  34  10.103  -2.559   2.494
  247   1HG1  ILE  34          2HG1      ILE  34  12.017  -2.334   4.830
  248   2HG1  ILE  34          1HG1      ILE  34  12.426  -2.051   3.141
  249   1HG2  ILE  34          1HG2      ILE  34   9.028  -1.801   4.584
  250   2HG2  ILE  34          2HG2      ILE  34   9.685  -3.214   5.410
  251   3HG2  ILE  34          3HG2      ILE  34   8.513  -3.420   4.110
  252   1HD1  ILE  34          1HD1      ILE  34  12.123   0.034   4.341
  253   2HD1  ILE  34          2HD1      ILE  34  10.483  -0.444   4.783
  254   3HD1  ILE  34          3HD1      ILE  34  10.891  -0.156   3.093
  255    H    ALA  35           H        ALA  35   9.623  -4.530   1.139
  256    HA   ALA  35           HA       ALA  35   7.300  -5.806   1.994
  257   1HB   ALA  35          1HB       ALA  35   7.515  -4.708  -0.174
  258   2HB   ALA  35          2HB       ALA  35   6.944  -6.369  -0.354
  259   3HB   ALA  35          3HB       ALA  35   8.627  -5.968  -0.707
  260    H    GLY  36           H        GLY  36  10.385  -7.092   0.917
  261   1HA   GLY  36          2HA       GLY  36   9.541  -9.834   0.879
  262   2HA   GLY  36          1HA       GLY  36  11.200  -9.255   0.830
  263    H    CYS  37           H        CYS  37  10.240  -7.681   3.354
  264    HA   CYS  37           HA       CYS  37  11.188  -9.733   5.182
  265   1HB   CYS  37          2HB       CYS  37  12.402  -7.621   5.125
  266   2HB   CYS  37          1HB       CYS  37  10.927  -6.742   5.499
  267    H    GLU  38           H        GLU  38   8.643  -7.213   5.160
  268    HA   GLU  38           HA       GLU  38   7.432  -8.507   7.461
  269   1HB   GLU  38          2HB       GLU  38   7.106  -5.828   6.180
  270   2HB   GLU  38          1HB       GLU  38   5.826  -6.455   7.212
  271   1HG   GLU  38          2HG       GLU  38   7.366  -6.673   9.055
  272   2HG   GLU  38          1HG       GLU  38   8.705  -6.166   8.029
  273    H    ALA  39           H        ALA  39   6.961  -8.262   4.062
  274    HA   ALA  39           HA       ALA  39   4.274  -9.341   4.396
  275   1HB   ALA  39          1HB       ALA  39   5.472  -8.201   1.890
  276   2HB   ALA  39          2HB       ALA  39   4.443  -7.316   3.018
  277   3HB   ALA  39          3HB       ALA  39   3.793  -8.694   2.127
  278    H    GLY  40           H        GLY  40   7.404 -10.285   3.695
  279   1HA   GLY  40          2HA       GLY  40   8.225 -12.389   3.154
  280   2HA   GLY  40          1HA       GLY  40   6.565 -12.945   2.946
  281    H    GLY  41           H        GLY  41   7.370 -10.054   1.438
  282   1HA   GLY  41          2HA       GLY  41   7.628  -9.420  -0.717
  283   2HA   GLY  41          1HA       GLY  41   8.197 -11.044  -1.101
  284    H    ASN  42           H        ASN  42   5.167  -9.518  -0.028
  285    HA   ASN  42           HA       ASN  42   3.779 -10.777  -2.254
  286   1HB   ASN  42          2HB       ASN  42   3.592 -12.271  -0.235
  287   2HB   ASN  42          1HB       ASN  42   2.780 -10.944   0.590
  288   1HD2  ASN  42          1HD2      ASN  42   2.288 -11.657  -2.825
  289   2HD2  ASN  42          2HD2      ASN  42   0.657 -12.210  -2.642
  290    H    TRP  43           H        TRP  43   3.254  -8.939  -3.240
  291    HA   TRP  43           HA       TRP  43   2.510  -6.588  -1.714
  292   1HB   TRP  43          2HB       TRP  43   2.704  -7.017  -4.701
  293   2HB   TRP  43          1HB       TRP  43   2.499  -5.462  -3.899
  294    HD1  TRP  43           HD       TRP  43   5.061  -8.370  -3.864
  295    HE1  TRP  43           1HE      TRP  43   7.424  -7.356  -3.628
  296    HE3  TRP  43           3HE      TRP  43   3.779  -3.450  -3.467
  297    HZ2  TRP  43           2HZ      TRP  43   8.592  -4.768  -3.314
  298    HZ3  TRP  43           3HZ      TRP  43   5.546  -1.766  -3.207
  299    HH2  TRP  43           HH       TRP  43   7.905  -2.416  -3.139
  300    H    ALA  44           H        ALA  44   0.971  -9.248  -2.596
  301    HA   ALA  44           HA       ALA  44  -1.603  -7.886  -3.042
  302   1HB   ALA  44          1HB       ALA  44  -0.950  -9.488  -4.793
  303   2HB   ALA  44          2HB       ALA  44  -2.436  -9.960  -3.971
  304   3HB   ALA  44          3HB       ALA  44  -0.919 -10.774  -3.586
  305    H    ILE  45           H        ILE  45   0.123  -9.032  -0.540
  306    HA   ILE  45           HA       ILE  45  -1.643 -10.797   0.739
  307    HB   ILE  45           HB       ILE  45   0.889 -10.355   1.185
  308   1HG1  ILE  45          2HG1      ILE  45  -1.052 -10.834   3.443
  309   2HG1  ILE  45          1HG1      ILE  45  -0.477 -12.043   2.298
  310   1HG2  ILE  45          1HG2      ILE  45   1.310  -8.959   3.163
  311   2HG2  ILE  45          2HG2      ILE  45  -0.361  -8.396   3.101
  312   3HG2  ILE  45          3HG2      ILE  45   0.746  -8.015   1.783
  313   1HD1  ILE  45          1HD1      ILE  45   1.816 -11.682   3.129
  314   2HD1  ILE  45          2HD1      ILE  45   0.710 -12.263   4.375
  315   3HD1  ILE  45          3HD1      ILE  45   1.173 -10.562   4.330
  316    H    ASN  46           H        ASN  46  -3.116 -10.435   2.364
  317    HA   ASN  46           HA       ASN  46  -3.731  -7.722   3.186
  318   1HB   ASN  46          2HB       ASN  46  -4.920  -8.219   0.939
  319   2HB   ASN  46          1HB       ASN  46  -5.936  -9.308   1.879
  320   1HD2  ASN  46          1HD2      ASN  46  -5.193  -6.057   1.096
  321   2HD2  ASN  46          2HD2      ASN  46  -6.465  -5.318   2.008
  322    H    THR  47           H        THR  47  -3.462  -8.248   5.248
  323    HA   THR  47           HA       THR  47  -4.544 -10.610   6.412
  324    HB   THR  47           HB       THR  47  -3.909  -9.428   8.579
  325    HG1  THR  47           1HG      THR  47  -2.433  -7.576   8.071
  326   1HG2  THR  47          1HG2      THR  47  -1.780  -9.710   6.451
  327   2HG2  THR  47          2HG2      THR  47  -2.393 -11.008   7.478
  328   3HG2  THR  47          3HG2      THR  47  -1.492  -9.665   8.190
  329    H    GLY  48           H        GLY  48  -5.673  -7.438   5.762
  330   1HA   GLY  48          2HA       GLY  48  -7.933  -6.805   5.747
  331   2HA   GLY  48          1HA       GLY  48  -8.281  -8.122   6.865
  332    H    ASN  49           H        ASN  49  -5.549  -6.161   7.529
  333    HA   ASN  49           HA       ASN  49  -6.931  -5.277   9.944
  334   1HB   ASN  49          2HB       ASN  49  -4.775  -4.934  10.938
  335   2HB   ASN  49          1HB       ASN  49  -4.753  -6.496  10.127
  336   1HD2  ASN  49          1HD2      ASN  49  -2.555  -4.733  10.882
  337   2HD2  ASN  49          2HD2      ASN  49  -1.697  -4.399   9.411
  338    H    GLY  50           H        GLY  50  -6.622  -4.014   7.028
  339   1HA   GLY  50          2HA       GLY  50  -7.195  -1.785   6.481
  340   2HA   GLY  50          1HA       GLY  50  -6.602  -1.275   8.056
  341    H    TYR  51           H        TYR  51  -4.272  -3.250   7.183
  342    HA   TYR  51           HA       TYR  51  -2.812  -1.233   5.619
  343   1HB   TYR  51          2HB       TYR  51  -1.568  -3.342   7.404
  344   2HB   TYR  51          1HB       TYR  51  -0.730  -2.088   6.534
  345    HD1  TYR  51           1HD      TYR  51  -3.835  -1.248   8.308
  346    HD2  TYR  51           2HD      TYR  51   0.410  -1.421   8.546
  347    HE1  TYR  51           1HE      TYR  51  -3.894   0.135  10.344
  348    HE2  TYR  51           2HE      TYR  51   0.362  -0.018  10.568
  349    HH   TYR  51           HH       TYR  51  -1.257   1.717  11.552
  350    H    TYR  52           H        TYR  52  -1.515  -2.083   3.896
  351    HA   TYR  52           HA       TYR  52  -2.816  -4.547   2.956
  352   1HB   TYR  52          2HB       TYR  52  -2.164  -2.102   1.337
  353   2HB   TYR  52          1HB       TYR  52  -3.006  -3.544   0.760
  354    HD1  TYR  52           1HD      TYR  52  -3.423  -0.326   2.115
  355    HD2  TYR  52           2HD      TYR  52  -5.085  -4.225   2.190
  356    HE1  TYR  52           1HE      TYR  52  -5.534   0.600   2.972
  357    HE2  TYR  52           2HE      TYR  52  -7.212  -3.326   3.018
  358    HH   TYR  52           HH       TYR  52  -7.978  -0.058   2.979
  359    H    GLY  53           H        GLY  53  -1.799  -5.412   0.916
  360   1HA   GLY  53          2HA       GLY  53   0.610  -6.553   1.761
  361   2HA   GLY  53          1HA       GLY  53  -0.129  -6.772   0.186
  362    H    GLY  54           H        GLY  54   2.593  -6.725   0.628
  363   1HA   GLY  54          2HA       GLY  54   4.241  -5.816  -0.821
  364   2HA   GLY  54          1HA       GLY  54   3.332  -4.308  -0.862
  365    H    VAL  55           H        VAL  55   3.805  -2.730   0.577
  366    HA   VAL  55           HA       VAL  55   6.120  -3.221   2.299
  367    HB   VAL  55           HB       VAL  55   4.846  -0.531   1.875
  368   1HG1  VAL  55          1HG1      VAL  55   6.623  -0.896   3.587
  369   2HG1  VAL  55          2HG1      VAL  55   7.025   0.302   2.358
  370   3HG1  VAL  55          3HG1      VAL  55   7.722  -1.316   2.276
  371   1HG2  VAL  55          1HG2      VAL  55   6.853  -1.863   0.055
  372   2HG2  VAL  55          2HG2      VAL  55   6.320  -0.186  -0.048
  373   3HG2  VAL  55          3HG2      VAL  55   5.176  -1.494  -0.348
  374    H    GLN  56           H        GLN  56   2.864  -3.366   2.517
  375    HA   GLN  56           HA       GLN  56   1.496  -3.842   4.240
  376   1HB   GLN  56          2HB       GLN  56   4.195  -4.331   5.390
  377   2HB   GLN  56          1HB       GLN  56   2.807  -4.362   6.470
  378   1HG   GLN  56          2HG       GLN  56   2.816  -5.949   3.935
  379   2HG   GLN  56          1HG       GLN  56   3.583  -6.562   5.403
  380   1HE2  GLN  56          1HE2      GLN  56   0.559  -5.568   3.948
  381   2HE2  GLN  56          2HE2      GLN  56  -0.466  -6.370   5.085
  382    H    PHE  57           H        PHE  57   1.506  -1.155   3.826
  383    HA   PHE  57           HA       PHE  57   1.295  -0.256   6.602
  384   1HB   PHE  57          2HB       PHE  57   1.663   2.035   5.903
  385   2HB   PHE  57          1HB       PHE  57   3.054   1.011   5.627
  386    HD1  PHE  57           1HD      PHE  57   3.328   0.110   3.173
  387    HD2  PHE  57           2HD      PHE  57   0.935   3.459   4.259
  388    HE1  PHE  57           1HE      PHE  57   3.565   1.006   0.902
  389    HE2  PHE  57           2HE      PHE  57   1.154   4.354   1.981
  390    HZ   PHE  57           HZ       PHE  57   2.493   3.142   0.297
  391    H    ASP  58           H        ASP  58  -0.183   1.859   6.629
  392    HA   ASP  58           HA       ASP  58  -2.673   0.448   6.327
  393   1HB   ASP  58          2HB       ASP  58  -3.606   2.136   7.815
  394   2HB   ASP  58          1HB       ASP  58  -2.135   1.438   8.476
  395    H    GLN  59           H        GLN  59  -4.612   1.391   5.756
  396    HA   GLN  59           HA       GLN  59  -4.770   2.432   3.206
  397   1HB   GLN  59          2HB       GLN  59  -6.496   1.137   4.379
  398   2HB   GLN  59          1HB       GLN  59  -6.755   2.479   5.479
  399   1HG   GLN  59          2HG       GLN  59  -8.494   2.594   3.929
  400   2HG   GLN  59          1HG       GLN  59  -7.358   3.856   3.465
  401   1HE2  GLN  59          1HE2      GLN  59  -6.120   3.588   1.593
  402   2HE2  GLN  59          2HE2      GLN  59  -6.561   2.444   0.360
  403    H    GLY  60           H        GLY  60  -4.864   4.023   6.327
  404   1HA   GLY  60          2HA       GLY  60  -5.873   6.517   5.420
  405   2HA   GLY  60          1HA       GLY  60  -5.098   6.221   6.972
  406    H    THR  61           H        THR  61  -2.609   5.472   6.347
  407    HA   THR  61           HA       THR  61  -1.267   7.823   5.613
  408    HB   THR  61           HB       THR  61  -0.263   5.007   5.628
  409    HG1  THR  61           1HG      THR  61  -0.650   5.232   7.700
  410   1HG2  THR  61          1HG2      THR  61   1.257   6.494   4.435
  411   2HG2  THR  61          2HG2      THR  61   1.958   6.004   5.979
  412   3HG2  THR  61          3HG2      THR  61   1.248   7.609   5.802
  413    H    TRP  62           H        TRP  62  -2.029   4.893   3.841
  414    HA   TRP  62           HA       TRP  62  -0.728   5.398   1.442
  415   1HB   TRP  62          2HB       TRP  62  -1.792   3.266   2.009
  416   2HB   TRP  62          1HB       TRP  62  -3.371   4.045   1.992
  417    HD1  TRP  62           HD       TRP  62  -4.480   4.534  -0.355
  418    HE1  TRP  62           1HE      TRP  62  -3.982   3.668  -2.724
  419    HE3  TRP  62           3HE      TRP  62   0.141   2.549   0.476
  420    HZ2  TRP  62           2HZ      TRP  62  -1.886   2.310  -4.083
  421    HZ3  TRP  62           3HZ      TRP  62   1.334   1.491  -1.385
  422    HH2  TRP  62           HH       TRP  62   0.352   1.368  -3.621
  423    H    GLU  63           H        GLU  63  -3.992   6.196   2.504
  424    HA   GLU  63           HA       GLU  63  -4.776   7.506   0.130
  425   1HB   GLU  63          2HB       GLU  63  -6.453   6.651   1.595
  426   2HB   GLU  63          1HB       GLU  63  -5.824   7.564   2.961
  427   1HG   GLU  63          2HG       GLU  63  -6.491   9.647   1.880
  428   2HG   GLU  63          1HG       GLU  63  -7.107   8.739   0.501
  429    H    ALA  64           H        ALA  64  -3.359   8.580   3.159
  430    HA   ALA  64           HA       ALA  64  -3.770  11.346   2.857
  431   1HB   ALA  64          1HB       ALA  64  -2.069  11.615   4.580
  432   2HB   ALA  64          2HB       ALA  64  -1.564   9.940   4.356
  433   3HB   ALA  64          3HB       ALA  64  -3.171  10.300   4.987
  434    H    ASN  65           H        ASN  65  -1.061   9.267   1.889
  435    HA   ASN  65           HA       ASN  65   0.363  11.492   0.758
  436   1HB   ASN  65          2HB       ASN  65   0.898   8.530   0.476
  437   2HB   ASN  65          1HB       ASN  65   2.016   9.835   0.081
  438   1HD2  ASN  65          1HD2      ASN  65   1.113  11.387   2.456
  439   2HD2  ASN  65          2HD2      ASN  65   1.874  10.626   3.814
  440    H    GLY  66           H        GLY  66  -2.185   9.536  -0.240
  441   1HA   GLY  66          2HA       GLY  66  -3.474  10.084  -2.138
  442   2HA   GLY  66          1HA       GLY  66  -2.042  10.784  -2.881
  443    H    GLY  67           H        GLY  67  -2.740   7.558  -1.523
  444   1HA   GLY  67          2HA       GLY  67  -1.181   6.363  -3.632
  445   2HA   GLY  67          1HA       GLY  67  -1.944   5.530  -2.287
  446    H    LEU  68           H        LEU  68  -4.515   7.007  -3.081
  447    HA   LEU  68           HA       LEU  68  -5.633   4.761  -4.247
  448   1HB   LEU  68          2HB       LEU  68  -6.657   7.537  -3.875
  449   2HB   LEU  68          1HB       LEU  68  -7.647   6.274  -4.575
  450    HG   LEU  68           HG       LEU  68  -7.087   4.971  -2.414
  451   1HD1  LEU  68          1HD1      LEU  68  -6.751   6.402  -0.458
  452   2HD1  LEU  68          2HD1      LEU  68  -6.511   7.782  -1.530
  453   3HD1  LEU  68          3HD1      LEU  68  -5.378   6.431  -1.563
  454   1HD2  LEU  68          1HD2      LEU  68  -9.310   5.765  -3.011
  455   2HD2  LEU  68          2HD2      LEU  68  -8.921   7.358  -2.361
  456   3HD2  LEU  68          3HD2      LEU  68  -9.008   5.964  -1.284
  457    H    ARG  69           H        ARG  69  -4.220   7.555  -5.712
  458    HA   ARG  69           HA       ARG  69  -5.407   7.285  -8.271
  459   1HB   ARG  69          2HB       ARG  69  -3.525   8.653  -9.068
  460   2HB   ARG  69          1HB       ARG  69  -4.289   9.345  -7.644
  461   1HG   ARG  69          2HG       ARG  69  -2.446   9.141  -6.397
  462   2HG   ARG  69          1HG       ARG  69  -2.050   7.554  -7.065
  463   1HD   ARG  69          2HD       ARG  69  -1.632  10.152  -8.543
  464   2HD   ARG  69          1HD       ARG  69  -0.390   9.367  -7.566
  465    HE   ARG  69           HE       ARG  69  -1.091   7.392  -9.222
  466   1HH1  ARG  69          1HH1      ARG  69  -0.379  10.762  -9.894
  467   2HH1  ARG  69          2HH1      ARG  69   0.338  10.421 -11.447
  468   1HH2  ARG  69          1HH2      ARG  69  -0.168   6.946 -11.243
  469   2HH2  ARG  69          2HH2      ARG  69   0.427   8.254 -12.223
  470    H    TYR  70           H        TYR  70  -2.728   5.788  -6.632
  471    HA   TYR  70           HA       TYR  70  -1.671   4.460  -8.976
  472   1HB   TYR  70          2HB       TYR  70  -1.276   3.943  -6.016
  473   2HB   TYR  70          1HB       TYR  70  -0.265   3.302  -7.311
  474    HD1  TYR  70           1HD      TYR  70  -1.020   6.100  -5.184
  475    HD2  TYR  70           2HD      TYR  70   1.264   4.858  -8.545
  476    HE1  TYR  70           1HE      TYR  70   0.411   8.069  -4.926
  477    HE2  TYR  70           2HE      TYR  70   2.711   6.835  -8.297
  478    HH   TYR  70           HH       TYR  70   2.746   8.741  -5.533
  479    H    ALA  71           H        ALA  71  -3.780   3.999  -6.322
  480    HA   ALA  71           HA       ALA  71  -5.608   2.242  -7.201
  481   1HB   ALA  71          1HB       ALA  71  -3.338   0.666  -5.963
  482   2HB   ALA  71          2HB       ALA  71  -3.854   0.570  -7.647
  483   3HB   ALA  71          3HB       ALA  71  -4.935   0.033  -6.360
  484    HA   PRO  72           HA       PRO  72  -6.840   3.838  -3.277
  485   1HB   PRO  72          2HB       PRO  72  -8.826   1.712  -3.277
  486   2HB   PRO  72          1HB       PRO  72  -9.029   3.453  -3.190
  487   1HG   PRO  72          2HG       PRO  72  -9.593   2.010  -5.408
  488   2HG   PRO  72          1HG       PRO  72  -9.085   3.707  -5.442
  489   1HD   PRO  72          2HD       PRO  72  -7.592   1.277  -6.185
  490   2HD   PRO  72          1HD       PRO  72  -7.371   2.958  -6.716
  491    H    ARG  73           H        ARG  73  -5.615   0.735  -3.726
  492    HA   ARG  73           HA       ARG  73  -4.974   0.588  -0.900
  493   1HB   ARG  73          2HB       ARG  73  -5.709  -1.724  -0.622
  494   2HB   ARG  73          1HB       ARG  73  -7.076  -0.700  -1.048
  495   1HG   ARG  73          2HG       ARG  73  -6.625  -1.440  -3.450
  496   2HG   ARG  73          1HG       ARG  73  -5.624  -2.700  -2.722
  497   1HD   ARG  73          2HD       ARG  73  -8.490  -2.244  -1.923
  498   2HD   ARG  73          1HD       ARG  73  -8.041  -3.298  -3.263
  499    HE   ARG  73           HE       ARG  73  -6.544  -4.295  -1.290
  500   1HH1  ARG  73          1HH1      ARG  73  -9.910  -3.299  -1.248
  501   2HH1  ARG  73          2HH1      ARG  73 -10.411  -4.612  -0.216
  502   1HH2  ARG  73          1HH2      ARG  73  -7.216  -6.016   0.041
  503   2HH2  ARG  73          2HH2      ARG  73  -8.884  -6.157   0.511
  504    H    ALA  74           H        ALA  74  -3.102  -0.488  -0.497
  505    HA   ALA  74           HA       ALA  74  -1.164  -0.416  -2.489
  506   1HB   ALA  74          1HB       ALA  74  -0.754  -1.992   0.013
  507   2HB   ALA  74          2HB       ALA  74  -0.929  -0.239   0.077
  508   3HB   ALA  74          3HB       ALA  74   0.379  -0.964  -0.860
  509    H    ASP  75           H        ASP  75  -3.249  -3.032  -1.553
  510    HA   ASP  75           HA       ASP  75  -1.513  -4.981  -2.806
  511   1HB   ASP  75          2HB       ASP  75  -3.162  -6.671  -2.171
  512   2HB   ASP  75          1HB       ASP  75  -2.671  -5.705  -0.792
  513    H    LEU  76           H        LEU  76  -3.615  -2.763  -3.890
  514    HA   LEU  76           HA       LEU  76  -4.339  -4.369  -6.239
  515   1HB   LEU  76          2HB       LEU  76  -6.169  -3.102  -5.192
  516   2HB   LEU  76          1HB       LEU  76  -5.261  -1.618  -5.397
  517    HG   LEU  76           HG       LEU  76  -5.396  -1.895  -7.849
  518   1HD1  LEU  76          1HD1      LEU  76  -6.938  -3.550  -8.781
  519   2HD1  LEU  76          2HD1      LEU  76  -7.184  -4.225  -7.169
  520   3HD1  LEU  76          3HD1      LEU  76  -5.597  -4.320  -7.933
  521   1HD2  LEU  76          1HD2      LEU  76  -8.067  -1.959  -6.457
  522   2HD2  LEU  76          2HD2      LEU  76  -7.738  -1.302  -8.060
  523   3HD2  LEU  76          3HD2      LEU  76  -7.035  -0.541  -6.632
  524    H    ALA  77           H        ALA  77  -2.521  -1.638  -5.098
  525    HA   ALA  77           HA       ALA  77  -1.485  -0.890  -7.662
  526   1HB   ALA  77          1HB       ALA  77  -0.566  -0.168  -4.875
  527   2HB   ALA  77          2HB       ALA  77  -1.704   0.756  -5.859
  528   3HB   ALA  77          3HB       ALA  77  -0.023   0.595  -6.372
  529    H    THR  78           H        THR  78   0.879  -0.973  -8.053
  530    HA   THR  78           HA       THR  78   1.820  -3.649  -7.355
  531    HB   THR  78           HB       THR  78   3.283  -3.381  -9.347
  532    HG1  THR  78           1HG      THR  78   1.989  -1.319 -10.491
  533   1HG2  THR  78          1HG2      THR  78   1.172  -4.481  -9.632
  534   2HG2  THR  78          2HG2      THR  78   1.390  -3.389 -11.003
  535   3HG2  THR  78          3HG2      THR  78   0.317  -2.939  -9.671
  536    H    ARG  79           H        ARG  79   4.430  -3.583  -7.700
  537    HA   ARG  79           HA       ARG  79   5.565  -2.605  -5.399
  538   1HB   ARG  79          2HB       ARG  79   7.077  -2.837  -7.998
  539   2HB   ARG  79          1HB       ARG  79   7.698  -3.036  -6.366
  540   1HG   ARG  79          2HG       ARG  79   6.199  -5.025  -6.144
  541   2HG   ARG  79          1HG       ARG  79   5.858  -4.872  -7.870
  542   1HD   ARG  79          2HD       ARG  79   7.588  -6.379  -7.912
  543   2HD   ARG  79          1HD       ARG  79   8.481  -4.864  -8.047
  544    HE   ARG  79           HE       ARG  79   8.524  -5.158  -5.443
  545   1HH1  ARG  79          1HH1      ARG  79   9.012  -7.575  -7.931
  546   2HH1  ARG  79          2HH1      ARG  79  10.038  -8.567  -6.933
  547   1HH2  ARG  79          1HH2      ARG  79   9.833  -6.476  -4.138
  548   2HH2  ARG  79          2HH2      ARG  79  10.516  -7.927  -4.787
  549    H    GLU  80           H        GLU  80   5.734  -1.149  -8.630
  550    HA   GLU  80           HA       GLU  80   7.312   1.050  -7.888
  551   1HB   GLU  80          2HB       GLU  80   6.617   1.973 -10.091
  552   2HB   GLU  80          1HB       GLU  80   7.180   0.310 -10.171
  553   1HG   GLU  80          2HG       GLU  80   4.806  -0.429 -10.152
  554   2HG   GLU  80          1HG       GLU  80   4.330   1.265 -10.267
  555    H    GLU  81           H        GLU  81   3.840   0.714  -8.237
  556    HA   GLU  81           HA       GLU  81   3.044   3.334  -7.668
  557   1HB   GLU  81          2HB       GLU  81   1.842   0.637  -7.695
  558   2HB   GLU  81          1HB       GLU  81   1.001   1.839  -6.732
  559   1HG   GLU  81          2HG       GLU  81   0.231   1.533  -9.081
  560   2HG   GLU  81          1HG       GLU  81   0.562   3.183  -8.576
  561    H    GLN  82           H        GLN  82   3.254   0.499  -5.560
  562    HA   GLN  82           HA       GLN  82   2.398   1.868  -3.241
  563   1HB   GLN  82          2HB       GLN  82   2.055  -0.465  -3.351
  564   2HB   GLN  82          1HB       GLN  82   3.743  -0.774  -3.724
  565   1HG   GLN  82          2HG       GLN  82   4.422  -0.450  -1.552
  566   2HG   GLN  82          1HG       GLN  82   2.986   0.484  -1.135
  567   1HE2  GLN  82          1HE2      GLN  82   2.684  -2.447  -2.972
  568   2HE2  GLN  82          2HE2      GLN  82   1.979  -3.392  -1.694
  569    H    ILE  83           H        ILE  83   5.502   1.211  -4.673
  570    HA   ILE  83           HA       ILE  83   7.182   2.070  -2.610
  571    HB   ILE  83           HB       ILE  83   7.438   2.125  -5.611
  572   1HG1  ILE  83          2HG1      ILE  83   9.227   0.709  -3.663
  573   2HG1  ILE  83          1HG1      ILE  83   7.665   0.023  -4.089
  574   1HG2  ILE  83          1HG2      ILE  83   9.802   2.804  -5.315
  575   2HG2  ILE  83          2HG2      ILE  83   9.453   3.151  -3.622
  576   3HG2  ILE  83          3HG2      ILE  83   8.647   4.069  -4.893
  577   1HD1  ILE  83          1HD1      ILE  83   8.313  -0.017  -6.435
  578   2HD1  ILE  83          2HD1      ILE  83   9.465  -0.909  -5.440
  579   3HD1  ILE  83          3HD1      ILE  83   9.868   0.706  -6.024
  580    H    ALA  84           H        ALA  84   5.455   3.858  -5.139
  581    HA   ALA  84           HA       ALA  84   6.679   6.360  -4.684
  582   1HB   ALA  84          1HB       ALA  84   3.960   5.775  -5.857
  583   2HB   ALA  84          2HB       ALA  84   5.483   5.779  -6.747
  584   3HB   ALA  84          3HB       ALA  84   4.874   7.274  -6.036
  585    H    VAL  85           H        VAL  85   3.726   4.903  -3.429
  586    HA   VAL  85           HA       VAL  85   2.890   7.135  -1.902
  587    HB   VAL  85           HB       VAL  85   2.302   4.220  -1.427
  588   1HG1  VAL  85          1HG1      VAL  85   0.815   6.715  -0.599
  589   2HG1  VAL  85          2HG1      VAL  85   1.687   5.614   0.467
  590   3HG1  VAL  85          3HG1      VAL  85   0.236   5.064  -0.371
  591   1HG2  VAL  85          1HG2      VAL  85   1.769   4.836  -3.708
  592   2HG2  VAL  85          2HG2      VAL  85   0.843   6.223  -3.137
  593   3HG2  VAL  85          3HG2      VAL  85   0.292   4.588  -2.776
  594    H    ALA  86           H        ALA  86   4.590   4.116  -0.947
  595    HA   ALA  86           HA       ALA  86   5.194   4.786   1.657
  596   1HB   ALA  86          1HB       ALA  86   7.019   3.183   1.478
  597   2HB   ALA  86          2HB       ALA  86   6.897   3.222  -0.280
  598   3HB   ALA  86          3HB       ALA  86   5.570   2.571   0.682
  599    H    GLU  87           H        GLU  87   6.562   5.860  -1.338
  600    HA   GLU  87           HA       GLU  87   9.010   6.887  -0.403
  601   1HB   GLU  87          2HB       GLU  87   7.273   7.582  -2.754
  602   2HB   GLU  87          1HB       GLU  87   8.683   8.560  -2.382
  603   1HG   GLU  87          2HG       GLU  87   8.756   5.595  -2.873
  604   2HG   GLU  87          1HG       GLU  87   9.051   6.819  -4.104
  605    H    VAL  88           H        VAL  88   5.797   8.425  -0.658
  606    HA   VAL  88           HA       VAL  88   6.641  10.959   0.258
  607    HB   VAL  88           HB       VAL  88   3.919   9.676   0.627
  608   1HG1  VAL  88          1HG1      VAL  88   3.099  11.934   0.944
  609   2HG1  VAL  88          2HG1      VAL  88   4.726  12.584   0.729
  610   3HG1  VAL  88          3HG1      VAL  88   4.357  11.579   2.138
  611   1HG2  VAL  88          1HG2      VAL  88   3.289  10.979  -1.366
  612   2HG2  VAL  88          2HG2      VAL  88   4.542   9.789  -1.723
  613   3HG2  VAL  88          3HG2      VAL  88   4.967  11.492  -1.549
  614    H    THR  89           H        THR  89   5.404   8.120   1.934
  615    HA   THR  89           HA       THR  89   5.307   9.195   4.519
  616    HB   THR  89           HB       THR  89   6.007   6.325   4.065
  617    HG1  THR  89           1HG      THR  89   3.572   7.618   3.310
  618   1HG2  THR  89          1HG2      THR  89   5.583   7.147   6.328
  619   2HG2  THR  89          2HG2      THR  89   4.353   5.985   5.825
  620   3HG2  THR  89          3HG2      THR  89   3.990   7.711   5.827
  621    H    ARG  90           H        ARG  90   7.880   7.391   2.850
  622    HA   ARG  90           HA       ARG  90   9.561   7.142   5.083
  623   1HB   ARG  90          2HB       ARG  90  11.252   6.377   3.604
  624   2HB   ARG  90          1HB       ARG  90   9.721   5.797   2.972
  625   1HG   ARG  90          2HG       ARG  90  10.120   6.750   1.025
  626   2HG   ARG  90          1HG       ARG  90  10.330   8.323   1.793
  627   1HD   ARG  90          2HD       ARG  90  12.625   8.029   2.050
  628   2HD   ARG  90          1HD       ARG  90  12.517   6.281   1.847
  629    HE   ARG  90           HE       ARG  90  11.765   6.994  -0.551
  630   1HH1  ARG  90          1HH1      ARG  90  14.286   8.466   1.414
  631   2HH1  ARG  90          2HH1      ARG  90  15.237   8.942   0.040
  632   1HH2  ARG  90          1HH2      ARG  90  12.991   7.615  -2.330
  633   2HH2  ARG  90          2HH2      ARG  90  14.498   8.455  -2.104
  634    H    LEU  91           H        LEU  91   9.138   9.700   2.801
  635    HA   LEU  91           HA       LEU  91  11.599  11.054   3.147
  636   1HB   LEU  91          2HB       LEU  91   8.949  12.405   2.648
  637   2HB   LEU  91          1HB       LEU  91  10.543  13.017   2.257
  638    HG   LEU  91           HG       LEU  91   9.134  10.711   0.952
  639   1HD1  LEU  91          1HD1      LEU  91   9.168  12.174  -1.031
  640   2HD1  LEU  91          2HD1      LEU  91   9.846  13.466  -0.039
  641   3HD1  LEU  91          3HD1      LEU  91   8.228  12.852   0.299
  642   1HD2  LEU  91          1HD2      LEU  91  11.854  11.885   0.366
  643   2HD2  LEU  91          2HD2      LEU  91  11.040  10.645  -0.589
  644   3HD2  LEU  91          3HD2      LEU  91  11.540  10.298   1.067
  645    H    ARG  92           H        ARG  92   8.703  10.933   5.032
  646    HA   ARG  92           HA       ARG  92   9.281  13.404   6.402
  647   1HB   ARG  92          2HB       ARG  92   7.081  11.520   7.121
  648   2HB   ARG  92          1HB       ARG  92   7.134  13.271   7.296
  649   1HG   ARG  92          2HG       ARG  92   6.616  13.644   5.093
  650   2HG   ARG  92          1HG       ARG  92   7.254  12.078   4.576
  651   1HD   ARG  92          2HD       ARG  92   4.626  12.735   5.822
  652   2HD   ARG  92          1HD       ARG  92   4.995  11.698   4.436
  653    HE   ARG  92           HE       ARG  92   6.129  10.272   6.277
  654   1HH1  ARG  92          1HH1      ARG  92   3.140  12.067   6.586
  655   2HH1  ARG  92          2HH1      ARG  92   2.461  10.990   7.763
  656   1HH2  ARG  92          1HH2      ARG  92   5.242   8.868   7.883
  657   2HH2  ARG  92          2HH2      ARG  92   3.649   9.182   8.506
  658    H    GLN  93           H        GLN  93   9.032   9.956   7.103
  659    HA   GLN  93           HA       GLN  93   9.834  10.571   9.830
  660   1HB   GLN  93          2HB       GLN  93   8.587   8.844  10.558
  661   2HB   GLN  93          1HB       GLN  93   7.801   9.067   9.003
  662   1HG   GLN  93          2HG       GLN  93  10.041   7.117   9.407
  663   2HG   GLN  93          1HG       GLN  93   8.353   6.706   9.701
  664   1HE2  GLN  93          1HE2      GLN  93   6.915   6.662   7.976
  665   2HE2  GLN  93          2HE2      GLN  93   7.486   6.481   6.345
  666    H    GLY  94           H        GLY  94  11.094   8.980   7.004
  667   1HA   GLY  94          2HA       GLY  94  13.379   8.739   6.591
  668   2HA   GLY  94          1HA       GLY  94  13.698   9.039   8.295
  669    H    TRP  95           H        TRP  95  11.518   6.664   6.905
  670    HA   TRP  95           HA       TRP  95  11.424   4.411   6.958
  671   1HB   TRP  95          2HB       TRP  95  14.383   4.339   7.545
  672   2HB   TRP  95          1HB       TRP  95  13.395   3.077   6.813
  673    HD1  TRP  95           HD       TRP  95  14.943   6.476   5.986
  674    HE1  TRP  95           1HE      TRP  95  15.208   6.649   3.446
  675    HE3  TRP  95           3HE      TRP  95  12.506   2.199   4.661
  676    HZ2  TRP  95           2HZ      TRP  95  14.458   5.164   1.160
  677    HZ3  TRP  95           3HZ      TRP  95  12.315   1.649   2.272
  678    HH2  TRP  95           HH       TRP  95  13.272   3.103   0.558
  679    H    GLY  96           H        GLY  96  11.790   6.284   9.460
  680   1HA   GLY  96          2HA       GLY  96  12.465   4.554  11.598
  681   2HA   GLY  96          1HA       GLY  96  11.536   6.041  11.730
  682    H    ALA  97           H        ALA  97   9.426   5.231   9.956
  683    HA   ALA  97           HA       ALA  97   7.731   3.885  11.776
  684   1HB   ALA  97          1HB       ALA  97   7.312   4.368   8.828
  685   2HB   ALA  97          2HB       ALA  97   6.898   5.492  10.122
  686   3HB   ALA  97          3HB       ALA  97   6.069   3.941  10.004
  687    H    TRP  98           H        TRP  98   9.731   2.859   9.150
  688    HA   TRP  98           HA       TRP  98   8.676   0.150   9.214
  689   1HB   TRP  98          2HB       TRP  98  10.709   1.551   7.470
  690   2HB   TRP  98          1HB       TRP  98  10.414  -0.183   7.382
  691    HD1  TRP  98           HD       TRP  98   8.005  -0.966   6.488
  692    HE1  TRP  98           1HE      TRP  98   6.338   0.196   4.892
  693    HE3  TRP  98           3HE      TRP  98   9.815   3.828   6.754
  694    HZ2  TRP  98           2HZ      TRP  98   5.879   2.822   3.840
  695    HZ3  TRP  98           3HZ      TRP  98   8.723   5.585   5.430
  696    HH2  TRP  98           HH       TRP  98   6.796   5.088   4.018
  697    HA   PRO  99           HA       PRO  99  11.622  -0.406  12.497
  698   1HB   PRO  99          2HB       PRO  99  10.543  -3.173  12.315
  699   2HB   PRO  99          1HB       PRO  99  10.680  -2.109  13.721
  700   1HG   PRO  99          2HG       PRO  99   8.322  -2.484  12.621
  701   2HG   PRO  99          1HG       PRO  99   8.824  -0.842  13.087
  702   1HD   PRO  99          2HD       PRO  99   8.883  -2.117  10.361
  703   2HD   PRO  99          1HD       PRO  99   8.244  -0.525  10.838
  704    H    VAL 100           H        VAL 100  12.212  -3.515  12.447
  705    HA   VAL 100           HA       VAL 100  14.870  -3.276  11.705
  706    HB   VAL 100           HB       VAL 100  13.270  -5.841  11.704
  707   1HG1  VAL 100          1HG1      VAL 100  15.401  -6.900  12.281
  708   2HG1  VAL 100          2HG1      VAL 100  16.213  -5.340  12.127
  709   3HG1  VAL 100          3HG1      VAL 100  15.472  -6.092  10.713
  710   1HG2  VAL 100          1HG2      VAL 100  13.952  -6.063  14.055
  711   2HG2  VAL 100          2HG2      VAL 100  12.917  -4.658  13.792
  712   3HG2  VAL 100          3HG2      VAL 100  14.658  -4.447  13.992
  713    H    CYS 101           H        CYS 101  12.083  -3.973   9.737
  714    HA   CYS 101           HA       CYS 101  13.473  -5.313   7.653
  715   1HB   CYS 101          2HB       CYS 101  10.770  -3.945   7.650
  716   2HB   CYS 101          1HB       CYS 101  11.395  -4.955   6.342
  717    H    ALA 102           H        ALA 102  12.762  -1.924   8.277
  718    HA   ALA 102           HA       ALA 102  13.578  -1.008   5.705
  719   1HB   ALA 102          1HB       ALA 102  13.542   0.473   8.326
  720   2HB   ALA 102          2HB       ALA 102  12.209   0.375   7.175
  721   3HB   ALA 102          3HB       ALA 102  13.703   1.197   6.727
  722    H    ALA 103           H        ALA 103  15.207  -1.383   8.823
  723    HA   ALA 103           HA       ALA 103  17.705  -0.355   8.050
  724   1HB   ALA 103          1HB       ALA 103  17.076  -0.722  10.392
  725   2HB   ALA 103          2HB       ALA 103  18.603  -1.512   9.995
  726   3HB   ALA 103          3HB       ALA 103  17.124  -2.468  10.127
  727    H    ARG 104           H        ARG 104  16.339  -3.581   7.923
  728    HA   ARG 104           HA       ARG 104  18.633  -4.880   6.893
  729   1HB   ARG 104          2HB       ARG 104  15.700  -5.576   6.919
  730   2HB   ARG 104          1HB       ARG 104  16.911  -6.637   6.205
  731   1HG   ARG 104          2HG       ARG 104  17.052  -5.681   9.050
  732   2HG   ARG 104          1HG       ARG 104  16.207  -7.153   8.573
  733   1HD   ARG 104          2HD       ARG 104  18.460  -7.654   9.349
  734   2HD   ARG 104          1HD       ARG 104  18.276  -8.051   7.642
  735    HE   ARG 104           HE       ARG 104  19.556  -5.541   8.528
  736   1HH1  ARG 104          1HH1      ARG 104  19.605  -8.530   6.694
  737   2HH1  ARG 104          2HH1      ARG 104  21.040  -8.104   5.799
  738   1HH2  ARG 104          1HH2      ARG 104  21.451  -4.989   7.360
  739   2HH2  ARG 104          2HH2      ARG 104  22.089  -6.103   6.186
  740    H    ALA 105           H        ALA 105  16.163  -2.958   5.446
  741    HA   ALA 105           HA       ALA 105  16.555  -3.954   2.759
  742   1HB   ALA 105          1HB       ALA 105  14.910  -2.295   2.142
  743   2HB   ALA 105          2HB       ALA 105  15.012  -1.564   3.743
  744   3HB   ALA 105          3HB       ALA 105  14.367  -3.195   3.559
  745    H    GLY 106           H        GLY 106  17.936  -1.507   4.756
  746   1HA   GLY 106          2HA       GLY 106  19.967  -0.393   4.086
  747   2HA   GLY 106          1HA       GLY 106  19.383  -0.422   2.429
  748    H    ALA 107           H        ALA 107  17.856   0.591   5.435
  749    HA   ALA 107           HA       ALA 107  16.448   2.757   4.437
  750   1HB   ALA 107          1HB       ALA 107  15.948   1.649   6.561
  751   2HB   ALA 107          2HB       ALA 107  16.104   3.395   6.758
  752   3HB   ALA 107          3HB       ALA 107  17.419   2.328   7.259
  753    H    ARG 108           H        ARG 108  16.709   5.004   4.641
  754    HA   ARG 108           HA       ARG 108  19.085   6.230   5.501
  755   1HB   ARG 108          2HB       ARG 108  19.597   6.997   2.988
  756   2HB   ARG 108          1HB       ARG 108  20.381   5.619   3.737
  757   1HG   ARG 108          2HG       ARG 108  19.779   4.708   1.739
  758   2HG   ARG 108          1HG       ARG 108  18.355   4.301   2.700
  759   1HD   ARG 108          2HD       ARG 108  17.719   5.177   0.512
  760   2HD   ARG 108          1HD       ARG 108  17.199   6.267   1.798
  761    HE   ARG 108           HE       ARG 108  19.434   7.459   1.196
  762   1HH1  ARG 108          1HH1      ARG 108  17.232   5.929  -1.045
  763   2HH1  ARG 108          2HH1      ARG 108  17.625   6.984  -2.357
  764   1HH2  ARG 108          1HH2      ARG 108  19.950   8.862  -0.510
  765   2HH2  ARG 108          2HH2      ARG 108  19.194   8.650  -2.068
  Start of MODEL    6
    1   1H    ASN   1          1HT       ASN   1  19.800  -4.164 -38.125
    2   2H    ASN   1          2HT       ASN   1  20.252  -3.888 -36.518
    3   3H    ASN   1          3HT       ASN   1  20.260  -5.465 -37.139
    4    HA   ASN   1           HA       ASN   1  22.036  -3.222 -37.908
    5   1HB   ASN   1          2HB       ASN   1  22.564  -5.872 -36.540
    6   2HB   ASN   1          1HB       ASN   1  23.826  -4.798 -37.129
    7   1HD2  ASN   1          1HD2      ASN   1  23.158  -5.752 -34.429
    8   2HD2  ASN   1          2HD2      ASN   1  22.974  -4.318 -33.470
    9    H    VAL   2           H        VAL   2  22.499  -3.209 -39.987
   10    HA   VAL   2           HA       VAL   2  22.312  -5.674 -41.551
   11    HB   VAL   2           HB       VAL   2  22.701  -2.830 -42.506
   12   1HG1  VAL   2          1HG1      VAL   2  22.065  -5.354 -44.031
   13   2HG1  VAL   2          2HG1      VAL   2  23.586  -4.457 -44.078
   14   3HG1  VAL   2          3HG1      VAL   2  22.110  -3.727 -44.714
   15   1HG2  VAL   2          1HG2      VAL   2  20.218  -4.539 -42.411
   16   2HG2  VAL   2          2HG2      VAL   2  20.344  -2.981 -43.228
   17   3HG2  VAL   2          3HG2      VAL   2  20.528  -3.076 -41.477
   18    H    VAL   3           H        VAL   3  24.529  -3.079 -40.721
   19    HA   VAL   3           HA       VAL   3  26.794  -3.907 -42.056
   20    HB   VAL   3           HB       VAL   3  26.663  -1.756 -40.911
   21   1HG1  VAL   3          1HG1      VAL   3  25.379  -2.419 -38.956
   22   2HG1  VAL   3          2HG1      VAL   3  26.859  -1.585 -38.477
   23   3HG1  VAL   3          3HG1      VAL   3  26.757  -3.342 -38.348
   24   1HG2  VAL   3          1HG2      VAL   3  28.880  -2.606 -41.362
   25   2HG2  VAL   3          2HG2      VAL   3  28.873  -3.507 -39.845
   26   3HG2  VAL   3          3HG2      VAL   3  28.873  -1.744 -39.822
   27    H    VAL   4           H        VAL   4  28.384  -5.408 -41.650
   28    HA   VAL   4           HA       VAL   4  27.690  -7.674 -40.124
   29    HB   VAL   4           HB       VAL   4  29.104  -8.017 -41.981
   30   1HG1  VAL   4          1HG1      VAL   4  30.193  -5.854 -42.112
   31   2HG1  VAL   4          2HG1      VAL   4  31.395  -7.144 -42.139
   32   3HG1  VAL   4          3HG1      VAL   4  31.129  -6.217 -40.661
   33   1HG2  VAL   4          1HG2      VAL   4  30.986  -9.260 -41.030
   34   2HG2  VAL   4          2HG2      VAL   4  29.481  -9.557 -40.161
   35   3HG2  VAL   4          3HG2      VAL   4  30.697  -8.480 -39.475
   36    H    THR   5           H        THR   5  28.326  -8.401 -38.225
   37    HA   THR   5           HA       THR   5  29.341  -6.360 -36.398
   38    HB   THR   5           HB       THR   5  27.029  -7.108 -35.977
   39    HG1  THR   5           1HG      THR   5  29.087  -7.394 -34.125
   40   1HG2  THR   5          1HG2      THR   5  26.578  -9.361 -35.137
   41   2HG2  THR   5          2HG2      THR   5  28.259  -9.814 -35.434
   42   3HG2  THR   5          3HG2      THR   5  27.201  -9.408 -36.788
   43    HA   PRO   6           HA       PRO   6  32.799  -9.075 -35.788
   44   1HB   PRO   6          2HB       PRO   6  34.174  -7.428 -34.153
   45   2HB   PRO   6          1HB       PRO   6  34.010  -7.134 -35.885
   46   1HG   PRO   6          2HG       PRO   6  32.793  -5.708 -33.633
   47   2HG   PRO   6          1HG       PRO   6  33.013  -5.185 -35.309
   48   1HD   PRO   6          2HD       PRO   6  30.647  -6.241 -34.053
   49   2HD   PRO   6          1HD       PRO   6  30.838  -5.641 -35.709
   50    H    ALA   7           H        ALA   7  34.154  -9.766 -33.960
   51    HA   ALA   7           HA       ALA   7  32.510 -10.367 -31.595
   52   1HB   ALA   7          1HB       ALA   7  34.704 -12.048 -32.823
   53   2HB   ALA   7          2HB       ALA   7  32.974 -12.376 -32.918
   54   3HB   ALA   7          3HB       ALA   7  33.801 -12.447 -31.363
   55    H    HIS   8           H        HIS   8  33.928 -10.960 -29.660
   56    HA   HIS   8           HA       HIS   8  35.238 -10.155 -27.999
   57   1HB   HIS   8          2HB       HIS   8  37.052 -10.524 -29.729
   58   2HB   HIS   8          1HB       HIS   8  36.898  -8.817 -30.128
   59    HD1  HIS   8           1HD      HIS   8  38.077 -11.095 -27.350
   60    HD2  HIS   8           2HD      HIS   8  38.132  -7.065 -28.388
   61    HE1  HIS   8           1HE      HIS   8  39.656  -9.960 -25.733
   62    H    GLU   9           H        GLU   9  33.403  -8.412 -30.027
   63    HA   GLU   9           HA       GLU   9  33.919  -5.734 -29.342
   64   1HB   GLU   9          2HB       GLU   9  31.644  -5.251 -30.089
   65   2HB   GLU   9          1HB       GLU   9  32.444  -6.351 -31.203
   66   1HG   GLU   9          2HG       GLU   9  31.199  -8.203 -30.412
   67   2HG   GLU   9          1HG       GLU   9  30.587  -7.280 -29.039
   68    H    ALA  10           H        ALA  10  33.271  -4.445 -27.703
   69    HA   ALA  10           HA       ALA  10  31.683  -5.686 -25.571
   70   1HB   ALA  10          1HB       ALA  10  34.036  -5.642 -24.877
   71   2HB   ALA  10          2HB       ALA  10  33.060  -4.553 -23.891
   72   3HB   ALA  10          3HB       ALA  10  34.088  -3.904 -25.168
   73    H    VAL  11           H        VAL  11  30.174  -4.565 -27.063
   74    HA   VAL  11           HA       VAL  11  29.978  -1.719 -26.852
   75    HB   VAL  11           HB       VAL  11  27.949  -3.688 -27.846
   76   1HG1  VAL  11          1HG1      VAL  11  26.931  -1.569 -27.237
   77   2HG1  VAL  11          2HG1      VAL  11  26.931  -1.772 -28.990
   78   3HG1  VAL  11          3HG1      VAL  11  28.110  -0.705 -28.224
   79   1HG2  VAL  11          1HG2      VAL  11  29.993  -3.819 -29.153
   80   2HG2  VAL  11          2HG2      VAL  11  29.965  -2.070 -29.392
   81   3HG2  VAL  11          3HG2      VAL  11  28.700  -3.079 -30.097
   82    H    VAL  12           H        VAL  12  28.236  -4.506 -25.665
   83    HA   VAL  12           HA       VAL  12  26.425  -4.675 -24.307
   84    HB   VAL  12           HB       VAL  12  28.788  -3.877 -22.712
   85   1HG1  VAL  12          1HG1      VAL  12  26.267  -5.254 -21.784
   86   2HG1  VAL  12          2HG1      VAL  12  26.834  -3.665 -21.273
   87   3HG1  VAL  12          3HG1      VAL  12  27.736  -5.110 -20.818
   88   1HG2  VAL  12          1HG2      VAL  12  29.084  -6.308 -22.449
   89   2HG2  VAL  12          2HG2      VAL  12  29.157  -5.781 -24.132
   90   3HG2  VAL  12          3HG2      VAL  12  27.699  -6.555 -23.513
   91    H    ARG  13           H        ARG  13  25.133  -3.031 -25.018
   92    HA   ARG  13           HA       ARG  13  24.623  -1.014 -23.024
   93   1HB   ARG  13          2HB       ARG  13  25.191  -0.467 -25.862
   94   2HB   ARG  13          1HB       ARG  13  23.997   0.527 -25.048
   95   1HG   ARG  13          2HG       ARG  13  26.836   0.114 -24.181
   96   2HG   ARG  13          1HG       ARG  13  26.218   1.534 -25.022
   97   1HD   ARG  13          2HD       ARG  13  26.133   2.289 -22.864
   98   2HD   ARG  13          1HD       ARG  13  24.532   1.560 -22.987
   99    HE   ARG  13           HE       ARG  13  26.553  -0.259 -22.043
  100   1HH1  ARG  13          1HH1      ARG  13  24.147   2.115 -21.113
  101   2HH1  ARG  13          2HH1      ARG  13  24.172   1.665 -19.433
  102   1HH2  ARG  13          1HH2      ARG  13  26.599  -0.852 -19.851
  103   2HH2  ARG  13          2HH2      ARG  13  25.570  -0.029 -18.713
  104    H    VAL  14           H        VAL  14  22.602  -0.772 -22.584
  105    HA   VAL  14           HA       VAL  14  20.633  -2.176 -24.225
  106    HB   VAL  14           HB       VAL  14  20.217  -1.564 -21.339
  107   1HG1  VAL  14          1HG1      VAL  14  18.310  -2.318 -22.647
  108   2HG1  VAL  14          2HG1      VAL  14  18.742  -3.510 -21.420
  109   3HG1  VAL  14          3HG1      VAL  14  19.189  -3.776 -23.105
  110   1HG2  VAL  14          1HG2      VAL  14  22.356  -2.727 -21.388
  111   2HG2  VAL  14          2HG2      VAL  14  21.649  -4.011 -22.369
  112   3HG2  VAL  14          3HG2      VAL  14  21.104  -3.768 -20.709
  113    H    GLY  15           H        GLY  15  18.545  -1.262 -24.196
  114   1HA   GLY  15          2HA       GLY  15  18.103   1.348 -23.201
  115   2HA   GLY  15          1HA       GLY  15  18.238   1.289 -24.951
  116    H    THR  16           H        THR  16  16.675  -0.371 -22.285
  117    HA   THR  16           HA       THR  16  14.601  -1.493 -23.824
  118    HB   THR  16           HB       THR  16  14.395  -0.997 -20.877
  119    HG1  THR  16           1HG      THR  16  15.660  -3.321 -21.346
  120   1HG2  THR  16          1HG2      THR  16  13.670  -3.323 -22.649
  121   2HG2  THR  16          2HG2      THR  16  12.551  -2.124 -22.003
  122   3HG2  THR  16          3HG2      THR  16  13.387  -3.231 -20.913
  123    H    LYS  17           H        LYS  17  14.883   1.276 -21.773
  124    HA   LYS  17           HA       LYS  17  13.404   2.887 -21.085
  125   1HB   LYS  17          2HB       LYS  17  13.367   2.956 -24.083
  126   2HB   LYS  17          1HB       LYS  17  12.639   4.225 -23.104
  127   1HG   LYS  17          2HG       LYS  17  15.539   3.412 -23.193
  128   2HG   LYS  17          1HG       LYS  17  14.829   4.925 -23.764
  129   1HD   LYS  17          2HD       LYS  17  14.181   5.476 -21.461
  130   2HD   LYS  17          1HD       LYS  17  14.912   3.970 -20.903
  131   1HE   LYS  17          2HE       LYS  17  17.088   4.751 -21.770
  132   2HE   LYS  17          1HE       LYS  17  16.336   6.287 -22.207
  133   1HZ   LYS  17          1HZ       LYS  17  17.456   6.441 -20.077
  134   2HZ   LYS  17          2HZ       LYS  17  16.529   5.162 -19.464
  135   3HZ   LYS  17          3HZ       LYS  17  15.782   6.626 -19.874
  136    HA   PRO  18           HA       PRO  18   9.681   0.173 -21.534
  137   1HB   PRO  18          2HB       PRO  18   9.447   0.626 -18.645
  138   2HB   PRO  18          1HB       PRO  18   9.535  -0.895 -19.539
  139   1HG   PRO  18          2HG       PRO  18  11.566  -0.058 -18.019
  140   2HG   PRO  18          1HG       PRO  18  11.842  -0.910 -19.551
  141   1HD   PRO  18          2HD       PRO  18  11.931   2.040 -18.991
  142   2HD   PRO  18          1HD       PRO  18  13.086   1.041 -19.900
  143    H    GLY  19           H        GLY  19   7.523   0.475 -20.866
  144   1HA   GLY  19          2HA       GLY  19   6.694   3.187 -20.178
  145   2HA   GLY  19          1HA       GLY  19   6.201   2.549 -21.739
  146    H    THR  20           H        THR  20   5.706  -0.026 -21.175
  147    HA   THR  20           HA       THR  20   3.137   0.022 -20.005
  148    HB   THR  20           HB       THR  20   4.876  -2.394 -20.550
  149    HG1  THR  20           1HG      THR  20   3.591  -0.597 -22.229
  150   1HG2  THR  20          1HG2      THR  20   2.880  -2.877 -19.231
  151   2HG2  THR  20          2HG2      THR  20   2.729  -3.544 -20.857
  152   3HG2  THR  20          3HG2      THR  20   1.879  -2.059 -20.428
  153    H    GLU  21           H        GLU  21   6.306  -0.817 -18.808
  154    HA   GLU  21           HA       GLU  21   5.205  -1.208 -16.159
  155   1HB   GLU  21          2HB       GLU  21   7.259  -2.542 -15.689
  156   2HB   GLU  21          1HB       GLU  21   6.209  -3.261 -16.898
  157   1HG   GLU  21          2HG       GLU  21   7.708  -2.263 -18.645
  158   2HG   GLU  21          1HG       GLU  21   8.814  -1.838 -17.339
  159    H    VAL  22           H        VAL  22   6.176  -0.122 -14.526
  160    HA   VAL  22           HA       VAL  22   7.172   2.435 -15.374
  161    HB   VAL  22           HB       VAL  22   6.582   1.451 -12.583
  162   1HG1  VAL  22          1HG1      VAL  22   6.821   4.259 -13.655
  163   2HG1  VAL  22          2HG1      VAL  22   7.999   3.444 -12.626
  164   3HG1  VAL  22          3HG1      VAL  22   6.387   3.810 -12.006
  165   1HG2  VAL  22          1HG2      VAL  22   4.642   1.251 -14.036
  166   2HG2  VAL  22          2HG2      VAL  22   4.827   2.933 -14.533
  167   3HG2  VAL  22          3HG2      VAL  22   4.416   2.548 -12.861
  168    HA   PRO  23           HA       PRO  23  11.506   1.646 -14.852
  169   1HB   PRO  23          2HB       PRO  23  11.485   4.587 -14.413
  170   2HB   PRO  23          1HB       PRO  23  12.493   3.620 -15.496
  171   1HG   PRO  23          2HG       PRO  23  10.474   5.030 -16.470
  172   2HG   PRO  23          1HG       PRO  23  10.805   3.397 -17.079
  173   1HD   PRO  23          2HD       PRO  23   8.705   4.304 -15.180
  174   2HD   PRO  23          1HD       PRO  23   8.603   3.111 -16.484
  175    HA   PRO  24           HA       PRO  24  11.614   1.088 -10.501
  176   1HB   PRO  24          2HB       PRO  24  14.377   0.844 -10.312
  177   2HB   PRO  24          1HB       PRO  24  13.250  -0.465 -10.684
  178   1HG   PRO  24          2HG       PRO  24  14.842   1.249 -12.550
  179   2HG   PRO  24          1HG       PRO  24  14.548  -0.502 -12.611
  180   1HD   PRO  24          2HD       PRO  24  13.167   1.098 -14.196
  181   2HD   PRO  24          1HD       PRO  24  12.338  -0.214 -13.332
  182    H    VAL  25           H        VAL  25  11.811   2.263  -8.782
  183    HA   VAL  25           HA       VAL  25  13.110   4.866  -8.899
  184    HB   VAL  25           HB       VAL  25  11.314   3.714  -6.745
  185   1HG1  VAL  25          1HG1      VAL  25  12.754   5.491  -5.916
  186   2HG1  VAL  25          2HG1      VAL  25  11.077   6.035  -6.000
  187   3HG1  VAL  25          3HG1      VAL  25  12.234   6.544  -7.234
  188   1HG2  VAL  25          1HG2      VAL  25  10.652   5.590  -9.012
  189   2HG2  VAL  25          2HG2      VAL  25   9.562   5.148  -7.695
  190   3HG2  VAL  25          3HG2      VAL  25  10.105   3.921  -8.843
  191    H    ILE  26           H        ILE  26  14.562   5.494  -7.270
  192    HA   ILE  26           HA       ILE  26  16.627   3.641  -6.947
  193    HB   ILE  26           HB       ILE  26  16.245   6.383  -5.749
  194   1HG1  ILE  26          2HG1      ILE  26  18.177   6.846  -7.380
  195   2HG1  ILE  26          1HG1      ILE  26  17.793   5.286  -8.091
  196   1HG2  ILE  26          1HG2      ILE  26  17.713   5.111  -4.277
  197   2HG2  ILE  26          2HG2      ILE  26  18.612   6.352  -5.148
  198   3HG2  ILE  26          3HG2      ILE  26  18.722   4.666  -5.654
  199   1HD1  ILE  26          1HD1      ILE  26  15.837   7.556  -7.850
  200   2HD1  ILE  26          2HD1      ILE  26  15.624   6.044  -8.737
  201   3HD1  ILE  26          3HD1      ILE  26  16.815   7.225  -9.279
  202    H    ASP  27           H        ASP  27  14.006   4.409  -4.862
  203    HA   ASP  27           HA       ASP  27  15.283   3.102  -2.596
  204   1HB   ASP  27          2HB       ASP  27  12.727   4.686  -2.748
  205   2HB   ASP  27          1HB       ASP  27  13.301   3.879  -1.299
  206    H    GLY  28           H        GLY  28  13.583   2.312  -5.165
  207   1HA   GLY  28          2HA       GLY  28  11.422   0.772  -4.205
  208   2HA   GLY  28          1HA       GLY  28  12.180   0.599  -5.784
  209    H    SER  29           H        SER  29  14.719   0.351  -4.022
  210    HA   SER  29           HA       SER  29  14.789  -2.531  -4.040
  211   1HB   SER  29          2HB       SER  29  16.767  -0.587  -2.860
  212   2HB   SER  29          1HB       SER  29  17.066  -2.274  -3.271
  213    HG   SER  29           HG       SER  29  17.244  -1.771  -5.324
  214    H    ILE  30           H        ILE  30  14.727   0.016  -1.692
  215    HA   ILE  30           HA       ILE  30  14.850  -1.621   0.632
  216    HB   ILE  30           HB       ILE  30  13.407   0.911   1.010
  217   1HG1  ILE  30          2HG1      ILE  30  14.793   1.617  -0.913
  218   2HG1  ILE  30          1HG1      ILE  30  15.281   2.412   0.582
  219   1HG2  ILE  30          1HG2      ILE  30  15.985  -0.140   2.154
  220   2HG2  ILE  30          2HG2      ILE  30  14.370  -0.384   2.820
  221   3HG2  ILE  30          3HG2      ILE  30  15.058   1.237   2.752
  222   1HD1  ILE  30          1HD1      ILE  30  17.169   0.885   0.798
  223   2HD1  ILE  30          2HD1      ILE  30  17.210   1.751  -0.738
  224   3HD1  ILE  30          3HD1      ILE  30  16.684   0.068  -0.688
  225    H    TRP  31           H        TRP  31  12.382  -0.223  -1.373
  226    HA   TRP  31           HA       TRP  31  10.183  -0.830   0.305
  227   1HB   TRP  31          2HB       TRP  31  10.306  -0.267  -2.666
  228   2HB   TRP  31          1HB       TRP  31   8.822  -0.346  -1.718
  229    HD1  TRP  31           HD       TRP  31  10.682   2.236  -3.168
  230    HE1  TRP  31           1HE      TRP  31  10.656   4.428  -1.810
  231    HE3  TRP  31           3HE      TRP  31   9.217   0.348   1.285
  232    HZ2  TRP  31           2HZ      TRP  31  10.149   5.207   0.831
  233    HZ3  TRP  31           3HZ      TRP  31   9.002   1.861   3.210
  234    HH2  TRP  31           HH       TRP  31   9.459   4.245   2.981
  235    H    ASP  32           H        ASP  32  11.813  -2.538  -2.296
  236    HA   ASP  32           HA       ASP  32   9.914  -4.656  -2.422
  237   1HB   ASP  32          2HB       ASP  32  11.135  -4.252  -4.393
  238   2HB   ASP  32          1HB       ASP  32  12.677  -4.216  -3.526
  239    H    ALA  33           H        ALA  33  13.037  -4.137  -0.789
  240    HA   ALA  33           HA       ALA  33  13.178  -6.785   0.198
  241   1HB   ALA  33          1HB       ALA  33  15.163  -5.382  -0.036
  242   2HB   ALA  33          2HB       ALA  33  14.983  -5.985   1.609
  243   3HB   ALA  33          3HB       ALA  33  14.557  -4.315   1.231
  244    H    ILE  34           H        ILE  34  11.859  -3.756   1.475
  245    HA   ILE  34           HA       ILE  34  11.121  -4.707   4.032
  246    HB   ILE  34           HB       ILE  34   9.870  -2.628   2.252
  247   1HG1  ILE  34          2HG1      ILE  34  11.514  -2.388   4.784
  248   2HG1  ILE  34          1HG1      ILE  34  12.119  -2.123   3.153
  249   1HG2  ILE  34          1HG2      ILE  34   8.600  -1.871   4.243
  250   2HG2  ILE  34          2HG2      ILE  34   9.135  -3.319   5.097
  251   3HG2  ILE  34          3HG2      ILE  34   8.107  -3.464   3.669
  252   1HD1  ILE  34          1HD1      ILE  34  10.571  -0.237   2.909
  253   2HD1  ILE  34          2HD1      ILE  34  11.689  -0.020   4.254
  254   3HD1  ILE  34          3HD1      ILE  34  10.020  -0.495   4.564
  255    H    ALA  35           H        ALA  35   9.387  -4.666   0.942
  256    HA   ALA  35           HA       ALA  35   7.038  -5.927   1.744
  257   1HB   ALA  35          1HB       ALA  35   7.324  -4.894  -0.453
  258   2HB   ALA  35          2HB       ALA  35   6.767  -6.560  -0.598
  259   3HB   ALA  35          3HB       ALA  35   8.457  -6.165  -0.906
  260    H    GLY  36           H        GLY  36  10.166  -7.213   0.831
  261   1HA   GLY  36          2HA       GLY  36   9.337  -9.964   0.849
  262   2HA   GLY  36          1HA       GLY  36  10.994  -9.377   0.819
  263    H    CYS  37           H        CYS  37  10.298  -7.712   3.235
  264    HA   CYS  37           HA       CYS  37  11.092  -9.683   5.178
  265   1HB   CYS  37          2HB       CYS  37  12.282  -7.651   5.303
  266   2HB   CYS  37          1HB       CYS  37  10.812  -6.691   5.185
  267    H    GLU  38           H        GLU  38   8.431  -7.330   4.896
  268    HA   GLU  38           HA       GLU  38   7.267  -8.386   7.336
  269   1HB   GLU  38          2HB       GLU  38   7.488  -5.900   6.747
  270   2HB   GLU  38          1HB       GLU  38   6.154  -6.165   5.634
  271   1HG   GLU  38          2HG       GLU  38   5.357  -5.255   7.727
  272   2HG   GLU  38          1HG       GLU  38   4.748  -6.895   7.496
  273    H    ALA  39           H        ALA  39   6.752  -8.403   3.906
  274    HA   ALA  39           HA       ALA  39   4.175  -9.713   4.311
  275   1HB   ALA  39          1HB       ALA  39   3.615  -9.103   2.025
  276   2HB   ALA  39          2HB       ALA  39   5.217  -8.390   1.823
  277   3HB   ALA  39          3HB       ALA  39   4.074  -7.683   2.967
  278    H    GLY  40           H        GLY  40   7.338 -10.420   3.617
  279   1HA   GLY  40          2HA       GLY  40   8.290 -12.481   3.085
  280   2HA   GLY  40          1HA       GLY  40   6.676 -13.107   2.760
  281    H    GLY  41           H        GLY  41   7.023 -10.202   1.321
  282   1HA   GLY  41          2HA       GLY  41   7.595  -9.507  -0.789
  283   2HA   GLY  41          1HA       GLY  41   8.129 -11.143  -1.192
  284    H    ASN  42           H        ASN  42   5.124  -9.539  -0.168
  285    HA   ASN  42           HA       ASN  42   3.714 -10.759  -2.398
  286   1HB   ASN  42          2HB       ASN  42   3.539 -12.298  -0.416
  287   2HB   ASN  42          1HB       ASN  42   2.763 -10.987   0.465
  288   1HD2  ASN  42          1HD2      ASN  42   2.149 -11.526  -2.946
  289   2HD2  ASN  42          2HD2      ASN  42   0.528 -12.105  -2.743
  290    H    TRP  43           H        TRP  43   3.161  -8.905  -3.339
  291    HA   TRP  43           HA       TRP  43   2.551  -6.574  -1.735
  292   1HB   TRP  43          2HB       TRP  43   2.575  -6.908  -4.738
  293   2HB   TRP  43          1HB       TRP  43   2.507  -5.383  -3.859
  294    HD1  TRP  43           HD       TRP  43   4.924  -8.423  -4.012
  295    HE1  TRP  43           1HE      TRP  43   7.339  -7.527  -3.935
  296    HE3  TRP  43           3HE      TRP  43   3.921  -3.452  -3.572
  297    HZ2  TRP  43           2HZ      TRP  43   8.655  -5.019  -3.709
  298    HZ3  TRP  43           3HZ      TRP  43   5.779  -1.862  -3.447
  299    HH2  TRP  43           HH       TRP  43   8.115  -2.658  -3.533
  300    H    ALA  44           H        ALA  44   0.884  -9.160  -2.795
  301    HA   ALA  44           HA       ALA  44  -1.646  -7.681  -3.074
  302   1HB   ALA  44          1HB       ALA  44  -2.551  -9.658  -4.165
  303   2HB   ALA  44          2HB       ALA  44  -1.037 -10.518  -3.901
  304   3HB   ALA  44          3HB       ALA  44  -1.082  -9.124  -4.979
  305    H    ILE  45           H        ILE  45   0.009  -8.853  -0.670
  306    HA   ILE  45           HA       ILE  45  -1.775 -10.669   0.580
  307    HB   ILE  45           HB       ILE  45   0.775 -10.437   0.928
  308   1HG1  ILE  45          2HG1      ILE  45  -1.051 -10.660   3.317
  309   2HG1  ILE  45          1HG1      ILE  45  -0.681 -11.951   2.180
  310   1HG2  ILE  45          1HG2      ILE  45   0.823  -8.058   1.446
  311   2HG2  ILE  45          2HG2      ILE  45   1.469  -9.016   2.778
  312   3HG2  ILE  45          3HG2      ILE  45  -0.158  -8.344   2.883
  313   1HD1  ILE  45          1HD1      ILE  45   1.672 -11.860   2.862
  314   2HD1  ILE  45          2HD1      ILE  45   0.600 -12.210   4.218
  315   3HD1  ILE  45          3HD1      ILE  45   1.274 -10.592   4.022
  316    H    ASN  46           H        ASN  46  -3.186 -10.262   2.253
  317    HA   ASN  46           HA       ASN  46  -3.492  -7.511   3.198
  318   1HB   ASN  46          2HB       ASN  46  -5.085  -8.096   1.176
  319   2HB   ASN  46          1HB       ASN  46  -5.996  -8.965   2.408
  320   1HD2  ASN  46          1HD2      ASN  46  -6.547  -6.500   0.817
  321   2HD2  ASN  46          2HD2      ASN  46  -6.948  -5.289   1.986
  322    H    THR  47           H        THR  47  -2.951  -7.917   5.186
  323    HA   THR  47           HA       THR  47  -3.437 -10.376   6.493
  324    HB   THR  47           HB       THR  47  -2.611  -9.017   8.521
  325    HG1  THR  47           1HG      THR  47  -1.416  -7.113   7.106
  326   1HG2  THR  47          1HG2      THR  47  -0.871  -9.180   6.056
  327   2HG2  THR  47          2HG2      THR  47  -1.164 -10.496   7.191
  328   3HG2  THR  47          3HG2      THR  47  -0.302  -9.051   7.721
  329    H    GLY  48           H        GLY  48  -5.211  -7.456   6.174
  330   1HA   GLY  48          2HA       GLY  48  -7.438  -7.121   6.825
  331   2HA   GLY  48          1HA       GLY  48  -7.287  -8.470   7.948
  332    H    ASN  49           H        ASN  49  -4.721  -6.242   7.865
  333    HA   ASN  49           HA       ASN  49  -5.353  -5.496  10.612
  334   1HB   ASN  49          2HB       ASN  49  -2.860  -5.205   8.937
  335   2HB   ASN  49          1HB       ASN  49  -3.006  -4.526  10.554
  336   1HD2  ASN  49          1HD2      ASN  49  -1.293  -5.802  11.260
  337   2HD2  ASN  49          2HD2      ASN  49  -1.489  -7.496  11.561
  338    H    GLY  50           H        GLY  50  -5.974  -4.254   7.641
  339   1HA   GLY  50          2HA       GLY  50  -6.868  -2.121   7.173
  340   2HA   GLY  50          1HA       GLY  50  -6.089  -1.500   8.630
  341    H    TYR  51           H        TYR  51  -3.842  -3.362   7.374
  342    HA   TYR  51           HA       TYR  51  -2.659  -1.246   5.726
  343   1HB   TYR  51          2HB       TYR  51  -1.021  -3.431   6.999
  344   2HB   TYR  51          1HB       TYR  51  -0.500  -1.865   6.422
  345    HD1  TYR  51           1HD      TYR  51  -3.179  -0.805   8.134
  346    HD2  TYR  51           2HD      TYR  51   0.512  -2.769   8.910
  347    HE1  TYR  51           1HE      TYR  51  -3.226   0.021  10.456
  348    HE2  TYR  51           2HE      TYR  51   0.477  -1.947  11.225
  349    HH   TYR  51           HH       TYR  51  -2.248  -0.713  12.690
  350    H    TYR  52           H        TYR  52  -1.482  -2.006   3.869
  351    HA   TYR  52           HA       TYR  52  -2.818  -4.429   2.885
  352   1HB   TYR  52          2HB       TYR  52  -2.251  -1.865   1.402
  353   2HB   TYR  52          1HB       TYR  52  -2.942  -3.318   0.676
  354    HD1  TYR  52           1HD      TYR  52  -3.512  -0.691   3.214
  355    HD2  TYR  52           2HD      TYR  52  -5.240  -3.825   0.926
  356    HE1  TYR  52           1HE      TYR  52  -5.737   0.019   3.956
  357    HE2  TYR  52           2HE      TYR  52  -7.482  -3.130   1.654
  358    HH   TYR  52           HH       TYR  52  -8.144  -0.203   3.071
  359    H    GLY  53           H        GLY  53  -1.771  -5.162   0.720
  360   1HA   GLY  53          2HA       GLY  53   0.493  -6.493   1.613
  361   2HA   GLY  53          1HA       GLY  53  -0.083  -6.487  -0.039
  362    H    GLY  54           H        GLY  54   2.507  -6.770   0.332
  363   1HA   GLY  54          2HA       GLY  54   4.377  -5.949  -0.743
  364   2HA   GLY  54          1HA       GLY  54   3.517  -4.443  -1.035
  365    H    VAL  55           H        VAL  55   3.825  -2.733   0.300
  366    HA   VAL  55           HA       VAL  55   6.122  -2.916   2.070
  367    HB   VAL  55           HB       VAL  55   4.516  -0.414   1.706
  368   1HG1  VAL  55          1HG1      VAL  55   6.432  -0.543   3.290
  369   2HG1  VAL  55          2HG1      VAL  55   6.624   0.669   2.024
  370   3HG1  VAL  55          3HG1      VAL  55   7.484  -0.866   1.913
  371   1HG2  VAL  55          1HG2      VAL  55   4.786  -1.299  -0.554
  372   2HG2  VAL  55          2HG2      VAL  55   6.515  -1.510  -0.275
  373   3HG2  VAL  55          3HG2      VAL  55   5.820   0.109  -0.311
  374    H    GLN  56           H        GLN  56   2.879  -3.352   2.344
  375    HA   GLN  56           HA       GLN  56   1.514  -3.828   4.066
  376   1HB   GLN  56          2HB       GLN  56   3.511  -5.293   4.523
  377   2HB   GLN  56          1HB       GLN  56   4.032  -4.094   5.698
  378   1HG   GLN  56          2HG       GLN  56   2.915  -5.882   6.839
  379   2HG   GLN  56          1HG       GLN  56   1.919  -4.431   6.929
  380   1HE2  GLN  56          1HE2      GLN  56   2.162  -6.338   4.033
  381   2HE2  GLN  56          2HE2      GLN  56   0.560  -6.982   4.083
  382    H    PHE  57           H        PHE  57   1.517  -1.137   3.745
  383    HA   PHE  57           HA       PHE  57   1.436  -0.276   6.540
  384   1HB   PHE  57          2HB       PHE  57   1.894   2.041   5.854
  385   2HB   PHE  57          1HB       PHE  57   3.218   0.934   5.550
  386    HD1  PHE  57           1HD      PHE  57   3.105  -0.093   3.023
  387    HD2  PHE  57           2HD      PHE  57   1.523   3.644   4.305
  388    HE1  PHE  57           1HE      PHE  57   3.319   0.777   0.736
  389    HE2  PHE  57           2HE      PHE  57   1.730   4.520   2.016
  390    HZ   PHE  57           HZ       PHE  57   2.641   3.089   0.224
  391    H    ASP  58           H        ASP  58  -0.046   1.692   6.842
  392    HA   ASP  58           HA       ASP  58  -2.533   0.356   6.513
  393   1HB   ASP  58          2HB       ASP  58  -3.454   2.039   7.997
  394   2HB   ASP  58          1HB       ASP  58  -1.933   1.422   8.628
  395    H    GLN  59           H        GLN  59  -4.533   1.358   6.003
  396    HA   GLN  59           HA       GLN  59  -4.768   2.345   3.446
  397   1HB   GLN  59          2HB       GLN  59  -6.544   1.282   4.830
  398   2HB   GLN  59          1HB       GLN  59  -6.622   2.746   5.795
  399   1HG   GLN  59          2HG       GLN  59  -8.401   2.877   4.294
  400   2HG   GLN  59          1HG       GLN  59  -7.168   3.976   3.689
  401   1HE2  GLN  59          1HE2      GLN  59  -5.974   3.371   1.825
  402   2HE2  GLN  59          2HE2      GLN  59  -6.587   2.186   0.713
  403    H    GLY  60           H        GLY  60  -4.565   4.025   6.518
  404   1HA   GLY  60          2HA       GLY  60  -5.457   6.559   5.582
  405   2HA   GLY  60          1HA       GLY  60  -4.661   6.244   7.116
  406    H    THR  61           H        THR  61  -2.218   5.385   6.471
  407    HA   THR  61           HA       THR  61  -0.814   7.667   5.662
  408    HB   THR  61           HB       THR  61   0.061   4.811   5.736
  409    HG1  THR  61           1HG      THR  61  -0.097   5.139   7.809
  410   1HG2  THR  61          1HG2      THR  61   2.350   5.669   5.889
  411   2HG2  THR  61          2HG2      THR  61   1.743   7.312   5.690
  412   3HG2  THR  61          3HG2      THR  61   1.591   6.152   4.372
  413    H    TRP  62           H        TRP  62  -1.693   4.750   3.914
  414    HA   TRP  62           HA       TRP  62  -0.465   5.270   1.466
  415   1HB   TRP  62          2HB       TRP  62  -1.513   3.135   2.063
  416   2HB   TRP  62          1HB       TRP  62  -3.088   3.923   2.115
  417    HD1  TRP  62           HD       TRP  62  -4.284   4.447  -0.174
  418    HE1  TRP  62           1HE      TRP  62  -3.916   3.577  -2.563
  419    HE3  TRP  62           3HE      TRP  62   0.343   2.370   0.432
  420    HZ2  TRP  62           2HZ      TRP  62  -1.914   2.179  -4.023
  421    HZ3  TRP  62           3HZ      TRP  62   1.422   1.288  -1.487
  422    HH2  TRP  62           HH       TRP  62   0.343   1.181  -3.668
  423    H    GLU  63           H        GLU  63  -3.682   6.091   2.675
  424    HA   GLU  63           HA       GLU  63  -4.559   7.418   0.340
  425   1HB   GLU  63          2HB       GLU  63  -6.138   6.546   1.934
  426   2HB   GLU  63          1HB       GLU  63  -5.482   7.550   3.215
  427   1HG   GLU  63          2HG       GLU  63  -6.232   9.553   1.946
  428   2HG   GLU  63          1HG       GLU  63  -7.011   8.470   0.792
  429    H    ALA  64           H        ALA  64  -2.924   8.451   3.262
  430    HA   ALA  64           HA       ALA  64  -3.323  11.231   3.012
  431   1HB   ALA  64          1HB       ALA  64  -1.042   9.792   4.359
  432   2HB   ALA  64          2HB       ALA  64  -2.603  10.163   5.095
  433   3HB   ALA  64          3HB       ALA  64  -1.518  11.470   4.622
  434    H    ASN  65           H        ASN  65  -0.687   9.125   1.872
  435    HA   ASN  65           HA       ASN  65   0.673  11.336   0.637
  436   1HB   ASN  65          2HB       ASN  65   1.103   8.348   0.406
  437   2HB   ASN  65          1HB       ASN  65   2.161   9.569  -0.291
  438   1HD2  ASN  65          1HD2      ASN  65   0.654  10.000   2.846
  439   2HD2  ASN  65          2HD2      ASN  65   2.111   9.836   3.767
  440    H    GLY  66           H        GLY  66  -1.996   9.462  -0.133
  441   1HA   GLY  66          2HA       GLY  66  -3.438   9.950  -1.913
  442   2HA   GLY  66          1HA       GLY  66  -2.100  10.702  -2.768
  443    H    GLY  67           H        GLY  67  -2.603   7.445  -1.398
  444   1HA   GLY  67          2HA       GLY  67  -1.183   6.313  -3.631
  445   2HA   GLY  67          1HA       GLY  67  -1.845   5.443  -2.256
  446    H    LEU  68           H        LEU  68  -4.477   6.887  -2.847
  447    HA   LEU  68           HA       LEU  68  -5.687   4.686  -3.957
  448   1HB   LEU  68          2HB       LEU  68  -6.641   7.486  -3.562
  449   2HB   LEU  68          1HB       LEU  68  -7.691   6.237  -4.198
  450    HG   LEU  68           HG       LEU  68  -7.066   4.942  -2.057
  451   1HD1  LEU  68          1HD1      LEU  68  -5.259   6.300  -1.291
  452   2HD1  LEU  68          2HD1      LEU  68  -6.584   6.397  -0.133
  453   3HD1  LEU  68          3HD1      LEU  68  -6.293   7.727  -1.257
  454   1HD2  LEU  68          1HD2      LEU  68  -8.877   6.027  -0.822
  455   2HD2  LEU  68          2HD2      LEU  68  -9.290   5.810  -2.523
  456   3HD2  LEU  68          3HD2      LEU  68  -8.805   7.399  -1.926
  457    H    ARG  69           H        ARG  69  -4.391   7.475  -5.527
  458    HA   ARG  69           HA       ARG  69  -5.707   7.146  -8.013
  459   1HB   ARG  69          2HB       ARG  69  -3.949   8.609  -8.900
  460   2HB   ARG  69          1HB       ARG  69  -4.655   9.249  -7.421
  461   1HG   ARG  69          2HG       ARG  69  -2.755   8.497  -6.142
  462   2HG   ARG  69          1HG       ARG  69  -2.065   7.732  -7.575
  463   1HD   ARG  69          2HD       ARG  69  -1.048   9.939  -7.044
  464   2HD   ARG  69          1HD       ARG  69  -1.781   9.871  -8.646
  465    HE   ARG  69           HE       ARG  69  -3.618  10.859  -6.708
  466   1HH1  ARG  69          1HH1      ARG  69  -0.815  11.788  -8.609
  467   2HH1  ARG  69          2HH1      ARG  69  -1.244  13.475  -8.646
  468   1HH2  ARG  69          1HH2      ARG  69  -4.192  13.081  -6.782
  469   2HH2  ARG  69          2HH2      ARG  69  -3.155  14.204  -7.620
  470    H    TYR  70           H        TYR  70  -2.891   5.744  -6.514
  471    HA   TYR  70           HA       TYR  70  -1.926   4.459  -8.920
  472   1HB   TYR  70          2HB       TYR  70  -1.385   3.914  -5.987
  473   2HB   TYR  70          1HB       TYR  70  -0.432   3.299  -7.335
  474    HD1  TYR  70           1HD      TYR  70   1.208   4.729  -8.432
  475    HD2  TYR  70           2HD      TYR  70  -1.245   6.217  -5.301
  476    HE1  TYR  70           1HE      TYR  70   2.685   6.684  -8.207
  477    HE2  TYR  70           2HE      TYR  70   0.211   8.170  -5.075
  478    HH   TYR  70           HH       TYR  70   2.425   8.885  -5.564
  479    H    ALA  71           H        ALA  71  -3.889   3.975  -6.186
  480    HA   ALA  71           HA       ALA  71  -5.777   2.230  -6.987
  481   1HB   ALA  71          1HB       ALA  71  -5.072   0.023  -6.149
  482   2HB   ALA  71          2HB       ALA  71  -3.451   0.653  -5.854
  483   3HB   ALA  71          3HB       ALA  71  -4.068   0.542  -7.504
  484    HA   PRO  72           HA       PRO  72  -6.782   3.794  -2.983
  485   1HB   PRO  72          2HB       PRO  72  -8.871   1.815  -2.810
  486   2HB   PRO  72          1HB       PRO  72  -8.981   3.565  -2.893
  487   1HG   PRO  72          2HG       PRO  72  -9.637   1.828  -4.934
  488   2HG   PRO  72          1HG       PRO  72  -9.280   3.554  -5.125
  489   1HD   PRO  72          2HD       PRO  72  -7.681   1.228  -5.882
  490   2HD   PRO  72          1HD       PRO  72  -7.544   2.919  -6.402
  491    H    ARG  73           H        ARG  73  -5.578   0.756  -3.536
  492    HA   ARG  73           HA       ARG  73  -4.909   0.450  -0.743
  493   1HB   ARG  73          2HB       ARG  73  -5.730  -1.831  -0.563
  494   2HB   ARG  73          1HB       ARG  73  -7.066  -0.756  -0.966
  495   1HG   ARG  73          2HG       ARG  73  -6.645  -1.410  -3.379
  496   2HG   ARG  73          1HG       ARG  73  -5.630  -2.704  -2.725
  497   1HD   ARG  73          2HD       ARG  73  -8.038  -2.755  -1.277
  498   2HD   ARG  73          1HD       ARG  73  -8.488  -2.574  -2.972
  499    HE   ARG  73           HE       ARG  73  -6.678  -4.708  -2.026
  500   1HH1  ARG  73          1HH1      ARG  73  -9.426  -3.622  -3.931
  501   2HH1  ARG  73          2HH1      ARG  73  -9.702  -5.192  -4.633
  502   1HH2  ARG  73          1HH2      ARG  73  -7.042  -6.738  -2.964
  503   2HH2  ARG  73          2HH2      ARG  73  -8.352  -6.954  -4.092
  504    H    ALA  74           H        ALA  74  -3.035  -0.667  -0.469
  505    HA   ALA  74           HA       ALA  74  -1.185  -0.556  -2.539
  506   1HB   ALA  74          1HB       ALA  74   0.399  -1.472  -1.022
  507   2HB   ALA  74          2HB       ALA  74  -0.874  -2.175  -0.027
  508   3HB   ALA  74          3HB       ALA  74  -0.680  -0.424  -0.100
  509    H    ASP  75           H        ASP  75  -3.263  -3.196  -1.574
  510    HA   ASP  75           HA       ASP  75  -1.614  -5.121  -2.967
  511   1HB   ASP  75          2HB       ASP  75  -3.079  -6.823  -2.150
  512   2HB   ASP  75          1HB       ASP  75  -2.771  -5.701  -0.832
  513    H    LEU  76           H        LEU  76  -3.688  -2.858  -3.936
  514    HA   LEU  76           HA       LEU  76  -4.580  -4.430  -6.251
  515   1HB   LEU  76          2HB       LEU  76  -6.287  -3.045  -5.116
  516   2HB   LEU  76          1HB       LEU  76  -5.315  -1.617  -5.415
  517    HG   LEU  76           HG       LEU  76  -5.585  -2.026  -7.868
  518   1HD1  LEU  76          1HD1      LEU  76  -7.562  -4.096  -6.927
  519   2HD1  LEU  76          2HD1      LEU  76  -6.069  -4.398  -7.814
  520   3HD1  LEU  76          3HD1      LEU  76  -7.391  -3.524  -8.586
  521   1HD2  LEU  76          1HD2      LEU  76  -8.109  -1.648  -6.262
  522   2HD2  LEU  76          2HD2      LEU  76  -7.893  -1.204  -7.955
  523   3HD2  LEU  76          3HD2      LEU  76  -6.952  -0.393  -6.704
  524    H    ALA  77           H        ALA  77  -2.644  -1.735  -5.192
  525    HA   ALA  77           HA       ALA  77  -1.663  -1.045  -7.798
  526   1HB   ALA  77          1HB       ALA  77  -0.176   0.452  -6.569
  527   2HB   ALA  77          2HB       ALA  77  -0.661  -0.297  -5.048
  528   3HB   ALA  77          3HB       ALA  77  -1.837   0.613  -5.996
  529    H    THR  78           H        THR  78   0.677  -1.200  -8.313
  530    HA   THR  78           HA       THR  78   1.696  -3.779  -7.371
  531    HB   THR  78           HB       THR  78   3.013  -3.887  -9.383
  532    HG1  THR  78           1HG      THR  78   2.038  -1.240  -9.878
  533   1HG2  THR  78          1HG2      THR  78   0.704  -4.594  -9.574
  534   2HG2  THR  78          2HG2      THR  78   1.204  -3.803 -11.072
  535   3HG2  THR  78          3HG2      THR  78   0.200  -2.938  -9.904
  536    H    ARG  79           H        ARG  79   4.332  -3.572  -7.952
  537    HA   ARG  79           HA       ARG  79   5.370  -2.638  -5.569
  538   1HB   ARG  79          2HB       ARG  79   6.956  -2.882  -8.118
  539   2HB   ARG  79          1HB       ARG  79   7.526  -3.089  -6.466
  540   1HG   ARG  79          2HG       ARG  79   6.076  -5.074  -6.256
  541   2HG   ARG  79          1HG       ARG  79   5.635  -4.893  -7.955
  542   1HD   ARG  79          2HD       ARG  79   7.363  -6.250  -8.344
  543   2HD   ARG  79          1HD       ARG  79   8.354  -4.820  -8.066
  544    HE   ARG  79           HE       ARG  79   8.749  -5.589  -5.824
  545   1HH1  ARG  79          1HH1      ARG  79   6.991  -7.833  -7.870
  546   2HH1  ARG  79          2HH1      ARG  79   7.563  -9.249  -7.048
  547   1HH2  ARG  79          1HH2      ARG  79   9.555  -7.490  -4.753
  548   2HH2  ARG  79          2HH2      ARG  79   9.009  -9.060  -5.283
  549    H    GLU  80           H        GLU  80   5.549  -1.195  -8.781
  550    HA   GLU  80           HA       GLU  80   7.075   1.023  -8.054
  551   1HB   GLU  80          2HB       GLU  80   5.921   1.997 -10.211
  552   2HB   GLU  80          1HB       GLU  80   7.100   0.701 -10.299
  553   1HG   GLU  80          2HG       GLU  80   4.219   0.001 -10.103
  554   2HG   GLU  80          1HG       GLU  80   4.859   0.588 -11.637
  555    H    GLU  81           H        GLU  81   3.506   0.719  -8.237
  556    HA   GLU  81           HA       GLU  81   2.917   3.344  -7.475
  557   1HB   GLU  81          2HB       GLU  81   1.468   0.751  -7.011
  558   2HB   GLU  81          1HB       GLU  81   0.813   2.303  -6.525
  559   1HG   GLU  81          2HG       GLU  81  -0.177   1.757  -8.564
  560   2HG   GLU  81          1HG       GLU  81   0.989   3.022  -8.915
  561    H    GLN  82           H        GLN  82   3.290   0.421  -5.473
  562    HA   GLN  82           HA       GLN  82   2.761   1.669  -3.011
  563   1HB   GLN  82          2HB       GLN  82   4.487  -0.737  -3.573
  564   2HB   GLN  82          1HB       GLN  82   3.927  -0.247  -1.982
  565   1HG   GLN  82          2HG       GLN  82   1.573  -0.455  -2.985
  566   2HG   GLN  82          1HG       GLN  82   2.368  -1.386  -4.259
  567   1HE2  GLN  82          1HE2      GLN  82   1.499  -3.362  -3.721
  568   2HE2  GLN  82          2HE2      GLN  82   1.850  -4.173  -2.229
  569    H    ILE  83           H        ILE  83   5.705   1.204  -4.818
  570    HA   ILE  83           HA       ILE  83   7.563   2.146  -2.971
  571    HB   ILE  83           HB       ILE  83   7.473   2.136  -5.977
  572   1HG1  ILE  83          2HG1      ILE  83   9.392   0.762  -4.098
  573   2HG1  ILE  83          1HG1      ILE  83   7.868   0.043  -4.596
  574   1HG2  ILE  83          1HG2      ILE  83   9.660   3.299  -4.271
  575   2HG2  ILE  83          2HG2      ILE  83   8.724   4.108  -5.524
  576   3HG2  ILE  83          3HG2      ILE  83   9.869   2.841  -5.959
  577   1HD1  ILE  83          1HD1      ILE  83   8.596   0.119  -6.925
  578   2HD1  ILE  83          2HD1      ILE  83   9.717  -0.801  -5.921
  579   3HD1  ILE  83          3HD1      ILE  83  10.126   0.842  -6.421
  580    H    ALA  84           H        ALA  84   5.602   3.853  -5.358
  581    HA   ALA  84           HA       ALA  84   6.718   6.410  -4.915
  582   1HB   ALA  84          1HB       ALA  84   4.823   7.240  -6.197
  583   2HB   ALA  84          2HB       ALA  84   4.021   5.676  -6.038
  584   3HB   ALA  84          3HB       ALA  84   5.519   5.808  -6.957
  585    H    VAL  85           H        VAL  85   3.759   4.866  -3.677
  586    HA   VAL  85           HA       VAL  85   2.876   7.083  -2.164
  587    HB   VAL  85           HB       VAL  85   2.378   4.171  -1.611
  588   1HG1  VAL  85          1HG1      VAL  85   0.297   4.977  -0.573
  589   2HG1  VAL  85          2HG1      VAL  85   0.805   6.639  -0.875
  590   3HG1  VAL  85          3HG1      VAL  85   1.729   5.621   0.231
  591   1HG2  VAL  85          1HG2      VAL  85   0.348   4.440  -2.968
  592   2HG2  VAL  85          2HG2      VAL  85   1.818   4.686  -3.911
  593   3HG2  VAL  85          3HG2      VAL  85   0.862   6.074  -3.391
  594    H    ALA  86           H        ALA  86   4.694   4.170  -1.184
  595    HA   ALA  86           HA       ALA  86   4.964   4.920   1.523
  596   1HB   ALA  86          1HB       ALA  86   5.197   2.608   0.725
  597   2HB   ALA  86          2HB       ALA  86   6.596   3.130   1.665
  598   3HB   ALA  86          3HB       ALA  86   6.695   3.052  -0.095
  599    H    GLU  87           H        GLU  87   6.752   5.650  -1.368
  600    HA   GLU  87           HA       GLU  87   9.117   6.439   0.028
  601   1HB   GLU  87          2HB       GLU  87  10.047   7.136  -2.015
  602   2HB   GLU  87          1HB       GLU  87   9.074   5.725  -2.391
  603   1HG   GLU  87          2HG       GLU  87   8.421   6.977  -4.092
  604   2HG   GLU  87          1HG       GLU  87   7.293   7.638  -2.911
  605    H    VAL  88           H        VAL  88   6.198   8.157  -0.969
  606    HA   VAL  88           HA       VAL  88   7.093  10.744  -0.304
  607    HB   VAL  88           HB       VAL  88   4.279   9.639   0.092
  608   1HG1  VAL  88          1HG1      VAL  88   3.589  11.982   0.038
  609   2HG1  VAL  88          2HG1      VAL  88   5.272  12.491  -0.103
  610   3HG1  VAL  88          3HG1      VAL  88   4.713  11.684   1.369
  611   1HG2  VAL  88          1HG2      VAL  88   5.010   9.416  -2.224
  612   2HG2  VAL  88          2HG2      VAL  88   5.514  11.105  -2.253
  613   3HG2  VAL  88          3HG2      VAL  88   3.806  10.697  -2.084
  614    H    THR  89           H        THR  89   5.776   8.106   1.607
  615    HA   THR  89           HA       THR  89   5.646   9.463   4.069
  616    HB   THR  89           HB       THR  89   6.175   6.507   3.790
  617    HG1  THR  89           1HG      THR  89   4.139   7.901   2.694
  618   1HG2  THR  89          1HG2      THR  89   4.604   6.420   5.726
  619   2HG2  THR  89          2HG2      THR  89   4.619   8.185   5.753
  620   3HG2  THR  89          3HG2      THR  89   6.101   7.282   6.052
  621    H    ARG  90           H        ARG  90   8.171   7.486   2.550
  622    HA   ARG  90           HA       ARG  90   9.999   7.492   4.681
  623   1HB   ARG  90          2HB       ARG  90  11.459   6.414   3.272
  624   2HB   ARG  90          1HB       ARG  90   9.953   6.140   2.413
  625   1HG   ARG  90          2HG       ARG  90  11.237   6.786   0.673
  626   2HG   ARG  90          1HG       ARG  90  10.697   8.385   1.198
  627   1HD   ARG  90          2HD       ARG  90  12.733   8.900   2.168
  628   2HD   ARG  90          1HD       ARG  90  13.185   7.207   2.365
  629    HE   ARG  90           HE       ARG  90  13.137   7.481  -0.311
  630   1HH1  ARG  90          1HH1      ARG  90  14.606   9.482   2.171
  631   2HH1  ARG  90          2HH1      ARG  90  16.001   9.848   1.204
  632   1HH2  ARG  90          1HH2      ARG  90  14.967   7.969  -1.563
  633   2HH2  ARG  90          2HH2      ARG  90  16.212   8.997  -0.901
  634    H    LEU  91           H        LEU  91   9.294   9.850   2.247
  635    HA   LEU  91           HA       LEU  91  11.662  11.406   2.499
  636   1HB   LEU  91          2HB       LEU  91   8.941  12.564   1.912
  637   2HB   LEU  91          1HB       LEU  91  10.501  13.195   1.435
  638    HG   LEU  91           HG       LEU  91   9.191  10.713   0.360
  639   1HD1  LEU  91          1HD1      LEU  91   9.674  13.416  -0.883
  640   2HD1  LEU  91          2HD1      LEU  91   8.113  12.742  -0.417
  641   3HD1  LEU  91          3HD1      LEU  91   9.037  12.005  -1.726
  642   1HD2  LEU  91          1HD2      LEU  91  11.045  10.697  -1.260
  643   2HD2  LEU  91          2HD2      LEU  91  11.615  10.472   0.394
  644   3HD2  LEU  91          3HD2      LEU  91  11.797  12.036  -0.395
  645    H    ARG  92           H        ARG  92   8.769  11.128   4.356
  646    HA   ARG  92           HA       ARG  92   9.180  13.683   5.675
  647   1HB   ARG  92          2HB       ARG  92   6.965  11.761   6.271
  648   2HB   ARG  92          1HB       ARG  92   6.973  13.515   6.426
  649   1HG   ARG  92          2HG       ARG  92   6.835  13.820   4.092
  650   2HG   ARG  92          1HG       ARG  92   7.203  12.120   3.786
  651   1HD   ARG  92          2HD       ARG  92   4.667  13.375   4.716
  652   2HD   ARG  92          1HD       ARG  92   4.937  12.142   3.479
  653    HE   ARG  92           HE       ARG  92   5.685  11.026   5.881
  654   1HH1  ARG  92          1HH1      ARG  92   2.764  12.284   4.413
  655   2HH1  ARG  92          2HH1      ARG  92   1.704  11.297   5.373
  656   1HH2  ARG  92          1HH2      ARG  92   4.283   9.712   7.135
  657   2HH2  ARG  92          2HH2      ARG  92   2.567   9.807   6.885
  658    H    GLN  93           H        GLN  93   8.735  10.283   6.524
  659    HA   GLN  93           HA       GLN  93   9.787  10.885   9.169
  660   1HB   GLN  93          2HB       GLN  93   7.977   9.838   9.871
  661   2HB   GLN  93          1HB       GLN  93   7.553   9.405   8.230
  662   1HG   GLN  93          2HG       GLN  93   9.458   7.820   9.920
  663   2HG   GLN  93          1HG       GLN  93   7.726   7.532   9.900
  664   1HE2  GLN  93          1HE2      GLN  93   7.589   8.074   6.968
  665   2HE2  GLN  93          2HE2      GLN  93   8.227   6.649   6.232
  666    H    GLY  94           H        GLY  94  10.613   9.331   6.290
  667   1HA   GLY  94          2HA       GLY  94  12.739   8.493   5.792
  668   2HA   GLY  94          1HA       GLY  94  13.076   8.394   7.516
  669    H    TRP  95           H        TRP  95  12.977   6.532   8.446
  670    HA   TRP  95           HA       TRP  95  11.372   4.382   7.333
  671   1HB   TRP  95          2HB       TRP  95  14.243   3.872   8.110
  672   2HB   TRP  95          1HB       TRP  95  13.161   2.853   7.160
  673    HD1  TRP  95           HD       TRP  95  15.277   6.033   6.842
  674    HE1  TRP  95           1HE      TRP  95  15.713   6.492   4.365
  675    HE3  TRP  95           3HE      TRP  95  12.323   2.387   4.828
  676    HZ2  TRP  95           2HZ      TRP  95  14.919   5.446   1.870
  677    HZ3  TRP  95           3HZ      TRP  95  12.215   2.188   2.379
  678    HH2  TRP  95           HH       TRP  95  13.488   3.688   0.931
  679    H    GLY  96           H        GLY  96  11.470   6.299   9.585
  680   1HA   GLY  96          2HA       GLY  96  11.916   4.732  11.955
  681   2HA   GLY  96          1HA       GLY  96  11.129   6.303  11.873
  682    H    ALA  97           H        ALA  97   9.319   5.145   9.732
  683    HA   ALA  97           HA       ALA  97   7.365   3.978  11.553
  684   1HB   ALA  97          1HB       ALA  97   7.079   4.780   8.659
  685   2HB   ALA  97          2HB       ALA  97   6.619   5.757  10.054
  686   3HB   ALA  97          3HB       ALA  97   5.775   4.244   9.718
  687    H    TRP  98           H        TRP  98   9.527   3.089   8.991
  688    HA   TRP  98           HA       TRP  98   8.387   0.389   8.917
  689   1HB   TRP  98          2HB       TRP  98  10.568   1.731   7.305
  690   2HB   TRP  98          1HB       TRP  98  10.165   0.023   7.159
  691    HD1  TRP  98           HD       TRP  98   7.717  -0.571   6.158
  692    HE1  TRP  98           1HE      TRP  98   6.201   0.724   4.525
  693    HE3  TRP  98           3HE      TRP  98   9.870   4.072   6.560
  694    HZ2  TRP  98           2HZ      TRP  98   5.969   3.393   3.542
  695    HZ3  TRP  98           3HZ      TRP  98   8.947   5.917   5.232
  696    HH2  TRP  98           HH       TRP  98   7.039   5.574   3.766
  697    HA   PRO  99           HA       PRO  99  11.164  -0.153  12.343
  698   1HB   PRO  99          2HB       PRO  99   9.849  -2.807  12.492
  699   2HB   PRO  99          1HB       PRO  99   9.984  -1.544  13.714
  700   1HG   PRO  99          2HG       PRO  99   7.680  -1.953  12.495
  701   2HG   PRO  99          1HG       PRO  99   8.263  -0.296  12.782
  702   1HD   PRO  99          2HD       PRO  99   8.460  -1.930  10.254
  703   2HD   PRO  99          1HD       PRO  99   7.838  -0.273  10.466
  704    H    VAL 100           H        VAL 100  11.107  -3.523  11.986
  705    HA   VAL 100           HA       VAL 100  13.919  -3.590  11.751
  706    HB   VAL 100           HB       VAL 100  11.963  -5.875  11.422
  707   1HG1  VAL 100          1HG1      VAL 100  13.817  -7.284  12.153
  708   2HG1  VAL 100          2HG1      VAL 100  14.869  -5.869  12.229
  709   3HG1  VAL 100          3HG1      VAL 100  14.224  -6.407  10.676
  710   1HG2  VAL 100          1HG2      VAL 100  11.565  -4.700  13.519
  711   2HG2  VAL 100          2HG2      VAL 100  13.275  -4.834  13.930
  712   3HG2  VAL 100          3HG2      VAL 100  12.278  -6.284  13.811
  713    H    CYS 101           H        CYS 101  11.295  -3.790   9.525
  714    HA   CYS 101           HA       CYS 101  12.625  -5.295   7.521
  715   1HB   CYS 101          2HB       CYS 101  10.130  -3.610   7.455
  716   2HB   CYS 101          1HB       CYS 101  10.721  -4.508   6.056
  717    H    ALA 102           H        ALA 102  12.351  -1.850   8.152
  718    HA   ALA 102           HA       ALA 102  13.341  -1.048   5.608
  719   1HB   ALA 102          1HB       ALA 102  13.393   0.434   8.229
  720   2HB   ALA 102          2HB       ALA 102  12.116   0.511   7.013
  721   3HB   ALA 102          3HB       ALA 102  13.728   1.124   6.643
  722    H    ALA 103           H        ALA 103  14.840  -1.569   8.776
  723    HA   ALA 103           HA       ALA 103  17.462  -0.904   7.981
  724   1HB   ALA 103          1HB       ALA 103  16.566  -2.729  10.209
  725   2HB   ALA 103          2HB       ALA 103  16.767  -0.981  10.320
  726   3HB   ALA 103          3HB       ALA 103  18.169  -2.011  10.035
  727    H    ARG 104           H        ARG 104  15.604  -3.865   7.892
  728    HA   ARG 104           HA       ARG 104  17.748  -5.555   7.082
  729   1HB   ARG 104          2HB       ARG 104  14.755  -5.839   6.746
  730   2HB   ARG 104          1HB       ARG 104  15.905  -7.083   6.286
  731   1HG   ARG 104          2HG       ARG 104  15.032  -6.193   8.990
  732   2HG   ARG 104          1HG       ARG 104  15.165  -7.819   8.328
  733   1HD   ARG 104          2HD       ARG 104  16.989  -7.893   9.652
  734   2HD   ARG 104          1HD       ARG 104  17.751  -7.098   8.275
  735    HE   ARG 104           HE       ARG 104  16.600  -5.173   9.988
  736   1HH1  ARG 104          1HH1      ARG 104  19.336  -7.355   9.793
  737   2HH1  ARG 104          2HH1      ARG 104  20.324  -6.411  10.871
  738   1HH2  ARG 104          1HH2      ARG 104  17.869  -3.974  11.456
  739   2HH2  ARG 104          2HH2      ARG 104  19.483  -4.500  11.840
  740    H    ALA 105           H        ALA 105  15.652  -3.334   5.468
  741    HA   ALA 105           HA       ALA 105  16.136  -4.401   2.801
  742   1HB   ALA 105          1HB       ALA 105  14.603  -1.962   3.664
  743   2HB   ALA 105          2HB       ALA 105  13.921  -3.580   3.488
  744   3HB   ALA 105          3HB       ALA 105  14.563  -2.735   2.078
  745    H    GLY 106           H        GLY 106  17.415  -1.975   4.885
  746   1HA   GLY 106          2HA       GLY 106  19.561  -0.983   4.294
  747   2HA   GLY 106          1HA       GLY 106  18.978  -0.878   2.635
  748    H    ALA 107           H        ALA 107  18.057   0.193   5.888
  749    HA   ALA 107           HA       ALA 107  16.380   2.293   5.061
  750   1HB   ALA 107          1HB       ALA 107  16.201   1.283   7.269
  751   2HB   ALA 107          2HB       ALA 107  16.479   3.022   7.403
  752   3HB   ALA 107          3HB       ALA 107  17.803   1.891   7.691
  753    H    ARG 108           H        ARG 108  16.710   4.556   5.196
  754    HA   ARG 108           HA       ARG 108  19.517   5.351   4.842
  755   1HB   ARG 108          2HB       ARG 108  17.204   6.058   3.019
  756   2HB   ARG 108          1HB       ARG 108  18.850   6.662   2.865
  757   1HG   ARG 108          2HG       ARG 108  19.680   4.516   2.300
  758   2HG   ARG 108          1HG       ARG 108  18.157   3.734   2.749
  759   1HD   ARG 108          2HD       ARG 108  17.032   4.646   0.877
  760   2HD   ARG 108          1HD       ARG 108  18.335   5.797   0.559
  761    HE   ARG 108           HE       ARG 108  19.416   3.230   0.372
  762   1HH1  ARG 108          1HH1      ARG 108  16.969   5.098  -1.310
  763   2HH1  ARG 108          2HH1      ARG 108  17.364   4.421  -2.860
  764   1HH2  ARG 108          1HH2      ARG 108  19.909   2.337  -1.644
  765   2HH2  ARG 108          2HH2      ARG 108  19.028   2.844  -3.053
  Start of MODEL    7
    1   1H    ASN   1          1HT       ASN   1 -10.862  28.802 -50.243
    2   2H    ASN   1          2HT       ASN   1 -11.777  28.021 -51.430
    3   3H    ASN   1          3HT       ASN   1 -10.514  29.058 -51.878
    4    HA   ASN   1           HA       ASN   1 -10.032  26.623 -52.026
    5   1HB   ASN   1          2HB       ASN   1  -8.297  28.365 -50.260
    6   2HB   ASN   1          1HB       ASN   1  -7.784  26.838 -50.969
    7   1HD2  ASN   1          1HD2      ASN   1  -6.160  27.738 -52.193
    8   2HD2  ASN   1          2HD2      ASN   1  -6.464  28.759 -53.560
    9    H    VAL   2           H        VAL   2 -11.063  25.065 -51.106
   10    HA   VAL   2           HA       VAL   2 -11.668  24.946 -48.305
   11    HB   VAL   2           HB       VAL   2 -12.093  22.769 -50.353
   12   1HG1  VAL   2          1HG1      VAL   2 -13.904  22.073 -48.864
   13   2HG1  VAL   2          2HG1      VAL   2 -13.487  23.372 -47.748
   14   3HG1  VAL   2          3HG1      VAL   2 -12.347  22.060 -48.038
   15   1HG2  VAL   2          1HG2      VAL   2 -13.921  25.063 -49.640
   16   2HG2  VAL   2          2HG2      VAL   2 -14.353  23.691 -50.663
   17   3HG2  VAL   2          3HG2      VAL   2 -13.101  24.819 -51.184
   18    H    VAL   3           H        VAL   3  -9.175  25.086 -48.102
   19    HA   VAL   3           HA       VAL   3  -7.669  22.731 -48.195
   20    HB   VAL   3           HB       VAL   3  -7.345  25.056 -46.300
   21   1HG1  VAL   3          1HG1      VAL   3  -5.382  22.937 -47.169
   22   2HG1  VAL   3          2HG1      VAL   3  -6.093  23.113 -45.565
   23   3HG1  VAL   3          3HG1      VAL   3  -4.994  24.345 -46.182
   24   1HG2  VAL   3          1HG2      VAL   3  -7.345  25.776 -48.633
   25   2HG2  VAL   3          2HG2      VAL   3  -6.096  24.587 -49.004
   26   3HG2  VAL   3          3HG2      VAL   3  -5.740  25.928 -47.916
   27    H    VAL   4           H        VAL   4  -8.285  20.915 -47.231
   28    HA   VAL   4           HA       VAL   4  -9.559  21.037 -44.582
   29    HB   VAL   4           HB       VAL   4  -9.282  18.587 -46.319
   30   1HG1  VAL   4          1HG1      VAL   4 -11.194  19.279 -44.098
   31   2HG1  VAL   4          2HG1      VAL   4  -9.823  18.173 -43.989
   32   3HG1  VAL   4          3HG1      VAL   4 -11.196  17.779 -45.027
   33   1HG2  VAL   4          1HG2      VAL   4 -10.451  20.261 -47.637
   34   2HG2  VAL   4          2HG2      VAL   4 -11.563  20.558 -46.302
   35   3HG2  VAL   4          3HG2      VAL   4 -11.567  18.999 -47.122
   36    H    THR   5           H        THR   5  -8.758  19.772 -42.881
   37    HA   THR   5           HA       THR   5  -5.936  19.043 -43.209
   38    HB   THR   5           HB       THR   5  -5.678  19.420 -40.784
   39    HG1  THR   5           1HG      THR   5  -7.477  19.393 -39.684
   40   1HG2  THR   5          1HG2      THR   5  -5.890  21.878 -40.814
   41   2HG2  THR   5          2HG2      THR   5  -6.845  21.760 -42.291
   42   3HG2  THR   5          3HG2      THR   5  -5.157  21.252 -42.291
   43    HA   PRO   6           HA       PRO   6  -7.265  14.895 -41.992
   44   1HB   PRO   6          2HB       PRO   6  -4.580  14.093 -42.651
   45   2HB   PRO   6          1HB       PRO   6  -6.067  13.725 -43.527
   46   1HG   PRO   6          2HG       PRO   6  -4.078  15.322 -44.519
   47   2HG   PRO   6          1HG       PRO   6  -5.782  15.464 -44.987
   48   1HD   PRO   6          2HD       PRO   6  -4.227  17.074 -42.998
   49   2HD   PRO   6          1HD       PRO   6  -5.392  17.626 -44.223
   50    H    ALA   7           H        ALA   7  -6.005  13.295 -40.627
   51    HA   ALA   7           HA       ALA   7  -5.229  14.666 -38.215
   52   1HB   ALA   7          1HB       ALA   7  -6.606  12.642 -38.136
   53   2HB   ALA   7          2HB       ALA   7  -5.110  12.445 -37.220
   54   3HB   ALA   7          3HB       ALA   7  -5.272  11.714 -38.818
   55    H    HIS   8           H        HIS   8  -3.566  14.675 -40.698
   56    HA   HIS   8           HA       HIS   8  -0.993  13.814 -39.784
   57   1HB   HIS   8          2HB       HIS   8  -1.599  14.147 -42.208
   58   2HB   HIS   8          1HB       HIS   8  -1.689  15.877 -41.897
   59    HD1  HIS   8           1HD      HIS   8   0.752  13.092 -42.432
   60    HD2  HIS   8           2HD      HIS   8   0.785  17.163 -41.579
   61    HE1  HIS   8           1HE      HIS   8   3.135  13.875 -42.771
   62    H    GLU   9           H        GLU   9  -3.174  16.215 -38.933
   63    HA   GLU   9           HA       GLU   9  -1.197  18.205 -38.197
   64   1HB   GLU   9          2HB       GLU   9  -3.073  19.437 -37.214
   65   2HB   GLU   9          1HB       GLU   9  -3.432  18.956 -38.864
   66   1HG   GLU   9          2HG       GLU   9  -4.862  17.186 -38.087
   67   2HG   GLU   9          1HG       GLU   9  -4.403  17.503 -36.414
   68    H    ALA  10           H        ALA  10  -0.563  18.690 -36.089
   69    HA   ALA  10           HA       ALA  10  -0.494  16.361 -34.394
   70   1HB   ALA  10          1HB       ALA  10   0.864  19.030 -34.022
   71   2HB   ALA  10          2HB       ALA  10   1.577  17.614 -34.794
   72   3HB   ALA  10          3HB       ALA  10   1.166  17.572 -33.079
   73    H    VAL  11           H        VAL  11  -2.886  16.935 -34.455
   74    HA   VAL  11           HA       VAL  11  -3.900  18.797 -32.579
   75    HB   VAL  11           HB       VAL  11  -5.228  17.893 -34.458
   76   1HG1  VAL  11          1HG1      VAL  11  -6.220  15.664 -34.301
   77   2HG1  VAL  11          2HG1      VAL  11  -5.252  15.338 -32.862
   78   3HG1  VAL  11          3HG1      VAL  11  -4.462  15.595 -34.418
   79   1HG2  VAL  11          1HG2      VAL  11  -6.395  17.391 -31.724
   80   2HG2  VAL  11          2HG2      VAL  11  -7.323  17.556 -33.215
   81   3HG2  VAL  11          3HG2      VAL  11  -6.386  18.919 -32.607
   82    H    VAL  12           H        VAL  12  -2.453  15.742 -32.279
   83    HA   VAL  12           HA       VAL  12  -2.082  14.266 -30.670
   84    HB   VAL  12           HB       VAL  12  -2.294  16.875 -29.372
   85   1HG1  VAL  12          1HG1      VAL  12  -1.410  15.940 -27.246
   86   2HG1  VAL  12          2HG1      VAL  12  -1.649  14.319 -27.898
   87   3HG1  VAL  12          3HG1      VAL  12  -3.038  15.361 -27.600
   88   1HG2  VAL  12          1HG2      VAL  12   0.124  16.529 -29.038
   89   2HG2  VAL  12          2HG2      VAL  12  -0.371  16.444 -30.727
   90   3HG2  VAL  12          3HG2      VAL  12  -0.035  14.963 -29.833
   91    H    ARG  13           H        ARG  13  -3.523  12.804 -30.569
   92    HA   ARG  13           HA       ARG  13  -6.146  13.081 -29.531
   93   1HB   ARG  13          2HB       ARG  13  -6.345  10.713 -29.892
   94   2HB   ARG  13          1HB       ARG  13  -5.499  11.400 -31.271
   95   1HG   ARG  13          2HG       ARG  13  -3.371  10.642 -30.348
   96   2HG   ARG  13          1HG       ARG  13  -4.221   9.951 -28.965
   97   1HD   ARG  13          2HD       ARG  13  -5.491   8.508 -30.516
   98   2HD   ARG  13          1HD       ARG  13  -4.539   9.153 -31.852
   99    HE   ARG  13           HE       ARG  13  -2.727   8.198 -29.991
  100   1HH1  ARG  13          1HH1      ARG  13  -5.269   6.927 -32.044
  101   2HH1  ARG  13          2HH1      ARG  13  -4.574   5.329 -32.126
  102   1HH2  ARG  13          1HH2      ARG  13  -1.828   6.112 -30.078
  103   2HH2  ARG  13          2HH2      ARG  13  -2.624   4.861 -30.981
  104    H    VAL  14           H        VAL  14  -6.857  11.798 -27.771
  105    HA   VAL  14           HA       VAL  14  -5.392  12.532 -25.441
  106    HB   VAL  14           HB       VAL  14  -7.857  10.863 -25.369
  107   1HG1  VAL  14          1HG1      VAL  14  -6.845  11.370 -23.254
  108   2HG1  VAL  14          2HG1      VAL  14  -8.363  12.256 -23.397
  109   3HG1  VAL  14          3HG1      VAL  14  -6.828  13.091 -23.633
  110   1HG2  VAL  14          1HG2      VAL  14  -7.800  13.816 -25.972
  111   2HG2  VAL  14          2HG2      VAL  14  -9.243  12.893 -25.553
  112   3HG2  VAL  14          3HG2      VAL  14  -8.370  12.534 -27.042
  113    H    GLY  15           H        GLY  15  -4.991  11.117 -23.734
  114   1HA   GLY  15          2HA       GLY  15  -4.386   8.390 -24.520
  115   2HA   GLY  15          1HA       GLY  15  -3.372   9.316 -23.421
  116    H    THR  16           H        THR  16  -6.689   8.342 -23.861
  117    HA   THR  16           HA       THR  16  -7.561   8.637 -21.235
  118    HB   THR  16           HB       THR  16  -8.723   6.637 -23.139
  119    HG1  THR  16           1HG      THR  16  -9.528   9.308 -23.367
  120   1HG2  THR  16          1HG2      THR  16  -9.731   6.913 -20.928
  121   2HG2  THR  16          2HG2      THR  16 -10.822   7.439 -22.210
  122   3HG2  THR  16          3HG2      THR  16  -9.953   8.632 -21.247
  123    H    LYS  17           H        LYS  17  -6.027   6.047 -22.844
  124    HA   LYS  17           HA       LYS  17  -6.684   4.044 -20.912
  125   1HB   LYS  17          2HB       LYS  17  -4.784   3.959 -23.254
  126   2HB   LYS  17          1HB       LYS  17  -5.173   2.582 -22.235
  127   1HG   LYS  17          2HG       LYS  17  -6.553   2.243 -24.025
  128   2HG   LYS  17          1HG       LYS  17  -7.623   3.113 -22.925
  129   1HD   LYS  17          2HD       LYS  17  -7.307   5.156 -24.124
  130   2HD   LYS  17          1HD       LYS  17  -6.019   4.446 -25.102
  131   1HE   LYS  17          2HE       LYS  17  -8.953   3.774 -25.150
  132   2HE   LYS  17          1HE       LYS  17  -7.991   4.498 -26.439
  133   1HZ   LYS  17          1HZ       LYS  17  -7.811   1.729 -25.397
  134   2HZ   LYS  17          2HZ       LYS  17  -6.663   2.403 -26.447
  135   3HZ   LYS  17          3HZ       LYS  17  -8.274   2.214 -26.955
  136    HA   PRO  18           HA       PRO  18  -3.169   4.943 -18.249
  137   1HB   PRO  18          2HB       PRO  18  -4.309   2.575 -16.910
  138   2HB   PRO  18          1HB       PRO  18  -3.968   4.181 -16.255
  139   1HG   PRO  18          2HG       PRO  18  -6.476   3.380 -16.685
  140   2HG   PRO  18          1HG       PRO  18  -5.982   5.056 -16.997
  141   1HD   PRO  18          2HD       PRO  18  -6.356   2.803 -18.939
  142   2HD   PRO  18          1HD       PRO  18  -6.871   4.499 -19.084
  143    H    GLY  19           H        GLY  19  -1.631   3.399 -17.290
  144   1HA   GLY  19          2HA       GLY  19  -0.443   1.265 -17.706
  145   2HA   GLY  19          1HA       GLY  19  -0.822   1.516 -19.410
  146    H    THR  20           H        THR  20   0.342   3.575 -16.826
  147    HA   THR  20           HA       THR  20   2.049   5.115 -18.458
  148    HB   THR  20           HB       THR  20   2.184   4.733 -15.460
  149    HG1  THR  20           1HG      THR  20   0.566   6.540 -16.986
  150   1HG2  THR  20          1HG2      THR  20   2.962   7.047 -17.233
  151   2HG2  THR  20          2HG2      THR  20   4.065   5.943 -16.414
  152   3HG2  THR  20          3HG2      THR  20   3.042   7.028 -15.471
  153    H    GLU  21           H        GLU  21   2.477   2.152 -16.692
  154    HA   GLU  21           HA       GLU  21   4.247   1.033 -15.854
  155   1HB   GLU  21          2HB       GLU  21   4.893   1.681 -18.661
  156   2HB   GLU  21          1HB       GLU  21   6.100   0.866 -17.676
  157   1HG   GLU  21          2HG       GLU  21   4.952  -0.851 -18.778
  158   2HG   GLU  21          1HG       GLU  21   4.285  -0.821 -17.148
  159    H    VAL  22           H        VAL  22   4.798   2.342 -14.234
  160    HA   VAL  22           HA       VAL  22   6.417   4.690 -14.553
  161    HB   VAL  22           HB       VAL  22   5.705   3.198 -12.018
  162   1HG1  VAL  22          1HG1      VAL  22   7.590   4.706 -11.727
  163   2HG1  VAL  22          2HG1      VAL  22   6.164   5.340 -10.905
  164   3HG1  VAL  22          3HG1      VAL  22   6.668   6.024 -12.450
  165   1HG2  VAL  22          1HG2      VAL  22   4.307   5.523 -13.339
  166   2HG2  VAL  22          2HG2      VAL  22   3.900   4.840 -11.764
  167   3HG2  VAL  22          3HG2      VAL  22   3.697   3.872 -13.224
  168    HA   PRO  23           HA       PRO  23  10.283   2.450 -14.717
  169   1HB   PRO  23          2HB       PRO  23  11.274   5.161 -14.012
  170   2HB   PRO  23          1HB       PRO  23  11.810   4.070 -15.296
  171   1HG   PRO  23          2HG       PRO  23  10.306   6.183 -15.871
  172   2HG   PRO  23          1HG       PRO  23  10.041   4.633 -16.692
  173   1HD   PRO  23          2HD       PRO  23   8.486   5.885 -14.492
  174   2HD   PRO  23          1HD       PRO  23   7.915   4.965 -15.891
  175    HA   PRO  24           HA       PRO  24  10.369   1.505 -10.412
  176   1HB   PRO  24          2HB       PRO  24  12.909   0.332 -10.449
  177   2HB   PRO  24          1HB       PRO  24  11.375  -0.498 -10.727
  178   1HG   PRO  24          2HG       PRO  24  13.330   0.586 -12.706
  179   2HG   PRO  24          1HG       PRO  24  12.361  -0.901 -12.777
  180   1HD   PRO  24          2HD       PRO  24  11.644   1.226 -14.195
  181   2HD   PRO  24          1HD       PRO  24  10.422   0.253 -13.352
  182    H    VAL  25           H        VAL  25  11.047   2.461  -8.669
  183    HA   VAL  25           HA       VAL  25  12.838   4.713  -8.894
  184    HB   VAL  25           HB       VAL  25  11.277   3.750  -6.484
  185   1HG1  VAL  25          1HG1      VAL  25  11.545   6.023  -5.659
  186   2HG1  VAL  25          2HG1      VAL  25  12.466   6.453  -7.099
  187   3HG1  VAL  25          3HG1      VAL  25  13.116   5.282  -5.952
  188   1HG2  VAL  25          1HG2      VAL  25  10.500   5.818  -8.539
  189   2HG2  VAL  25          2HG2      VAL  25   9.594   5.407  -7.081
  190   3HG2  VAL  25          3HG2      VAL  25   9.786   4.214  -8.368
  191    H    ILE  26           H        ILE  26  14.672   4.968  -7.679
  192    HA   ILE  26           HA       ILE  26  16.340   2.731  -7.610
  193    HB   ILE  26           HB       ILE  26  16.832   5.385  -6.260
  194   1HG1  ILE  26          2HG1      ILE  26  16.219   5.702  -8.607
  195   2HG1  ILE  26          1HG1      ILE  26  17.929   6.039  -8.365
  196   1HG2  ILE  26          1HG2      ILE  26  19.200   4.865  -6.609
  197   2HG2  ILE  26          2HG2      ILE  26  18.755   3.297  -7.283
  198   3HG2  ILE  26          3HG2      ILE  26  18.415   3.658  -5.590
  199   1HD1  ILE  26          1HD1      ILE  26  16.765   3.518  -9.531
  200   2HD1  ILE  26          2HD1      ILE  26  18.481   3.838  -9.277
  201   3HD1  ILE  26          3HD1      ILE  26  17.564   4.815 -10.424
  202    H    ASP  27           H        ASP  27  14.292   4.030  -5.168
  203    HA   ASP  27           HA       ASP  27  15.664   2.570  -3.067
  204   1HB   ASP  27          2HB       ASP  27  13.417   4.574  -2.974
  205   2HB   ASP  27          1HB       ASP  27  13.965   3.668  -1.570
  206    H    GLY  28           H        GLY  28  13.602   1.933  -5.374
  207   1HA   GLY  28          2HA       GLY  28  11.480   0.560  -4.098
  208   2HA   GLY  28          1HA       GLY  28  12.025   0.308  -5.754
  209    H    SER  29           H        SER  29  14.754  -0.008  -4.275
  210    HA   SER  29           HA       SER  29  14.684  -2.882  -4.117
  211   1HB   SER  29          2HB       SER  29  16.866  -0.962  -3.317
  212   2HB   SER  29          1HB       SER  29  17.048  -2.693  -3.598
  213    HG   SER  29           HG       SER  29  17.379  -2.192  -5.607
  214    H    ILE  30           H        ILE  30  14.946  -0.192  -1.939
  215    HA   ILE  30           HA       ILE  30  15.155  -1.659   0.485
  216    HB   ILE  30           HB       ILE  30  13.735   0.947   0.642
  217   1HG1  ILE  30          2HG1      ILE  30  15.234   1.435  -1.253
  218   2HG1  ILE  30          1HG1      ILE  30  15.717   2.307   0.191
  219   1HG2  ILE  30          1HG2      ILE  30  14.533  -0.186   2.616
  220   2HG2  ILE  30          2HG2      ILE  30  15.360   1.358   2.412
  221   3HG2  ILE  30          3HG2      ILE  30  16.186  -0.145   2.001
  222   1HD1  ILE  30          1HD1      ILE  30  17.022  -0.182  -0.881
  223   2HD1  ILE  30          2HD1      ILE  30  17.492   0.673   0.588
  224   3HD1  ILE  30          3HD1      ILE  30  17.650   1.462  -0.981
  225    H    TRP  31           H        TRP  31  12.587  -0.397  -1.484
  226    HA   TRP  31           HA       TRP  31  10.482  -0.962   0.336
  227   1HB   TRP  31          2HB       TRP  31  10.455  -0.346  -2.626
  228   2HB   TRP  31          1HB       TRP  31   9.012  -0.478  -1.626
  229    HD1  TRP  31           HD       TRP  31  10.967   2.160  -2.994
  230    HE1  TRP  31           1HE      TRP  31  10.919   4.298  -1.537
  231    HE3  TRP  31           3HE      TRP  31   9.239   0.123   1.307
  232    HZ2  TRP  31           2HZ      TRP  31  10.258   4.976   1.099
  233    HZ3  TRP  31           3HZ      TRP  31   8.946   1.562   3.279
  234    HH2  TRP  31           HH       TRP  31   9.449   3.941   3.170
  235    H    ASP  32           H        ASP  32  11.975  -2.714  -2.316
  236    HA   ASP  32           HA       ASP  32  10.050  -4.812  -2.323
  237   1HB   ASP  32          2HB       ASP  32  11.189  -4.647  -4.336
  238   2HB   ASP  32          1HB       ASP  32  12.751  -4.392  -3.547
  239    H    ALA  33           H        ALA  33  13.156  -4.249  -0.692
  240    HA   ALA  33           HA       ALA  33  13.292  -6.849   0.413
  241   1HB   ALA  33          1HB       ALA  33  15.270  -5.447   0.219
  242   2HB   ALA  33          2HB       ALA  33  15.004  -5.934   1.894
  243   3HB   ALA  33          3HB       ALA  33  14.580  -4.304   1.371
  244    H    ILE  34           H        ILE  34  11.899  -3.789   1.481
  245    HA   ILE  34           HA       ILE  34  11.054  -4.687   4.037
  246    HB   ILE  34           HB       ILE  34  10.000  -2.530   2.228
  247   1HG1  ILE  34          2HG1      ILE  34  11.607  -2.440   4.793
  248   2HG1  ILE  34          1HG1      ILE  34  12.248  -2.187   3.173
  249   1HG2  ILE  34          1HG2      ILE  34   9.154  -3.161   5.056
  250   2HG2  ILE  34          2HG2      ILE  34   8.150  -3.267   3.608
  251   3HG2  ILE  34          3HG2      ILE  34   8.721  -1.696   4.174
  252   1HD1  ILE  34          1HD1      ILE  34  10.830  -0.192   2.955
  253   2HD1  ILE  34          2HD1      ILE  34  11.963  -0.081   4.302
  254   3HD1  ILE  34          3HD1      ILE  34  10.263  -0.439   4.607
  255    H    ALA  35           H        ALA  35   9.455  -4.619   0.864
  256    HA   ALA  35           HA       ALA  35   7.020  -5.762   1.631
  257   1HB   ALA  35          1HB       ALA  35   8.482  -6.095  -0.985
  258   2HB   ALA  35          2HB       ALA  35   7.401  -4.765  -0.572
  259   3HB   ALA  35          3HB       ALA  35   6.768  -6.406  -0.707
  260    H    GLY  36           H        GLY  36  10.132  -7.163   0.893
  261   1HA   GLY  36          2HA       GLY  36   9.197  -9.888   0.989
  262   2HA   GLY  36          1HA       GLY  36  10.874  -9.362   0.954
  263    H    CYS  37           H        CYS  37   9.937  -7.553   3.302
  264    HA   CYS  37           HA       CYS  37  10.729  -9.480   5.338
  265   1HB   CYS  37          2HB       CYS  37  12.064  -7.485   5.195
  266   2HB   CYS  37          1HB       CYS  37  10.631  -6.469   5.282
  267    H    GLU  38           H        GLU  38   8.220  -7.036   4.759
  268    HA   GLU  38           HA       GLU  38   6.863  -7.745   7.226
  269   1HB   GLU  38          2HB       GLU  38   6.198  -5.730   5.070
  270   2HB   GLU  38          1HB       GLU  38   5.269  -5.950   6.544
  271   1HG   GLU  38          2HG       GLU  38   8.179  -5.232   6.548
  272   2HG   GLU  38          1HG       GLU  38   6.894  -4.027   6.497
  273    H    ALA  39           H        ALA  39   6.575  -8.172   3.782
  274    HA   ALA  39           HA       ALA  39   3.967  -9.425   4.174
  275   1HB   ALA  39          1HB       ALA  39   5.126  -8.350   1.624
  276   2HB   ALA  39          2HB       ALA  39   3.971  -7.508   2.659
  277   3HB   ALA  39          3HB       ALA  39   3.500  -8.998   1.841
  278    H    GLY  40           H        GLY  40   7.172 -10.167   3.554
  279   1HA   GLY  40          2HA       GLY  40   8.169 -12.222   3.147
  280   2HA   GLY  40          1HA       GLY  40   6.558 -12.934   3.036
  281    H    GLY  41           H        GLY  41   7.077 -10.130   1.273
  282   1HA   GLY  41          2HA       GLY  41   7.455  -9.687  -0.922
  283   2HA   GLY  41          1HA       GLY  41   7.881 -11.377  -1.198
  284    H    ASN  42           H        ASN  42   5.058  -9.460  -0.233
  285    HA   ASN  42           HA       ASN  42   3.468 -10.656  -2.344
  286   1HB   ASN  42          2HB       ASN  42   3.058 -11.167   0.562
  287   2HB   ASN  42          1HB       ASN  42   1.623 -10.857  -0.407
  288   1HD2  ASN  42          1HD2      ASN  42   1.037 -12.320  -2.015
  289   2HD2  ASN  42          2HD2      ASN  42   1.681 -13.923  -2.066
  290    H    TRP  43           H        TRP  43   3.197  -8.728  -3.299
  291    HA   TRP  43           HA       TRP  43   2.602  -6.359  -1.775
  292   1HB   TRP  43          2HB       TRP  43   2.627  -6.832  -4.760
  293   2HB   TRP  43          1HB       TRP  43   2.483  -5.259  -3.980
  294    HD1  TRP  43           HD       TRP  43   5.009  -8.180  -4.206
  295    HE1  TRP  43           1HE      TRP  43   7.394  -7.197  -4.042
  296    HE3  TRP  43           3HE      TRP  43   3.809  -3.290  -3.368
  297    HZ2  TRP  43           2HZ      TRP  43   8.595  -4.670  -3.595
  298    HZ3  TRP  43           3HZ      TRP  43   5.619  -1.651  -3.089
  299    HH2  TRP  43           HH       TRP  43   7.964  -2.332  -3.207
  300    H    ALA  44           H        ALA  44   0.900  -8.931  -3.063
  301    HA   ALA  44           HA       ALA  44  -1.617  -7.423  -3.231
  302   1HB   ALA  44          1HB       ALA  44  -2.531  -9.369  -4.367
  303   2HB   ALA  44          2HB       ALA  44  -1.022 -10.244  -4.107
  304   3HB   ALA  44          3HB       ALA  44  -1.051  -8.824  -5.152
  305    H    ILE  45           H        ILE  45   0.002  -8.709  -0.829
  306    HA   ILE  45           HA       ILE  45  -1.794 -10.603   0.272
  307    HB   ILE  45           HB       ILE  45   0.740 -10.390   0.672
  308   1HG1  ILE  45          2HG1      ILE  45  -1.149 -10.808   2.994
  309   2HG1  ILE  45          1HG1      ILE  45  -0.723 -12.007   1.779
  310   1HG2  ILE  45          1HG2      ILE  45  -0.249  -8.435   2.746
  311   2HG2  ILE  45          2HG2      ILE  45   0.791  -8.065   1.371
  312   3HG2  ILE  45          3HG2      ILE  45   1.378  -9.111   2.664
  313   1HD1  ILE  45          1HD1      ILE  45   0.478 -12.374   3.864
  314   2HD1  ILE  45          2HD1      ILE  45   1.176 -10.758   3.753
  315   3HD1  ILE  45          3HD1      ILE  45   1.585 -11.981   2.549
  316    H    ASN  46           H        ASN  46  -3.187 -10.358   1.966
  317    HA   ASN  46           HA       ASN  46  -3.661  -7.677   3.045
  318   1HB   ASN  46          2HB       ASN  46  -5.166  -8.064   1.038
  319   2HB   ASN  46          1HB       ASN  46  -5.907  -9.379   1.944
  320   1HD2  ASN  46          1HD2      ASN  46  -5.485  -5.949   1.698
  321   2HD2  ASN  46          2HD2      ASN  46  -6.745  -5.517   2.803
  322    H    THR  47           H        THR  47  -2.997  -8.242   4.998
  323    HA   THR  47           HA       THR  47  -3.555 -10.712   6.233
  324    HB   THR  47           HB       THR  47  -2.771  -9.479   8.326
  325    HG1  THR  47           1HG      THR  47  -1.797  -7.408   7.859
  326   1HG2  THR  47          1HG2      THR  47  -1.238 -10.792   6.946
  327   2HG2  THR  47          2HG2      THR  47  -0.441  -9.332   7.538
  328   3HG2  THR  47          3HG2      THR  47  -1.010  -9.413   5.870
  329    H    GLY  48           H        GLY  48  -5.298  -7.772   5.942
  330   1HA   GLY  48          2HA       GLY  48  -7.573  -7.486   6.396
  331   2HA   GLY  48          1HA       GLY  48  -7.519  -8.910   7.434
  332    H    ASN  49           H        ASN  49  -5.008  -6.625   7.766
  333    HA   ASN  49           HA       ASN  49  -6.030  -6.075  10.452
  334   1HB   ASN  49          2HB       ASN  49  -3.257  -5.790   9.296
  335   2HB   ASN  49          1HB       ASN  49  -3.687  -5.307  10.933
  336   1HD2  ASN  49          1HD2      ASN  49  -1.765  -7.301  10.072
  337   2HD2  ASN  49          2HD2      ASN  49  -2.273  -8.794  10.786
  338    H    GLY  50           H        GLY  50  -6.521  -4.659   7.716
  339   1HA   GLY  50          2HA       GLY  50  -7.386  -2.505   7.388
  340   2HA   GLY  50          1HA       GLY  50  -6.557  -1.979   8.849
  341    H    TYR  51           H        TYR  51  -4.237  -3.628   7.581
  342    HA   TYR  51           HA       TYR  51  -3.257  -1.432   5.903
  343   1HB   TYR  51          2HB       TYR  51  -1.459  -3.487   7.179
  344   2HB   TYR  51          1HB       TYR  51  -1.036  -1.920   6.536
  345    HD1  TYR  51           1HD      TYR  51  -3.794  -0.993   8.232
  346    HD2  TYR  51           2HD      TYR  51   0.063  -2.619   9.035
  347    HE1  TYR  51           1HE      TYR  51  -3.849  -0.031  10.508
  348    HE2  TYR  51           2HE      TYR  51   0.009  -1.668  11.298
  349    HH   TYR  51           HH       TYR  51  -2.760  -0.548  12.761
  350    H    TYR  52           H        TYR  52  -1.946  -2.061   4.074
  351    HA   TYR  52           HA       TYR  52  -3.132  -4.498   2.941
  352   1HB   TYR  52          2HB       TYR  52  -2.527  -1.869   1.580
  353   2HB   TYR  52          1HB       TYR  52  -3.157  -3.307   0.769
  354    HD1  TYR  52           1HD      TYR  52  -5.459  -3.595   0.612
  355    HD2  TYR  52           2HD      TYR  52  -3.918  -1.014   3.606
  356    HE1  TYR  52           1HE      TYR  52  -7.751  -2.968   1.240
  357    HE2  TYR  52           2HE      TYR  52  -6.191  -0.379   4.257
  358    HH   TYR  52           HH       TYR  52  -8.461  -0.324   3.247
  359    H    GLY  53           H        GLY  53  -1.855  -5.142   0.835
  360   1HA   GLY  53          2HA       GLY  53   0.456  -6.270   1.974
  361   2HA   GLY  53          1HA       GLY  53  -0.076  -6.466   0.318
  362    H    GLY  54           H        GLY  54   2.331  -6.563   0.221
  363   1HA   GLY  54          2HA       GLY  54   4.129  -5.647  -0.876
  364   2HA   GLY  54          1HA       GLY  54   3.236  -4.138  -0.999
  365    H    VAL  55           H        VAL  55   3.669  -2.514   0.365
  366    HA   VAL  55           HA       VAL  55   5.982  -2.816   2.103
  367    HB   VAL  55           HB       VAL  55   4.403  -0.279   1.883
  368   1HG1  VAL  55          1HG1      VAL  55   6.329  -0.520   3.438
  369   2HG1  VAL  55          2HG1      VAL  55   6.526   0.761   2.243
  370   3HG1  VAL  55          3HG1      VAL  55   7.368  -0.776   2.039
  371   1HG2  VAL  55          1HG2      VAL  55   6.376  -1.280  -0.169
  372   2HG2  VAL  55          2HG2      VAL  55   5.680   0.339  -0.115
  373   3HG2  VAL  55          3HG2      VAL  55   4.645  -1.054  -0.419
  374    H    GLN  56           H        GLN  56   2.727  -3.239   2.333
  375    HA   GLN  56           HA       GLN  56   1.368  -3.826   4.027
  376   1HB   GLN  56          2HB       GLN  56   4.055  -4.239   5.274
  377   2HB   GLN  56          1HB       GLN  56   2.588  -4.518   6.202
  378   1HG   GLN  56          2HG       GLN  56   3.010  -5.807   3.532
  379   2HG   GLN  56          1HG       GLN  56   3.687  -6.501   5.003
  380   1HE2  GLN  56          1HE2      GLN  56   0.601  -4.829   4.882
  381   2HE2  GLN  56          2HE2      GLN  56  -0.370  -6.224   5.185
  382    H    PHE  57           H        PHE  57   1.428  -1.068   3.754
  383    HA   PHE  57           HA       PHE  57   1.152  -0.365   6.578
  384   1HB   PHE  57          2HB       PHE  57   1.444   2.011   5.987
  385   2HB   PHE  57          1HB       PHE  57   2.877   1.026   5.801
  386    HD1  PHE  57           1HD      PHE  57   1.384   3.735   4.520
  387    HD2  PHE  57           2HD      PHE  57   2.840  -0.022   3.148
  388    HE1  PHE  57           1HE      PHE  57   1.792   4.708   2.298
  389    HE2  PHE  57           2HE      PHE  57   3.248   0.943   0.924
  390    HZ   PHE  57           HZ       PHE  57   2.745   3.323   0.492
  391    H    ASP  58           H        ASP  58  -0.405   1.574   6.877
  392    HA   ASP  58           HA       ASP  58  -2.872   0.238   6.353
  393   1HB   ASP  58          2HB       ASP  58  -3.874   1.870   7.857
  394   2HB   ASP  58          1HB       ASP  58  -2.418   1.171   8.554
  395    H    GLN  59           H        GLN  59  -4.832   1.342   5.802
  396    HA   GLN  59           HA       GLN  59  -4.755   2.447   3.230
  397   1HB   GLN  59          2HB       GLN  59  -6.641   1.209   3.863
  398   2HB   GLN  59          1HB       GLN  59  -6.850   2.104   5.354
  399   1HG   GLN  59          2HG       GLN  59  -8.581   2.648   3.771
  400   2HG   GLN  59          1HG       GLN  59  -7.554   4.049   4.057
  401   1HE2  GLN  59          1HE2      GLN  59  -6.434   1.446   2.089
  402   2HE2  GLN  59          2HE2      GLN  59  -6.559   2.246   0.558
  403    H    GLY  60           H        GLY  60  -4.977   3.829   6.404
  404   1HA   GLY  60          2HA       GLY  60  -5.840   6.428   5.649
  405   2HA   GLY  60          1HA       GLY  60  -5.042   6.011   7.160
  406    H    THR  61           H        THR  61  -2.637   5.170   6.466
  407    HA   THR  61           HA       THR  61  -1.196   7.471   5.732
  408    HB   THR  61           HB       THR  61  -0.314   4.617   5.803
  409    HG1  THR  61           1HG      THR  61  -0.733   4.940   7.858
  410   1HG2  THR  61          1HG2      THR  61   1.284   5.995   4.581
  411   2HG2  THR  61          2HG2      THR  61   1.951   5.527   6.145
  412   3HG2  THR  61          3HG2      THR  61   1.315   7.155   5.908
  413    H    TRP  62           H        TRP  62  -2.035   4.546   3.935
  414    HA   TRP  62           HA       TRP  62  -0.658   5.044   1.568
  415   1HB   TRP  62          2HB       TRP  62  -1.798   2.944   2.055
  416   2HB   TRP  62          1HB       TRP  62  -3.352   3.774   2.057
  417    HD1  TRP  62           HD       TRP  62  -4.501   4.235  -0.221
  418    HE1  TRP  62           1HE      TRP  62  -4.045   3.452  -2.622
  419    HE3  TRP  62           3HE      TRP  62   0.194   2.375   0.449
  420    HZ2  TRP  62           2HZ      TRP  62  -1.924   2.170  -4.081
  421    HZ3  TRP  62           3HZ      TRP  62   1.379   1.395  -1.462
  422    HH2  TRP  62           HH       TRP  62   0.353   1.295  -3.679
  423    H    GLU  63           H        GLU  63  -3.900   5.958   2.580
  424    HA   GLU  63           HA       GLU  63  -4.597   7.403   0.269
  425   1HB   GLU  63          2HB       GLU  63  -6.369   6.687   1.620
  426   2HB   GLU  63          1HB       GLU  63  -5.602   7.248   3.098
  427   1HG   GLU  63          2HG       GLU  63  -7.401   8.697   2.746
  428   2HG   GLU  63          1HG       GLU  63  -5.974   9.599   2.242
  429    H    ALA  64           H        ALA  64  -2.945   8.246   3.264
  430    HA   ALA  64           HA       ALA  64  -3.166  11.053   3.092
  431   1HB   ALA  64          1HB       ALA  64  -0.987   9.428   4.403
  432   2HB   ALA  64          2HB       ALA  64  -2.519   9.886   5.146
  433   3HB   ALA  64          3HB       ALA  64  -1.345  11.127   4.709
  434    H    ASN  65           H        ASN  65  -0.630   8.833   1.926
  435    HA   ASN  65           HA       ASN  65   0.830  10.996   0.704
  436   1HB   ASN  65          2HB       ASN  65   1.169   8.026   0.241
  437   2HB   ASN  65          1HB       ASN  65   2.318   9.294  -0.165
  438   1HD2  ASN  65          1HD2      ASN  65   1.037   7.299   2.330
  439   2HD2  ASN  65          2HD2      ASN  65   2.172   7.755   3.556
  440    H    GLY  66           H        GLY  66  -1.907   9.215  -0.089
  441   1HA   GLY  66          2HA       GLY  66  -3.328   9.728  -1.871
  442   2HA   GLY  66          1HA       GLY  66  -1.979  10.505  -2.695
  443    H    GLY  67           H        GLY  67  -2.582   7.212  -1.456
  444   1HA   GLY  67          2HA       GLY  67  -1.153   6.102  -3.696
  445   2HA   GLY  67          1HA       GLY  67  -1.875   5.212  -2.363
  446    H    LEU  68           H        LEU  68  -4.436   6.761  -2.920
  447    HA   LEU  68           HA       LEU  68  -5.681   4.646  -4.177
  448   1HB   LEU  68          2HB       LEU  68  -6.583   7.410  -3.513
  449   2HB   LEU  68          1HB       LEU  68  -7.660   6.258  -4.279
  450    HG   LEU  68           HG       LEU  68  -7.061   4.715  -2.311
  451   1HD1  LEU  68          1HD1      LEU  68  -6.481   5.860  -0.240
  452   2HD1  LEU  68          2HD1      LEU  68  -6.238   7.354  -1.144
  453   3HD1  LEU  68          3HD1      LEU  68  -5.198   5.964  -1.445
  454   1HD2  LEU  68          1HD2      LEU  68  -8.735   7.182  -1.875
  455   2HD2  LEU  68          2HD2      LEU  68  -8.825   5.699  -0.924
  456   3HD2  LEU  68          3HD2      LEU  68  -9.264   5.680  -2.632
  457    H    ARG  69           H        ARG  69  -4.151   7.359  -5.563
  458    HA   ARG  69           HA       ARG  69  -5.503   7.372  -8.057
  459   1HB   ARG  69          2HB       ARG  69  -3.529   8.619  -8.855
  460   2HB   ARG  69          1HB       ARG  69  -4.158   9.270  -7.347
  461   1HG   ARG  69          2HG       ARG  69  -2.428   8.076  -6.113
  462   2HG   ARG  69          1HG       ARG  69  -1.791   7.442  -7.628
  463   1HD   ARG  69          2HD       ARG  69  -0.484   9.341  -6.869
  464   2HD   ARG  69          1HD       ARG  69  -1.315   9.725  -8.377
  465    HE   ARG  69           HE       ARG  69  -2.896  10.526  -6.175
  466   1HH1  ARG  69          1HH1      ARG  69   0.075  11.408  -7.814
  467   2HH1  ARG  69          2HH1      ARG  69  -0.081  13.098  -7.451
  468   1HH2  ARG  69          1HH2      ARG  69  -3.116  12.746  -5.719
  469   2HH2  ARG  69          2HH2      ARG  69  -1.917  13.867  -6.297
  470    H    TYR  70           H        TYR  70  -2.832   5.605  -6.666
  471    HA   TYR  70           HA       TYR  70  -2.048   4.324  -9.138
  472   1HB   TYR  70          2HB       TYR  70  -1.397   3.627  -6.267
  473   2HB   TYR  70          1HB       TYR  70  -0.493   3.121  -7.695
  474    HD1  TYR  70           1HD      TYR  70  -1.004   5.641  -5.199
  475    HD2  TYR  70           2HD      TYR  70   0.849   4.866  -8.942
  476    HE1  TYR  70           1HE      TYR  70   0.441   7.588  -4.873
  477    HE2  TYR  70           2HE      TYR  70   2.305   6.830  -8.631
  478    HH   TYR  70           HH       TYR  70   2.445   8.532  -5.589
  479    H    ALA  71           H        ALA  71  -3.921   3.866  -6.310
  480    HA   ALA  71           HA       ALA  71  -5.835   2.131  -7.128
  481   1HB   ALA  71          1HB       ALA  71  -3.524   0.582  -5.937
  482   2HB   ALA  71          2HB       ALA  71  -4.105   0.445  -7.596
  483   3HB   ALA  71          3HB       ALA  71  -5.134  -0.062  -6.257
  484    HA   PRO  72           HA       PRO  72  -6.906   3.823  -3.188
  485   1HB   PRO  72          2HB       PRO  72  -9.003   1.813  -3.130
  486   2HB   PRO  72          1HB       PRO  72  -9.111   3.565  -3.077
  487   1HG   PRO  72          2HG       PRO  72  -9.781   2.076  -5.257
  488   2HG   PRO  72          1HG       PRO  72  -9.237   3.762  -5.334
  489   1HD   PRO  72          2HD       PRO  72  -7.824   1.293  -6.084
  490   2HD   PRO  72          1HD       PRO  72  -7.557   2.965  -6.618
  491    H    ARG  73           H        ARG  73  -5.854   0.690  -3.700
  492    HA   ARG  73           HA       ARG  73  -5.270   0.395  -0.864
  493   1HB   ARG  73          2HB       ARG  73  -6.068  -1.878  -0.754
  494   2HB   ARG  73          1HB       ARG  73  -7.392  -0.855  -1.297
  495   1HG   ARG  73          2HG       ARG  73  -6.732  -1.523  -3.651
  496   2HG   ARG  73          1HG       ARG  73  -5.721  -2.755  -2.889
  497   1HD   ARG  73          2HD       ARG  73  -8.674  -2.463  -2.347
  498   2HD   ARG  73          1HD       ARG  73  -8.028  -3.499  -3.615
  499    HE   ARG  73           HE       ARG  73  -6.705  -4.511  -1.628
  500   1HH1  ARG  73          1HH1      ARG  73  -9.990  -3.298  -1.485
  501   2HH1  ARG  73          2HH1      ARG  73 -10.480  -4.427  -0.262
  502   1HH2  ARG  73          1HH2      ARG  73  -7.353  -5.987  -0.039
  503   2HH2  ARG  73          2HH2      ARG  73  -8.980  -5.948   0.576
  504    H    ALA  74           H        ALA  74  -3.351  -0.485  -0.527
  505    HA   ALA  74           HA       ALA  74  -1.389  -0.357  -2.447
  506   1HB   ALA  74          1HB       ALA  74  -1.056  -0.235   0.024
  507   2HB   ALA  74          2HB       ALA  74   0.118  -1.238  -0.826
  508   3HB   ALA  74          3HB       ALA  74  -1.197  -1.991   0.072
  509    H    ASP  75           H        ASP  75  -3.381  -3.120  -1.577
  510    HA   ASP  75           HA       ASP  75  -1.532  -4.962  -2.779
  511   1HB   ASP  75          2HB       ASP  75  -3.128  -6.712  -2.212
  512   2HB   ASP  75          1HB       ASP  75  -2.820  -5.676  -0.828
  513    H    LEU  76           H        LEU  76  -3.932  -2.952  -3.917
  514    HA   LEU  76           HA       LEU  76  -4.363  -4.529  -6.339
  515   1HB   LEU  76          2HB       LEU  76  -6.289  -3.351  -5.410
  516   2HB   LEU  76          1HB       LEU  76  -5.419  -1.831  -5.484
  517    HG   LEU  76           HG       LEU  76  -5.372  -2.012  -7.957
  518   1HD1  LEU  76          1HD1      LEU  76  -7.184  -4.381  -7.507
  519   2HD1  LEU  76          2HD1      LEU  76  -5.538  -4.441  -8.137
  520   3HD1  LEU  76          3HD1      LEU  76  -6.809  -3.644  -9.065
  521   1HD2  LEU  76          1HD2      LEU  76  -8.114  -2.138  -6.710
  522   2HD2  LEU  76          2HD2      LEU  76  -7.722  -1.452  -8.287
  523   3HD2  LEU  76          3HD2      LEU  76  -7.089  -0.708  -6.818
  524    H    ALA  77           H        ALA  77  -2.630  -1.829  -5.071
  525    HA   ALA  77           HA       ALA  77  -1.555  -0.938  -7.564
  526   1HB   ALA  77          1HB       ALA  77  -0.680  -0.398  -4.727
  527   2HB   ALA  77          2HB       ALA  77  -1.827   0.571  -5.654
  528   3HB   ALA  77          3HB       ALA  77  -0.139   0.475  -6.161
  529    H    THR  78           H        THR  78   0.761  -1.019  -8.009
  530    HA   THR  78           HA       THR  78   1.779  -3.690  -7.405
  531    HB   THR  78           HB       THR  78   3.174  -3.347  -9.428
  532    HG1  THR  78           1HG      THR  78   3.405  -1.342 -10.053
  533   1HG2  THR  78          1HG2      THR  78   1.049  -4.450  -9.687
  534   2HG2  THR  78          2HG2      THR  78   1.269  -3.346 -11.047
  535   3HG2  THR  78          3HG2      THR  78   0.200  -2.902  -9.712
  536    H    ARG  79           H        ARG  79   4.401  -3.519  -7.867
  537    HA   ARG  79           HA       ARG  79   5.529  -2.662  -5.498
  538   1HB   ARG  79          2HB       ARG  79   6.835  -2.934  -8.207
  539   2HB   ARG  79          1HB       ARG  79   7.714  -2.739  -6.699
  540   1HG   ARG  79          2HG       ARG  79   6.711  -4.837  -5.884
  541   2HG   ARG  79          1HG       ARG  79   5.929  -5.035  -7.455
  542   1HD   ARG  79          2HD       ARG  79   8.005  -6.338  -7.270
  543   2HD   ARG  79          1HD       ARG  79   8.079  -5.133  -8.552
  544    HE   ARG  79           HE       ARG  79   9.187  -4.311  -6.003
  545   1HH1  ARG  79          1HH1      ARG  79   9.782  -5.660  -9.176
  546   2HH1  ARG  79          2HH1      ARG  79  11.498  -5.393  -9.113
  547   1HH2  ARG  79          1HH2      ARG  79  11.468  -3.948  -5.920
  548   2HH2  ARG  79          2HH2      ARG  79  12.458  -4.439  -7.260
  549    H    GLU  80           H        GLU  80   5.588  -1.028  -8.632
  550    HA   GLU  80           HA       GLU  80   7.114   1.168  -7.769
  551   1HB   GLU  80          2HB       GLU  80   6.275   2.250  -9.894
  552   2HB   GLU  80          1HB       GLU  80   7.099   0.709 -10.074
  553   1HG   GLU  80          2HG       GLU  80   4.161   0.613  -9.826
  554   2HG   GLU  80          1HG       GLU  80   4.819   1.302 -11.311
  555    H    GLU  81           H        GLU  81   3.617   0.658  -7.874
  556    HA   GLU  81           HA       GLU  81   2.893   3.340  -7.302
  557   1HB   GLU  81          2HB       GLU  81   1.345   0.935  -6.386
  558   2HB   GLU  81          1HB       GLU  81   0.735   2.530  -6.781
  559   1HG   GLU  81          2HG       GLU  81   1.871   0.574  -8.751
  560   2HG   GLU  81          1HG       GLU  81   0.158   0.837  -8.424
  561    H    GLN  82           H        GLN  82   3.285   0.477  -5.245
  562    HA   GLN  82           HA       GLN  82   2.697   1.805  -2.818
  563   1HB   GLN  82          2HB       GLN  82   4.402  -0.652  -3.207
  564   2HB   GLN  82          1HB       GLN  82   3.655  -0.129  -1.707
  565   1HG   GLN  82          2HG       GLN  82   1.436  -0.353  -2.962
  566   2HG   GLN  82          1HG       GLN  82   2.367  -1.284  -4.141
  567   1HE2  GLN  82          1HE2      GLN  82   1.465  -3.260  -3.714
  568   2HE2  GLN  82          2HE2      GLN  82   1.649  -4.078  -2.197
  569    H    ILE  83           H        ILE  83   5.662   1.183  -4.582
  570    HA   ILE  83           HA       ILE  83   7.497   2.223  -2.759
  571    HB   ILE  83           HB       ILE  83   7.483   2.153  -5.774
  572   1HG1  ILE  83          2HG1      ILE  83   9.341   0.764  -3.852
  573   2HG1  ILE  83          1HG1      ILE  83   7.801   0.060  -4.330
  574   1HG2  ILE  83          1HG2      ILE  83   9.837   2.849  -5.732
  575   2HG2  ILE  83          2HG2      ILE  83   9.698   3.173  -4.003
  576   3HG2  ILE  83          3HG2      ILE  83   8.758   4.119  -5.158
  577   1HD1  ILE  83          1HD1      ILE  83  10.065   0.785  -6.179
  578   2HD1  ILE  83          2HD1      ILE  83   8.527   0.068  -6.661
  579   3HD1  ILE  83          3HD1      ILE  83   9.639  -0.839  -5.639
  580    H    ALA  84           H        ALA  84   5.610   3.846  -5.318
  581    HA   ALA  84           HA       ALA  84   6.698   6.413  -4.923
  582   1HB   ALA  84          1HB       ALA  84   5.451   5.793  -6.925
  583   2HB   ALA  84          2HB       ALA  84   4.769   7.233  -6.169
  584   3HB   ALA  84          3HB       ALA  84   3.971   5.672  -5.973
  585    H    VAL  85           H        VAL  85   3.851   4.865  -3.508
  586    HA   VAL  85           HA       VAL  85   2.955   7.128  -2.052
  587    HB   VAL  85           HB       VAL  85   2.527   4.197  -1.504
  588   1HG1  VAL  85          1HG1      VAL  85   0.516   4.928  -0.281
  589   2HG1  VAL  85          2HG1      VAL  85   0.987   6.609  -0.536
  590   3HG1  VAL  85          3HG1      VAL  85   1.998   5.551   0.450
  591   1HG2  VAL  85          1HG2      VAL  85   0.426   4.465  -2.702
  592   2HG2  VAL  85          2HG2      VAL  85   1.801   4.852  -3.736
  593   3HG2  VAL  85          3HG2      VAL  85   0.825   6.148  -3.043
  594    H    ALA  86           H        ALA  86   4.813   4.251  -1.052
  595    HA   ALA  86           HA       ALA  86   5.417   5.081   1.540
  596   1HB   ALA  86          1HB       ALA  86   7.226   3.449   1.449
  597   2HB   ALA  86          2HB       ALA  86   7.051   3.344  -0.304
  598   3HB   ALA  86          3HB       ALA  86   5.746   2.794   0.746
  599    H    GLU  87           H        GLU  87   6.743   5.946  -1.535
  600    HA   GLU  87           HA       GLU  87   9.223   7.013  -0.742
  601   1HB   GLU  87          2HB       GLU  87   7.399   7.609  -3.050
  602   2HB   GLU  87          1HB       GLU  87   8.807   8.621  -2.772
  603   1HG   GLU  87          2HG       GLU  87   8.856   5.644  -3.208
  604   2HG   GLU  87          1HG       GLU  87   9.208   6.865  -4.429
  605    H    VAL  88           H        VAL  88   6.031   8.567  -0.994
  606    HA   VAL  88           HA       VAL  88   6.879  11.108  -0.124
  607    HB   VAL  88           HB       VAL  88   4.158   9.845   0.304
  608   1HG1  VAL  88          1HG1      VAL  88   5.004  12.744   0.338
  609   2HG1  VAL  88          2HG1      VAL  88   4.570  11.776   1.752
  610   3HG1  VAL  88          3HG1      VAL  88   3.357  12.140   0.518
  611   1HG2  VAL  88          1HG2      VAL  88   3.509  11.092  -1.721
  612   2HG2  VAL  88          2HG2      VAL  88   4.742   9.875  -2.051
  613   3HG2  VAL  88          3HG2      VAL  88   5.191  11.577  -1.946
  614    H    THR  89           H        THR  89   5.856   8.219   1.585
  615    HA   THR  89           HA       THR  89   5.648   9.448   4.136
  616    HB   THR  89           HB       THR  89   6.245   6.534   3.826
  617    HG1  THR  89           1HG      THR  89   4.179   7.933   2.608
  618   1HG2  THR  89          1HG2      THR  89   4.130   7.974   5.413
  619   2HG2  THR  89          2HG2      THR  89   5.746   7.626   6.020
  620   3HG2  THR  89          3HG2      THR  89   4.662   6.302   5.594
  621    H    ARG  90           H        ARG  90   8.159   7.468   2.586
  622    HA   ARG  90           HA       ARG  90   9.807   7.165   4.836
  623   1HB   ARG  90          2HB       ARG  90  11.509   6.375   3.329
  624   2HB   ARG  90          1HB       ARG  90   9.948   5.768   2.801
  625   1HG   ARG  90          2HG       ARG  90  10.135   6.751   0.816
  626   2HG   ARG  90          1HG       ARG  90  10.626   8.287   1.537
  627   1HD   ARG  90          2HD       ARG  90  12.894   7.577   1.687
  628   2HD   ARG  90          1HD       ARG  90  12.468   5.928   1.231
  629    HE   ARG  90           HE       ARG  90  11.846   6.887  -0.984
  630   1HH1  ARG  90          1HH1      ARG  90  14.142   8.561   1.090
  631   2HH1  ARG  90          2HH1      ARG  90  14.989   9.283  -0.243
  632   1HH2  ARG  90          1HH2      ARG  90  12.913   7.865  -2.707
  633   2HH2  ARG  90          2HH2      ARG  90  14.304   8.875  -2.411
  634    H    LEU  91           H        LEU  91   9.572   9.708   2.503
  635    HA   LEU  91           HA       LEU  91  12.149  10.809   3.054
  636   1HB   LEU  91          2HB       LEU  91  11.487  12.690   1.665
  637   2HB   LEU  91          1HB       LEU  91  11.152  11.164   0.883
  638    HG   LEU  91           HG       LEU  91   8.708  11.553   1.761
  639   1HD1  LEU  91          1HD1      LEU  91   8.119  13.929   1.841
  640   2HD1  LEU  91          2HD1      LEU  91   9.826  14.357   1.742
  641   3HD1  LEU  91          3HD1      LEU  91   9.215  13.488   3.149
  642   1HD2  LEU  91          1HD2      LEU  91   9.923  13.126  -0.506
  643   2HD2  LEU  91          2HD2      LEU  91   8.206  12.786  -0.294
  644   3HD2  LEU  91          3HD2      LEU  91   9.336  11.463  -0.577
  645    H    ARG  92           H        ARG  92   9.134  10.954   4.597
  646    HA   ARG  92           HA       ARG  92   9.581  13.543   5.815
  647   1HB   ARG  92          2HB       ARG  92   7.412  11.599   6.489
  648   2HB   ARG  92          1HB       ARG  92   7.418  13.345   6.704
  649   1HG   ARG  92          2HG       ARG  92   7.217  13.719   4.382
  650   2HG   ARG  92          1HG       ARG  92   7.520  12.017   4.024
  651   1HD   ARG  92          2HD       ARG  92   5.093  13.299   5.186
  652   2HD   ARG  92          1HD       ARG  92   5.235  12.205   3.813
  653    HE   ARG  92           HE       ARG  92   6.060  10.837   6.096
  654   1HH1  ARG  92          1HH1      ARG  92   3.176  12.194   4.633
  655   2HH1  ARG  92          2HH1      ARG  92   2.083  11.141   5.483
  656   1HH2  ARG  92          1HH2      ARG  92   4.593   9.462   7.256
  657   2HH2  ARG  92          2HH2      ARG  92   2.878   9.601   6.967
  658    H    GLN  93           H        GLN  93   9.176  10.180   6.816
  659    HA   GLN  93           HA       GLN  93   9.941  11.006   9.485
  660   1HB   GLN  93          2HB       GLN  93   8.720   9.299  10.354
  661   2HB   GLN  93          1HB       GLN  93   7.873   9.539   8.829
  662   1HG   GLN  93          2HG       GLN  93   9.990   7.449   9.289
  663   2HG   GLN  93          1HG       GLN  93   8.258   7.169   9.446
  664   1HE2  GLN  93          1HE2      GLN  93   6.967   7.229   7.585
  665   2HE2  GLN  93          2HE2      GLN  93   7.661   7.042   6.005
  666    H    GLY  94           H        GLY  94  11.279   9.137   6.876
  667   1HA   GLY  94          2HA       GLY  94  13.617   8.894   6.643
  668   2HA   GLY  94          1HA       GLY  94  13.796   9.196   8.366
  669    H    TRP  95           H        TRP  95  11.703   6.898   6.731
  670    HA   TRP  95           HA       TRP  95  11.470   4.668   6.811
  671   1HB   TRP  95          2HB       TRP  95  14.349   4.360   7.636
  672   2HB   TRP  95          1HB       TRP  95  13.353   3.253   6.692
  673    HD1  TRP  95           HD       TRP  95  15.243   6.578   6.332
  674    HE1  TRP  95           1HE      TRP  95  15.814   6.917   3.864
  675    HE3  TRP  95           3HE      TRP  95  12.691   2.615   4.378
  676    HZ2  TRP  95           2HZ      TRP  95  15.254   5.671   1.385
  677    HZ3  TRP  95           3HZ      TRP  95  12.755   2.260   1.945
  678    HH2  TRP  95           HH       TRP  95  14.009   3.758   0.483
  679    H    GLY  96           H        GLY  96  11.654   6.528   9.305
  680   1HA   GLY  96          2HA       GLY  96  12.195   4.760  11.482
  681   2HA   GLY  96          1HA       GLY  96  11.411   6.327  11.589
  682    H    ALA  97           H        ALA  97   9.452   5.315   9.498
  683    HA   ALA  97           HA       ALA  97   7.529   4.214  11.328
  684   1HB   ALA  97          1HB       ALA  97   6.846   5.807   9.595
  685   2HB   ALA  97          2HB       ALA  97   5.989   4.273   9.435
  686   3HB   ALA  97          3HB       ALA  97   7.325   4.653   8.351
  687    H    TRP  98           H        TRP  98   9.699   3.067   8.895
  688    HA   TRP  98           HA       TRP  98   8.612   0.350   9.099
  689   1HB   TRP  98          2HB       TRP  98  10.668   1.576   7.236
  690   2HB   TRP  98          1HB       TRP  98  10.180  -0.114   7.202
  691    HD1  TRP  98           HD       TRP  98   7.709  -0.662   6.310
  692    HE1  TRP  98           1HE      TRP  98   6.127   0.625   4.741
  693    HE3  TRP  98           3HE      TRP  98   9.912   3.978   6.553
  694    HZ2  TRP  98           2HZ      TRP  98   5.856   3.268   3.723
  695    HZ3  TRP  98           3HZ      TRP  98   8.922   5.808   5.244
  696    HH2  TRP  98           HH       TRP  98   6.939   5.454   3.872
  697    HA   PRO  99           HA       PRO  99  11.799   0.253  12.226
  698   1HB   PRO  99          2HB       PRO  99  10.568  -2.268  13.069
  699   2HB   PRO  99          1HB       PRO  99  10.729  -0.742  13.938
  700   1HG   PRO  99          2HG       PRO  99   8.353  -1.544  13.023
  701   2HG   PRO  99          1HG       PRO  99   8.849   0.162  12.982
  702   1HD   PRO  99          2HD       PRO  99   8.942  -1.854  10.746
  703   2HD   PRO  99          1HD       PRO  99   8.246  -0.212  10.745
  704    H    VAL 100           H        VAL 100  11.174  -3.176  11.823
  705    HA   VAL 100           HA       VAL 100  13.977  -3.692  11.929
  706    HB   VAL 100           HB       VAL 100  11.701  -5.601  11.359
  707   1HG1  VAL 100          1HG1      VAL 100  13.885  -6.486  10.700
  708   2HG1  VAL 100          2HG1      VAL 100  13.221  -7.349  12.088
  709   3HG1  VAL 100          3HG1      VAL 100  14.503  -6.159  12.320
  710   1HG2  VAL 100          1HG2      VAL 100  11.386  -4.468  13.483
  711   2HG2  VAL 100          2HG2      VAL 100  13.031  -4.882  13.968
  712   3HG2  VAL 100          3HG2      VAL 100  11.829  -6.154  13.747
  713    H    CYS 101           H        CYS 101  11.642  -3.330   9.439
  714    HA   CYS 101           HA       CYS 101  13.053  -5.014   7.567
  715   1HB   CYS 101          2HB       CYS 101  10.554  -3.354   7.230
  716   2HB   CYS 101          1HB       CYS 101  11.191  -4.494   6.042
  717    H    ALA 102           H        ALA 102  12.624  -1.557   8.115
  718    HA   ALA 102           HA       ALA 102  13.761  -0.763   5.636
  719   1HB   ALA 102          1HB       ALA 102  12.445   0.777   7.018
  720   2HB   ALA 102          2HB       ALA 102  14.039   1.429   6.641
  721   3HB   ALA 102          3HB       ALA 102  13.716   0.758   8.239
  722    H    ALA 103           H        ALA 103  15.106  -1.299   8.868
  723    HA   ALA 103           HA       ALA 103  17.760  -0.613   8.305
  724   1HB   ALA 103          1HB       ALA 103  18.345  -1.938  10.266
  725   2HB   ALA 103          2HB       ALA 103  16.742  -2.675  10.253
  726   3HB   ALA 103          3HB       ALA 103  16.916  -0.950  10.573
  727    H    ARG 104           H        ARG 104  15.982  -3.592   7.827
  728    HA   ARG 104           HA       ARG 104  18.197  -5.162   6.975
  729   1HB   ARG 104          2HB       ARG 104  15.208  -5.421   6.814
  730   2HB   ARG 104          1HB       ARG 104  16.257  -6.572   5.992
  731   1HG   ARG 104          2HG       ARG 104  17.284  -7.161   8.125
  732   2HG   ARG 104          1HG       ARG 104  16.253  -5.988   8.947
  733   1HD   ARG 104          2HD       ARG 104  15.440  -8.353   9.074
  734   2HD   ARG 104          1HD       ARG 104  14.282  -7.215   8.384
  735    HE   ARG 104           HE       ARG 104  15.561  -8.173   6.205
  736   1HH1  ARG 104          1HH1      ARG 104  13.971  -9.752   8.903
  737   2HH1  ARG 104          2HH1      ARG 104  13.524 -11.149   7.968
  738   1HH2  ARG 104          1HH2      ARG 104  14.957  -9.982   4.991
  739   2HH2  ARG 104          2HH2      ARG 104  14.062 -11.269   5.746
  740    H    ALA 105           H        ALA 105  15.809  -3.154   5.377
  741    HA   ALA 105           HA       ALA 105  16.433  -4.099   2.726
  742   1HB   ALA 105          1HB       ALA 105  14.773  -2.500   2.020
  743   2HB   ALA 105          2HB       ALA 105  14.754  -1.778   3.629
  744   3HB   ALA 105          3HB       ALA 105  14.185  -3.432   3.396
  745    H    GLY 106           H        GLY 106  17.544  -1.533   4.775
  746   1HA   GLY 106          2HA       GLY 106  19.690  -0.520   4.097
  747   2HA   GLY 106          1HA       GLY 106  19.014  -0.384   2.480
  748    H    ALA 107           H        ALA 107  18.139   0.539   5.787
  749    HA   ALA 107           HA       ALA 107  16.580   2.769   5.120
  750   1HB   ALA 107          1HB       ALA 107  16.448   1.620   7.287
  751   2HB   ALA 107          2HB       ALA 107  16.711   3.354   7.468
  752   3HB   ALA 107          3HB       ALA 107  18.051   2.231   7.698
  753    H    ARG 108           H        ARG 108  17.053   5.019   5.397
  754    HA   ARG 108           HA       ARG 108  19.881   5.619   4.898
  755   1HB   ARG 108          2HB       ARG 108  17.561   6.623   3.248
  756   2HB   ARG 108          1HB       ARG 108  19.258   7.016   3.003
  757   1HG   ARG 108          2HG       ARG 108  19.752   4.721   2.440
  758   2HG   ARG 108          1HG       ARG 108  18.082   4.245   2.783
  759   1HD   ARG 108          2HD       ARG 108  18.530   4.553   0.360
  760   2HD   ARG 108          1HD       ARG 108  17.282   5.643   0.973
  761    HE   ARG 108           HE       ARG 108  19.943   6.761   0.984
  762   1HH1  ARG 108          1HH1      ARG 108  17.042   6.274  -0.936
  763   2HH1  ARG 108          2HH1      ARG 108  17.333   7.676  -1.930
  764   1HH2  ARG 108          1HH2      ARG 108  20.300   8.589  -0.315
  765   2HH2  ARG 108          2HH2      ARG 108  19.191   8.969  -1.591
  Start of MODEL    8
    1   1H    ASN   1          1HT       ASN   1  43.501 -36.725 -32.875
    2   2H    ASN   1          2HT       ASN   1  42.482 -36.620 -31.529
    3   3H    ASN   1          3HT       ASN   1  44.169 -36.566 -31.331
    4    HA   ASN   1           HA       ASN   1  44.228 -34.514 -32.647
    5   1HB   ASN   1          2HB       ASN   1  41.228 -34.733 -32.370
    6   2HB   ASN   1          1HB       ASN   1  42.092 -33.290 -32.888
    7   1HD2  ASN   1          1HD2      ASN   1  40.120 -35.025 -34.272
    8   2HD2  ASN   1          2HD2      ASN   1  40.897 -35.490 -35.753
    9    H    VAL   2           H        VAL   2  45.337 -34.142 -30.821
   10    HA   VAL   2           HA       VAL   2  43.890 -33.343 -28.409
   11    HB   VAL   2           HB       VAL   2  45.933 -34.848 -28.312
   12   1HG1  VAL   2          1HG1      VAL   2  47.373 -32.271 -28.914
   13   2HG1  VAL   2          2HG1      VAL   2  47.338 -33.718 -29.921
   14   3HG1  VAL   2          3HG1      VAL   2  48.133 -33.759 -28.347
   15   1HG2  VAL   2          1HG2      VAL   2  45.069 -33.774 -26.323
   16   2HG2  VAL   2          2HG2      VAL   2  45.966 -32.302 -26.695
   17   3HG2  VAL   2          3HG2      VAL   2  46.832 -33.781 -26.284
   18    H    VAL   3           H        VAL   3  44.932 -32.001 -31.214
   19    HA   VAL   3           HA       VAL   3  46.008 -29.547 -30.539
   20    HB   VAL   3           HB       VAL   3  44.166 -30.176 -32.849
   21   1HG1  VAL   3          1HG1      VAL   3  44.411 -27.775 -32.490
   22   2HG1  VAL   3          2HG1      VAL   3  45.238 -28.277 -33.965
   23   3HG1  VAL   3          3HG1      VAL   3  46.167 -27.942 -32.503
   24   1HG2  VAL   3          1HG2      VAL   3  46.205 -30.560 -34.135
   25   2HG2  VAL   3          2HG2      VAL   3  46.097 -31.671 -32.768
   26   3HG2  VAL   3          3HG2      VAL   3  47.177 -30.278 -32.692
   27    H    VAL   4           H        VAL   4  45.137 -28.235 -29.065
   28    HA   VAL   4           HA       VAL   4  42.279 -27.990 -28.761
   29    HB   VAL   4           HB       VAL   4  43.617 -28.008 -26.773
   30   1HG1  VAL   4          1HG1      VAL   4  45.699 -27.117 -27.642
   31   2HG1  VAL   4          2HG1      VAL   4  45.195 -26.215 -26.213
   32   3HG1  VAL   4          3HG1      VAL   4  44.959 -25.526 -27.819
   33   1HG2  VAL   4          1HG2      VAL   4  41.581 -26.706 -26.661
   34   2HG2  VAL   4          2HG2      VAL   4  42.447 -25.274 -27.217
   35   3HG2  VAL   4          3HG2      VAL   4  42.827 -25.981 -25.646
   36    H    THR   5           H        THR   5  41.107 -26.142 -29.039
   37    HA   THR   5           HA       THR   5  42.237 -24.307 -31.021
   38    HB   THR   5           HB       THR   5  40.195 -25.391 -31.751
   39    HG1  THR   5           1HG      THR   5  40.443 -23.276 -32.465
   40   1HG2  THR   5          1HG2      THR   5  38.049 -24.999 -30.643
   41   2HG2  THR   5          2HG2      THR   5  38.868 -24.119 -29.354
   42   3HG2  THR   5          3HG2      THR   5  39.170 -25.843 -29.576
   43    HA   PRO   6           HA       PRO   6  42.457 -21.351 -27.755
   44   1HB   PRO   6          2HB       PRO   6  43.827 -19.492 -29.051
   45   2HB   PRO   6          1HB       PRO   6  44.563 -21.065 -28.702
   46   1HG   PRO   6          2HG       PRO   6  43.339 -20.063 -31.230
   47   2HG   PRO   6          1HG       PRO   6  44.839 -20.985 -31.009
   48   1HD   PRO   6          2HD       PRO   6  42.397 -22.077 -31.724
   49   2HD   PRO   6          1HD       PRO   6  43.715 -22.985 -30.964
   50    H    ALA   7           H        ALA   7  40.769 -20.336 -27.193
   51    HA   ALA   7           HA       ALA   7  39.068 -18.802 -28.945
   52   1HB   ALA   7          1HB       ALA   7  37.773 -18.311 -26.949
   53   2HB   ALA   7          2HB       ALA   7  39.020 -19.044 -25.942
   54   3HB   ALA   7          3HB       ALA   7  38.101 -20.038 -27.071
   55    H    HIS   8           H        HIS   8  40.677 -17.443 -29.714
   56    HA   HIS   8           HA       HIS   8  41.759 -15.395 -28.018
   57   1HB   HIS   8          2HB       HIS   8  42.833 -16.238 -30.163
   58   2HB   HIS   8          1HB       HIS   8  41.564 -15.392 -31.039
   59    HD1  HIS   8           1HD      HIS   8  41.834 -12.858 -31.327
   60    HD2  HIS   8           2HD      HIS   8  44.670 -14.570 -28.812
   61    HE1  HIS   8           1HE      HIS   8  43.570 -11.072 -30.885
   62    H    GLU   9           H        GLU   9  38.832 -16.151 -29.394
   63    HA   GLU   9           HA       GLU   9  37.895 -13.416 -29.673
   64   1HB   GLU   9          2HB       GLU   9  36.812 -16.112 -30.264
   65   2HB   GLU   9          1HB       GLU   9  35.646 -14.848 -29.882
   66   1HG   GLU   9          2HG       GLU   9  36.299 -13.539 -31.691
   67   2HG   GLU   9          1HG       GLU   9  37.790 -14.452 -31.929
   68    H    ALA  10           H        ALA  10  37.122 -12.282 -28.062
   69    HA   ALA  10           HA       ALA  10  35.990 -13.738 -25.778
   70   1HB   ALA  10          1HB       ALA  10  37.559 -11.161 -25.632
   71   2HB   ALA  10          2HB       ALA  10  38.170 -12.752 -25.181
   72   3HB   ALA  10          3HB       ALA  10  36.848 -12.025 -24.269
   73    H    VAL  11           H        VAL  11  34.350 -13.296 -27.609
   74    HA   VAL  11           HA       VAL  11  32.961 -10.803 -27.370
   75    HB   VAL  11           HB       VAL  11  31.988 -13.401 -28.495
   76   1HG1  VAL  11          1HG1      VAL  11  30.318 -12.069 -29.663
   77   2HG1  VAL  11          2HG1      VAL  11  30.939 -10.608 -28.895
   78   3HG1  VAL  11          3HG1      VAL  11  30.179 -11.864 -27.916
   79   1HG2  VAL  11          1HG2      VAL  11  33.960 -12.674 -29.678
   80   2HG2  VAL  11          2HG2      VAL  11  33.279 -11.058 -29.870
   81   3HG2  VAL  11          3HG2      VAL  11  32.537 -12.432 -30.692
   82    H    VAL  12           H        VAL  12  32.385 -14.121 -26.401
   83    HA   VAL  12           HA       VAL  12  30.759 -14.992 -25.057
   84    HB   VAL  12           HB       VAL  12  32.836 -15.247 -23.988
   85   1HG1  VAL  12          1HG1      VAL  12  33.714 -13.696 -22.317
   86   2HG1  VAL  12          2HG1      VAL  12  32.377 -12.593 -22.647
   87   3HG1  VAL  12          3HG1      VAL  12  33.570 -12.932 -23.901
   88   1HG2  VAL  12          1HG2      VAL  12  30.912 -16.057 -22.787
   89   2HG2  VAL  12          2HG2      VAL  12  30.700 -14.487 -22.016
   90   3HG2  VAL  12          3HG2      VAL  12  32.119 -15.466 -21.645
   91    H    ARG  13           H        ARG  13  29.034 -13.728 -25.707
   92    HA   ARG  13           HA       ARG  13  27.776 -12.479 -23.448
   93   1HB   ARG  13          2HB       ARG  13  28.331 -11.068 -25.964
   94   2HB   ARG  13          1HB       ARG  13  26.803 -10.757 -25.159
   95   1HG   ARG  13          2HG       ARG  13  27.891  -9.994 -23.204
   96   2HG   ARG  13          1HG       ARG  13  29.454 -10.578 -23.777
   97   1HD   ARG  13          2HD       ARG  13  27.942  -8.516 -25.329
   98   2HD   ARG  13          1HD       ARG  13  28.903  -8.050 -23.926
   99    HE   ARG  13           HE       ARG  13  30.532  -9.632 -25.512
  100   1HH1  ARG  13          1HH1      ARG  13  28.843  -6.576 -25.804
  101   2HH1  ARG  13          2HH1      ARG  13  30.037  -5.870 -26.859
  102   1HH2  ARG  13          1HH2      ARG  13  32.101  -8.703 -26.887
  103   2HH2  ARG  13          2HH2      ARG  13  31.888  -7.086 -27.480
  104    H    VAL  14           H        VAL  14  26.148 -13.695 -23.127
  105    HA   VAL  14           HA       VAL  14  24.364 -14.388 -25.341
  106    HB   VAL  14           HB       VAL  14  24.546 -15.977 -22.815
  107   1HG1  VAL  14          1HG1      VAL  14  22.621 -16.394 -24.199
  108   2HG1  VAL  14          2HG1      VAL  14  23.691 -17.795 -24.243
  109   3HG1  VAL  14          3HG1      VAL  14  23.649 -16.673 -25.604
  110   1HG2  VAL  14          1HG2      VAL  14  26.074 -17.566 -23.912
  111   2HG2  VAL  14          2HG2      VAL  14  26.813 -15.984 -23.665
  112   3HG2  VAL  14          3HG2      VAL  14  26.236 -16.447 -25.266
  113    H    GLY  15           H        GLY  15  22.143 -14.674 -24.576
  114   1HA   GLY  15          2HA       GLY  15  20.303 -14.167 -23.279
  115   2HA   GLY  15          1HA       GLY  15  21.392 -13.586 -22.018
  116    H    THR  16           H        THR  16  20.418 -12.837 -25.296
  117    HA   THR  16           HA       THR  16  21.223 -10.123 -25.023
  118    HB   THR  16           HB       THR  16  19.831 -11.556 -27.283
  119    HG1  THR  16           1HG      THR  16  21.849 -12.420 -27.091
  120   1HG2  THR  16          1HG2      THR  16  19.492  -9.147 -27.407
  121   2HG2  THR  16          2HG2      THR  16  20.580  -9.701 -28.680
  122   3HG2  THR  16          3HG2      THR  16  21.226  -8.887 -27.256
  123    H    LYS  17           H        LYS  17  18.338 -11.876 -24.668
  124    HA   LYS  17           HA       LYS  17  16.644  -9.587 -24.930
  125   1HB   LYS  17          2HB       LYS  17  14.871 -11.370 -24.125
  126   2HB   LYS  17          1HB       LYS  17  15.439 -11.291 -25.783
  127   1HG   LYS  17          2HG       LYS  17  15.409 -13.564 -25.139
  128   2HG   LYS  17          1HG       LYS  17  17.096 -13.061 -25.227
  129   1HD   LYS  17          2HD       LYS  17  16.774 -12.580 -22.679
  130   2HD   LYS  17          1HD       LYS  17  15.428 -13.714 -22.844
  131   1HE   LYS  17          2HE       LYS  17  18.195 -14.293 -23.811
  132   2HE   LYS  17          1HE       LYS  17  17.656 -14.700 -22.178
  133   1HZ   LYS  17          1HZ       LYS  17  17.475 -16.522 -23.897
  134   2HZ   LYS  17          2HZ       LYS  17  16.212 -15.629 -24.596
  135   3HZ   LYS  17          3HZ       LYS  17  16.069 -16.197 -23.007
  136    HA   PRO  18           HA       PRO  18  16.827  -8.812 -20.518
  137   1HB   PRO  18          2HB       PRO  18  15.962  -6.156 -21.092
  138   2HB   PRO  18          1HB       PRO  18  17.579  -6.687 -20.626
  139   1HG   PRO  18          2HG       PRO  18  16.915  -5.645 -23.088
  140   2HG   PRO  18          1HG       PRO  18  18.325  -6.667 -22.769
  141   1HD   PRO  18          2HD       PRO  18  15.669  -7.412 -23.931
  142   2HD   PRO  18          1HD       PRO  18  17.295  -7.977 -24.387
  143    H    GLY  19           H        GLY  19  15.252  -7.798 -19.088
  144   1HA   GLY  19          2HA       GLY  19  13.064  -7.241 -18.453
  145   2HA   GLY  19          1HA       GLY  19  12.487  -7.732 -20.041
  146    H    THR  20           H        THR  20  14.594  -9.574 -18.041
  147    HA   THR  20           HA       THR  20  12.903 -11.868 -18.007
  148    HB   THR  20           HB       THR  20  15.404 -11.247 -16.419
  149    HG1  THR  20           1HG      THR  20  14.915 -12.302 -18.991
  150   1HG2  THR  20          1HG2      THR  20  15.603 -13.673 -16.162
  151   2HG2  THR  20          2HG2      THR  20  14.057 -13.886 -16.984
  152   3HG2  THR  20          3HG2      THR  20  14.120 -13.069 -15.423
  153    H    GLU  21           H        GLU  21  13.489  -9.163 -15.947
  154    HA   GLU  21           HA       GLU  21  11.366  -9.975 -14.156
  155   1HB   GLU  21          2HB       GLU  21  14.026  -8.846 -13.236
  156   2HB   GLU  21          1HB       GLU  21  12.649  -9.208 -12.204
  157   1HG   GLU  21          2HG       GLU  21  12.884 -11.567 -12.642
  158   2HG   GLU  21          1HG       GLU  21  14.177 -11.254 -13.799
  159    H    VAL  22           H        VAL  22  10.135  -8.241 -13.537
  160    HA   VAL  22           HA       VAL  22  10.276  -5.937 -15.207
  161    HB   VAL  22           HB       VAL  22   8.502  -6.382 -12.799
  162   1HG1  VAL  22          1HG1      VAL  22   7.019  -4.765 -13.884
  163   2HG1  VAL  22          2HG1      VAL  22   8.198  -4.548 -15.176
  164   3HG1  VAL  22          3HG1      VAL  22   8.593  -4.053 -13.531
  165   1HG2  VAL  22          1HG2      VAL  22   7.987  -7.010 -15.703
  166   2HG2  VAL  22          2HG2      VAL  22   6.846  -7.223 -14.372
  167   3HG2  VAL  22          3HG2      VAL  22   8.317  -8.197 -14.441
  168    HA   PRO  23           HA       PRO  23  13.317  -3.877 -12.810
  169   1HB   PRO  23          2HB       PRO  23  12.338  -1.491 -14.270
  170   2HB   PRO  23          1HB       PRO  23  13.978  -2.134 -14.133
  171   1HG   PRO  23          2HG       PRO  23  12.595  -2.455 -16.376
  172   2HG   PRO  23          1HG       PRO  23  13.612  -3.765 -15.747
  173   1HD   PRO  23          2HD       PRO  23  10.659  -3.437 -15.583
  174   2HD   PRO  23          1HD       PRO  23  11.611  -4.893 -15.911
  175    HA   PRO  24           HA       PRO  24  10.947  -2.080  -9.469
  176   1HB   PRO  24          2HB       PRO  24  13.165  -1.557  -7.956
  177   2HB   PRO  24          1HB       PRO  24  12.357  -3.131  -8.014
  178   1HG   PRO  24          2HG       PRO  24  14.746  -2.181  -9.563
  179   2HG   PRO  24          1HG       PRO  24  14.521  -3.710  -8.683
  180   1HD   PRO  24          2HD       PRO  24  14.184  -3.654 -11.303
  181   2HD   PRO  24          1HD       PRO  24  13.043  -4.540 -10.274
  182    H    VAL  25           H        VAL  25  10.799  -0.047  -8.542
  183    HA   VAL  25           HA       VAL  25  12.007   2.163  -9.913
  184    HB   VAL  25           HB       VAL  25  10.015   1.987  -7.631
  185   1HG1  VAL  25          1HG1      VAL  25  11.200   4.516  -8.808
  186   2HG1  VAL  25          2HG1      VAL  25  11.539   3.884  -7.196
  187   3HG1  VAL  25          3HG1      VAL  25   9.910   4.421  -7.606
  188   1HG2  VAL  25          1HG2      VAL  25   8.559   3.119  -9.232
  189   2HG2  VAL  25          2HG2      VAL  25   9.176   1.600  -9.880
  190   3HG2  VAL  25          3HG2      VAL  25   9.862   3.133 -10.420
  191    H    ILE  26           H        ILE  26  13.255   3.785  -8.672
  192    HA   ILE  26           HA       ILE  26  15.625   2.458  -8.174
  193    HB   ILE  26           HB       ILE  26  15.027   5.308  -7.414
  194   1HG1  ILE  26          2HG1      ILE  26  14.377   4.896  -9.728
  195   2HG1  ILE  26          1HG1      ILE  26  15.848   5.864  -9.683
  196   1HG2  ILE  26          1HG2      ILE  26  17.416   5.673  -7.797
  197   2HG2  ILE  26          2HG2      ILE  26  17.626   3.952  -8.122
  198   3HG2  ILE  26          3HG2      ILE  26  17.139   4.495  -6.516
  199   1HD1  ILE  26          1HD1      ILE  26  15.685   2.909 -10.231
  200   2HD1  ILE  26          2HD1      ILE  26  17.168   3.861 -10.165
  201   3HD1  ILE  26          3HD1      ILE  26  15.969   4.181 -11.418
  202    H    ASP  27           H        ASP  27  13.320   3.625  -5.842
  203    HA   ASP  27           HA       ASP  27  15.130   2.791  -3.699
  204   1HB   ASP  27          2HB       ASP  27  12.835   4.710  -3.709
  205   2HB   ASP  27          1HB       ASP  27  13.361   3.946  -2.212
  206    H    GLY  28           H        GLY  28  12.856   1.648  -5.551
  207   1HA   GLY  28          2HA       GLY  28  11.120   0.322  -3.711
  208   2HA   GLY  28          1HA       GLY  28  11.285  -0.023  -5.426
  209    H    SER  29           H        SER  29  14.303  -0.006  -4.304
  210    HA   SER  29           HA       SER  29  14.527  -2.866  -4.125
  211   1HB   SER  29          2HB       SER  29  16.586  -0.793  -3.401
  212   2HB   SER  29          1HB       SER  29  16.874  -2.476  -3.835
  213    HG   SER  29           HG       SER  29  16.902  -0.454  -5.460
  214    H    ILE  30           H        ILE  30  14.600  -0.133  -1.998
  215    HA   ILE  30           HA       ILE  30  15.061  -1.588   0.425
  216    HB   ILE  30           HB       ILE  30  13.544   0.918   0.746
  217   1HG1  ILE  30          2HG1      ILE  30  14.770   1.517  -1.328
  218   2HG1  ILE  30          1HG1      ILE  30  15.308   2.449   0.059
  219   1HG2  ILE  30          1HG2      ILE  30  14.657  -0.152   2.579
  220   2HG2  ILE  30          2HG2      ILE  30  15.361   1.438   2.288
  221   3HG2  ILE  30          3HG2      ILE  30  16.212  -0.015   1.762
  222   1HD1  ILE  30          1HD1      ILE  30  16.741   0.080  -1.117
  223   2HD1  ILE  30          2HD1      ILE  30  17.293   1.060   0.245
  224   3HD1  ILE  30          3HD1      ILE  30  17.160   1.776  -1.365
  225    H    TRP  31           H        TRP  31  12.371  -0.440  -1.435
  226    HA   TRP  31           HA       TRP  31  10.367  -1.002   0.498
  227   1HB   TRP  31          2HB       TRP  31  10.170  -0.475  -2.478
  228   2HB   TRP  31          1HB       TRP  31   8.790  -0.561  -1.383
  229    HD1  TRP  31           HD       TRP  31  10.530   2.020  -3.017
  230    HE1  TRP  31           1HE      TRP  31  10.650   4.219  -1.656
  231    HE3  TRP  31           3HE      TRP  31   9.370   0.157   1.527
  232    HZ2  TRP  31           2HZ      TRP  31  10.299   5.008   1.006
  233    HZ3  TRP  31           3HZ      TRP  31   9.292   1.673   3.463
  234    HH2  TRP  31           HH       TRP  31   9.749   4.054   3.203
  235    H    ASP  32           H        ASP  32  11.812  -2.770  -2.168
  236    HA   ASP  32           HA       ASP  32   9.877  -4.894  -2.047
  237   1HB   ASP  32          2HB       ASP  32  10.839  -4.594  -4.170
  238   2HB   ASP  32          1HB       ASP  32  12.480  -4.513  -3.510
  239    H    ALA  33           H        ALA  33  13.068  -4.242  -0.659
  240    HA   ALA  33           HA       ALA  33  13.379  -6.833   0.438
  241   1HB   ALA  33          1HB       ALA  33  14.588  -4.217   1.315
  242   2HB   ALA  33          2HB       ALA  33  15.282  -5.348   0.153
  243   3HB   ALA  33          3HB       ALA  33  15.108  -5.816   1.845
  244    H    ILE  34           H        ILE  34  11.941  -3.813   1.605
  245    HA   ILE  34           HA       ILE  34  11.245  -4.729   4.193
  246    HB   ILE  34           HB       ILE  34   9.978  -2.654   2.423
  247   1HG1  ILE  34          2HG1      ILE  34  11.760  -2.452   4.861
  248   2HG1  ILE  34          1HG1      ILE  34  12.252  -2.161   3.197
  249   1HG2  ILE  34          1HG2      ILE  34   9.367  -3.255   5.318
  250   2HG2  ILE  34          2HG2      ILE  34   8.276  -3.481   3.953
  251   3HG2  ILE  34          3HG2      ILE  34   8.774  -1.856   4.423
  252   1HD1  ILE  34          1HD1      ILE  34  11.913  -0.084   4.402
  253   2HD1  ILE  34          2HD1      ILE  34  10.246  -0.545   4.749
  254   3HD1  ILE  34          3HD1      ILE  34  10.752  -0.247   3.085
  255    H    ALA  35           H        ALA  35   9.464  -4.727   1.123
  256    HA   ALA  35           HA       ALA  35   7.136  -6.003   1.975
  257   1HB   ALA  35          1HB       ALA  35   7.388  -5.022  -0.248
  258   2HB   ALA  35          2HB       ALA  35   6.866  -6.704  -0.350
  259   3HB   ALA  35          3HB       ALA  35   8.547  -6.279  -0.675
  260    H    GLY  36           H        GLY  36  10.270  -7.275   1.033
  261   1HA   GLY  36          2HA       GLY  36   9.469 -10.036   1.165
  262   2HA   GLY  36          1HA       GLY  36  11.119  -9.433   1.064
  263    H    CYS  37           H        CYS  37  10.018  -7.725   3.492
  264    HA   CYS  37           HA       CYS  37  11.053  -9.592   5.466
  265   1HB   CYS  37          2HB       CYS  37  12.175  -7.454   5.329
  266   2HB   CYS  37          1HB       CYS  37  10.650  -6.601   5.509
  267    H    GLU  38           H        GLU  38   8.425  -7.157   5.313
  268    HA   GLU  38           HA       GLU  38   7.188  -8.485   7.589
  269   1HB   GLU  38          2HB       GLU  38   6.853  -5.802   6.322
  270   2HB   GLU  38          1HB       GLU  38   5.538  -6.463   7.289
  271   1HG   GLU  38          2HG       GLU  38   7.021  -6.696   9.191
  272   2HG   GLU  38          1HG       GLU  38   8.372  -6.102   8.232
  273    H    ALA  39           H        ALA  39   6.741  -8.137   4.174
  274    HA   ALA  39           HA       ALA  39   4.004  -9.077   4.365
  275   1HB   ALA  39          1HB       ALA  39   4.412  -7.215   2.870
  276   2HB   ALA  39          2HB       ALA  39   3.845  -8.625   1.974
  277   3HB   ALA  39          3HB       ALA  39   5.557  -8.197   1.951
  278    H    GLY  40           H        GLY  40   7.101 -10.323   3.867
  279   1HA   GLY  40          2HA       GLY  40   7.747 -12.532   3.487
  280   2HA   GLY  40          1HA       GLY  40   6.057 -12.941   3.187
  281    H    GLY  41           H        GLY  41   7.080 -10.177   1.632
  282   1HA   GLY  41          2HA       GLY  41   7.740  -9.659  -0.477
  283   2HA   GLY  41          1HA       GLY  41   8.174 -11.347  -0.742
  284    H    ASN  42           H        ASN  42   5.161  -9.504  -0.130
  285    HA   ASN  42           HA       ASN  42   4.127 -10.382  -2.672
  286   1HB   ASN  42          2HB       ASN  42   3.477 -12.226  -1.105
  287   2HB   ASN  42          1HB       ASN  42   2.599 -11.022  -0.153
  288   1HD2  ASN  42          1HD2      ASN  42   0.710 -12.299  -0.597
  289   2HD2  ASN  42          2HD2      ASN  42  -0.128 -12.089  -2.105
  290    H    TRP  43           H        TRP  43   2.975  -8.844  -3.518
  291    HA   TRP  43           HA       TRP  43   2.490  -6.494  -1.846
  292   1HB   TRP  43          2HB       TRP  43   2.656  -6.772  -4.843
  293   2HB   TRP  43          1HB       TRP  43   2.508  -5.259  -3.955
  294    HD1  TRP  43           HD       TRP  43   4.956  -8.263  -4.026
  295    HE1  TRP  43           1HE      TRP  43   7.346  -7.370  -3.757
  296    HE3  TRP  43           3HE      TRP  43   3.884  -3.300  -3.518
  297    HZ2  TRP  43           2HZ      TRP  43   8.616  -4.854  -3.397
  298    HZ3  TRP  43           3HZ      TRP  43   5.730  -1.708  -3.226
  299    HH2  TRP  43           HH       TRP  43   8.051  -2.470  -3.176
  300    H    ALA  44           H        ALA  44   0.905  -9.078  -2.968
  301    HA   ALA  44           HA       ALA  44  -1.651  -7.638  -3.253
  302   1HB   ALA  44          1HB       ALA  44  -2.492  -9.584  -4.448
  303   2HB   ALA  44          2HB       ALA  44  -0.949 -10.407  -4.219
  304   3HB   ALA  44          3HB       ALA  44  -1.034  -8.958  -5.220
  305    H    ILE  45           H        ILE  45   0.021  -8.933  -0.890
  306    HA   ILE  45           HA       ILE  45  -1.729 -10.878   0.192
  307    HB   ILE  45           HB       ILE  45   0.749 -10.748   0.640
  308   1HG1  ILE  45          2HG1      ILE  45  -1.074 -10.745   3.045
  309   2HG1  ILE  45          1HG1      ILE  45  -0.765 -12.116   1.987
  310   1HG2  ILE  45          1HG2      ILE  45   1.514  -9.265   2.439
  311   2HG2  ILE  45          2HG2      ILE  45  -0.061  -8.472   2.438
  312   3HG2  ILE  45          3HG2      ILE  45   0.976  -8.374   1.015
  313   1HD1  ILE  45          1HD1      ILE  45   0.502 -12.292   4.055
  314   2HD1  ILE  45          2HD1      ILE  45   1.271 -10.739   3.723
  315   3HD1  ILE  45          3HD1      ILE  45   1.577 -12.115   2.665
  316    H    ASN  46           H        ASN  46  -3.164 -10.641   1.903
  317    HA   ASN  46           HA       ASN  46  -3.698  -7.988   2.948
  318   1HB   ASN  46          2HB       ASN  46  -4.974  -8.225   0.752
  319   2HB   ASN  46          1HB       ASN  46  -5.920  -9.482   1.543
  320   1HD2  ASN  46          1HD2      ASN  46  -5.186  -6.107   1.400
  321   2HD2  ASN  46          2HD2      ASN  46  -6.508  -5.571   2.372
  322    H    THR  47           H        THR  47  -3.049  -9.005   4.863
  323    HA   THR  47           HA       THR  47  -4.399 -11.236   5.937
  324    HB   THR  47           HB       THR  47  -3.397  -9.927   8.118
  325    HG1  THR  47           1HG      THR  47  -2.101  -8.393   7.439
  326   1HG2  THR  47          1HG2      THR  47  -2.888 -12.226   7.464
  327   2HG2  THR  47          2HG2      THR  47  -1.406 -11.339   7.813
  328   3HG2  THR  47          3HG2      THR  47  -1.880 -11.638   6.140
  329    H    GLY  48           H        GLY  48  -5.141  -7.886   5.752
  330   1HA   GLY  48          2HA       GLY  48  -7.333  -7.073   5.971
  331   2HA   GLY  48          1HA       GLY  48  -7.718  -8.458   6.986
  332    H    ASN  49           H        ASN  49  -4.806  -6.711   7.578
  333    HA   ASN  49           HA       ASN  49  -5.923  -5.988  10.174
  334   1HB   ASN  49          2HB       ASN  49  -3.588  -5.681  10.905
  335   2HB   ASN  49          1HB       ASN  49  -3.876  -7.282  10.235
  336   1HD2  ASN  49          1HD2      ASN  49  -2.244  -4.272   9.853
  337   2HD2  ASN  49          2HD2      ASN  49  -1.233  -4.751   8.533
  338    H    GLY  50           H        GLY  50  -6.079  -4.451   7.472
  339   1HA   GLY  50          2HA       GLY  50  -6.767  -2.208   7.297
  340   2HA   GLY  50          1HA       GLY  50  -5.895  -1.847   8.779
  341    H    TYR  51           H        TYR  51  -3.635  -3.472   7.490
  342    HA   TYR  51           HA       TYR  51  -2.605  -1.391   5.707
  343   1HB   TYR  51          2HB       TYR  51  -0.953  -3.529   7.080
  344   2HB   TYR  51          1HB       TYR  51  -0.376  -2.108   6.244
  345    HD1  TYR  51           1HD      TYR  51  -3.149  -1.175   8.249
  346    HD2  TYR  51           2HD      TYR  51   0.997  -2.143   8.451
  347    HE1  TYR  51           1HE      TYR  51  -2.975  -0.021  10.424
  348    HE2  TYR  51           2HE      TYR  51   1.174  -0.980  10.610
  349    HH   TYR  51           HH       TYR  51  -0.107   0.908  11.791
  350    H    TYR  52           H        TYR  52  -1.347  -2.265   3.856
  351    HA   TYR  52           HA       TYR  52  -2.773  -4.661   2.923
  352   1HB   TYR  52          2HB       TYR  52  -2.212  -2.122   1.403
  353   2HB   TYR  52          1HB       TYR  52  -2.921  -3.576   0.699
  354    HD1  TYR  52           1HD      TYR  52  -5.227  -4.023   0.938
  355    HD2  TYR  52           2HD      TYR  52  -3.426  -0.955   3.253
  356    HE1  TYR  52           1HE      TYR  52  -7.451  -3.297   1.692
  357    HE2  TYR  52           2HE      TYR  52  -5.625  -0.213   4.005
  358    HH   TYR  52           HH       TYR  52  -8.069  -0.387   3.046
  359    H    GLY  53           H        GLY  53  -1.846  -5.473   0.791
  360   1HA   GLY  53          2HA       GLY  53   0.555  -6.699   1.362
  361   2HA   GLY  53          1HA       GLY  53  -0.163  -6.616  -0.234
  362    H    GLY  54           H        GLY  54   2.550  -6.718   0.155
  363   1HA   GLY  54          2HA       GLY  54   4.252  -5.684  -1.066
  364   2HA   GLY  54          1HA       GLY  54   3.303  -4.207  -1.119
  365    H    VAL  55           H        VAL  55   3.837  -2.596   0.212
  366    HA   VAL  55           HA       VAL  55   6.142  -2.980   1.944
  367    HB   VAL  55           HB       VAL  55   4.658  -0.385   1.703
  368   1HG1  VAL  55          1HG1      VAL  55   6.817   0.587   2.050
  369   2HG1  VAL  55          2HG1      VAL  55   7.601  -0.983   1.886
  370   3HG1  VAL  55          3HG1      VAL  55   6.563  -0.658   3.272
  371   1HG2  VAL  55          1HG2      VAL  55   5.978   0.162  -0.295
  372   2HG2  VAL  55          2HG2      VAL  55   4.869  -1.178  -0.586
  373   3HG2  VAL  55          3HG2      VAL  55   6.586  -1.494  -0.336
  374    H    GLN  56           H        GLN  56   2.964  -3.396   2.246
  375    HA   GLN  56           HA       GLN  56   1.553  -3.847   3.915
  376   1HB   GLN  56          2HB       GLN  56   3.464  -5.361   4.371
  377   2HB   GLN  56          1HB       GLN  56   4.100  -4.165   5.489
  378   1HG   GLN  56          2HG       GLN  56   1.476  -4.585   6.313
  379   2HG   GLN  56          1HG       GLN  56   2.103  -6.189   5.912
  380   1HE2  GLN  56          1HE2      GLN  56   4.141  -3.601   6.816
  381   2HE2  GLN  56          2HE2      GLN  56   4.610  -4.202   8.385
  382    H    PHE  57           H        PHE  57   1.624  -1.141   3.597
  383    HA   PHE  57           HA       PHE  57   1.442  -0.359   6.405
  384   1HB   PHE  57          2HB       PHE  57   1.824   1.978   5.810
  385   2HB   PHE  57          1HB       PHE  57   3.206   0.946   5.521
  386    HD1  PHE  57           1HD      PHE  57   3.222   0.011   2.935
  387    HD2  PHE  57           2HD      PHE  57   1.470   3.637   4.321
  388    HE1  PHE  57           1HE      PHE  57   3.543   1.012   0.713
  389    HE2  PHE  57           2HE      PHE  57   1.775   4.635   2.095
  390    HZ   PHE  57           HZ       PHE  57   2.831   3.334   0.288
  391    H    ASP  58           H        ASP  58  -0.009   1.660   6.633
  392    HA   ASP  58           HA       ASP  58  -2.489   0.278   6.416
  393   1HB   ASP  58          2HB       ASP  58  -2.596   1.138   8.457
  394   2HB   ASP  58          1HB       ASP  58  -1.256   2.204   8.108
  395    H    GLN  59           H        GLN  59  -4.490   1.183   5.913
  396    HA   GLN  59           HA       GLN  59  -4.802   2.164   3.373
  397   1HB   GLN  59          2HB       GLN  59  -6.498   1.012   4.797
  398   2HB   GLN  59          1HB       GLN  59  -6.646   2.475   5.744
  399   1HG   GLN  59          2HG       GLN  59  -8.456   2.337   4.190
  400   2HG   GLN  59          1HG       GLN  59  -7.403   3.682   3.767
  401   1HE2  GLN  59          1HE2      GLN  59  -6.114   3.529   1.902
  402   2HE2  GLN  59          2HE2      GLN  59  -6.460   2.376   0.647
  403    H    GLY  60           H        GLY  60  -4.781   3.866   6.454
  404   1HA   GLY  60          2HA       GLY  60  -5.621   6.387   5.427
  405   2HA   GLY  60          1HA       GLY  60  -4.913   6.091   7.008
  406    H    THR  61           H        THR  61  -2.471   5.149   6.449
  407    HA   THR  61           HA       THR  61  -0.954   7.421   5.860
  408    HB   THR  61           HB       THR  61  -0.131   4.548   5.775
  409    HG1  THR  61           1HG      THR  61  -1.129   5.165   7.767
  410   1HG2  THR  61          1HG2      THR  61   1.493   7.054   6.201
  411   2HG2  THR  61          2HG2      THR  61   1.564   5.986   4.799
  412   3HG2  THR  61          3HG2      THR  61   2.113   5.411   6.373
  413    H    TRP  62           H        TRP  62  -1.813   4.636   3.937
  414    HA   TRP  62           HA       TRP  62  -0.440   5.255   1.574
  415   1HB   TRP  62          2HB       TRP  62  -1.421   3.078   2.026
  416   2HB   TRP  62          1HB       TRP  62  -3.025   3.798   2.106
  417    HD1  TRP  62           HD       TRP  62  -4.237   4.337  -0.185
  418    HE1  TRP  62           1HE      TRP  62  -3.814   3.565  -2.605
  419    HE3  TRP  62           3HE      TRP  62   0.472   2.468   0.390
  420    HZ2  TRP  62           2HZ      TRP  62  -1.730   2.310  -4.100
  421    HZ3  TRP  62           3HZ      TRP  62   1.613   1.500  -1.553
  422    HH2  TRP  62           HH       TRP  62   0.546   1.419  -3.745
  423    H    GLU  63           H        GLU  63  -3.726   6.002   2.676
  424    HA   GLU  63           HA       GLU  63  -4.504   7.332   0.296
  425   1HB   GLU  63          2HB       GLU  63  -6.516   7.169   1.256
  426   2HB   GLU  63          1HB       GLU  63  -5.729   6.417   2.633
  427   1HG   GLU  63          2HG       GLU  63  -6.737   8.036   3.791
  428   2HG   GLU  63          1HG       GLU  63  -5.389   9.027   3.237
  429    H    ALA  64           H        ALA  64  -3.069   8.332   3.314
  430    HA   ALA  64           HA       ALA  64  -3.538  11.115   3.099
  431   1HB   ALA  64          1HB       ALA  64  -1.333   9.720   4.608
  432   2HB   ALA  64          2HB       ALA  64  -2.969   9.983   5.211
  433   3HB   ALA  64          3HB       ALA  64  -1.919  11.360   4.879
  434    H    ASN  65           H        ASN  65  -0.778   9.090   2.181
  435    HA   ASN  65           HA       ASN  65   0.614  11.341   1.059
  436   1HB   ASN  65          2HB       ASN  65   1.179   8.374   0.989
  437   2HB   ASN  65          1HB       ASN  65   2.266   9.624   0.386
  438   1HD2  ASN  65          1HD2      ASN  65   2.470   7.647   2.618
  439   2HD2  ASN  65          2HD2      ASN  65   2.875   8.598   4.006
  440    H    GLY  66           H        GLY  66  -1.928   9.443   0.090
  441   1HA   GLY  66          2HA       GLY  66  -3.188   9.911  -1.810
  442   2HA   GLY  66          1HA       GLY  66  -1.797  10.721  -2.512
  443    H    GLY  67           H        GLY  67  -2.239   7.410  -1.287
  444   1HA   GLY  67          2HA       GLY  67  -0.872   6.371  -3.611
  445   2HA   GLY  67          1HA       GLY  67  -1.496   5.440  -2.257
  446    H    LEU  68           H        LEU  68  -4.027   7.153  -2.823
  447    HA   LEU  68           HA       LEU  68  -5.448   4.975  -3.839
  448   1HB   LEU  68          2HB       LEU  68  -6.449   7.800  -3.719
  449   2HB   LEU  68          1HB       LEU  68  -7.371   6.319  -3.541
  450    HG   LEU  68           HG       LEU  68  -5.296   7.239  -1.553
  451   1HD1  LEU  68          1HD1      LEU  68  -7.106   8.854  -1.636
  452   2HD1  LEU  68          2HD1      LEU  68  -7.191   7.907  -0.151
  453   3HD1  LEU  68          3HD1      LEU  68  -8.292   7.558  -1.484
  454   1HD2  LEU  68          1HD2      LEU  68  -5.666   4.872  -1.477
  455   2HD2  LEU  68          2HD2      LEU  68  -7.414   5.109  -1.442
  456   3HD2  LEU  68          3HD2      LEU  68  -6.425   5.629  -0.077
  457    H    ARG  69           H        ARG  69  -3.982   7.686  -5.349
  458    HA   ARG  69           HA       ARG  69  -5.395   7.621  -7.808
  459   1HB   ARG  69          2HB       ARG  69  -3.504   8.946  -8.666
  460   2HB   ARG  69          1HB       ARG  69  -4.122   9.581  -7.146
  461   1HG   ARG  69          2HG       ARG  69  -2.293   8.601  -5.938
  462   2HG   ARG  69          1HG       ARG  69  -1.712   7.804  -7.400
  463   1HD   ARG  69          2HD       ARG  69  -1.911  10.794  -7.017
  464   2HD   ARG  69          1HD       ARG  69  -0.434   9.850  -6.824
  465    HE   ARG  69           HE       ARG  69  -1.640   9.447  -9.387
  466   1HH1  ARG  69          1HH1      ARG  69   0.377  11.634  -7.535
  467   2HH1  ARG  69          2HH1      ARG  69   1.156  12.299  -8.929
  468   1HH2  ARG  69          1HH2      ARG  69  -0.612  10.302 -11.219
  469   2HH2  ARG  69          2HH2      ARG  69   0.619  11.516 -11.039
  470    H    TYR  70           H        TYR  70  -2.643   5.923  -6.479
  471    HA   TYR  70           HA       TYR  70  -1.888   4.707  -8.997
  472   1HB   TYR  70          2HB       TYR  70  -1.146   3.949  -6.161
  473   2HB   TYR  70          1HB       TYR  70  -0.290   3.476  -7.627
  474    HD1  TYR  70           1HD      TYR  70   1.007   5.216  -8.891
  475    HD2  TYR  70           2HD      TYR  70  -0.744   5.997  -5.103
  476    HE1  TYR  70           1HE      TYR  70   2.449   7.194  -8.642
  477    HE2  TYR  70           2HE      TYR  70   0.685   7.970  -4.840
  478    HH   TYR  70           HH       TYR  70   2.802   8.841  -5.668
  479    H    ALA  71           H        ALA  71  -3.704   4.176  -6.164
  480    HA   ALA  71           HA       ALA  71  -5.700   2.564  -7.056
  481   1HB   ALA  71          1HB       ALA  71  -4.021   0.827  -7.582
  482   2HB   ALA  71          2HB       ALA  71  -5.126   0.305  -6.309
  483   3HB   ALA  71          3HB       ALA  71  -3.496   0.840  -5.897
  484    HA   PRO  72           HA       PRO  72  -6.677   4.124  -3.031
  485   1HB   PRO  72          2HB       PRO  72  -8.907   2.289  -2.988
  486   2HB   PRO  72          1HB       PRO  72  -8.884   4.044  -2.973
  487   1HG   PRO  72          2HG       PRO  72  -9.611   2.477  -5.126
  488   2HG   PRO  72          1HG       PRO  72  -9.138   4.182  -5.204
  489   1HD   PRO  72          2HD       PRO  72  -7.691   1.812  -6.095
  490   2HD   PRO  72          1HD       PRO  72  -7.401   3.523  -6.466
  491    H    ARG  73           H        ARG  73  -5.686   1.011  -3.650
  492    HA   ARG  73           HA       ARG  73  -4.998   0.725  -0.856
  493   1HB   ARG  73          2HB       ARG  73  -5.784  -1.582  -0.678
  494   2HB   ARG  73          1HB       ARG  73  -7.137  -0.522  -1.062
  495   1HG   ARG  73          2HG       ARG  73  -6.717  -1.162  -3.493
  496   2HG   ARG  73          1HG       ARG  73  -5.699  -2.455  -2.845
  497   1HD   ARG  73          2HD       ARG  73  -8.578  -2.040  -2.042
  498   2HD   ARG  73          1HD       ARG  73  -8.081  -3.093  -3.367
  499    HE   ARG  73           HE       ARG  73  -6.598  -4.049  -1.366
  500   1HH1  ARG  73          1HH1      ARG  73  -9.995  -3.169  -1.457
  501   2HH1  ARG  73          2HH1      ARG  73 -10.481  -4.411  -0.343
  502   1HH2  ARG  73          1HH2      ARG  73  -7.246  -5.703   0.077
  503   2HH2  ARG  73          2HH2      ARG  73  -8.917  -5.843   0.546
  504    H    ALA  74           H        ALA  74  -3.115  -0.393  -0.575
  505    HA   ALA  74           HA       ALA  74  -1.228  -0.277  -2.597
  506   1HB   ALA  74          1HB       ALA  74  -0.820  -0.211  -0.120
  507   2HB   ALA  74          2HB       ALA  74   0.315  -1.184  -1.052
  508   3HB   ALA  74          3HB       ALA  74  -0.964  -1.967  -0.129
  509    H    ASP  75           H        ASP  75  -3.303  -2.950  -1.670
  510    HA   ASP  75           HA       ASP  75  -1.652  -4.845  -3.112
  511   1HB   ASP  75          2HB       ASP  75  -3.223  -6.549  -2.364
  512   2HB   ASP  75          1HB       ASP  75  -2.668  -5.572  -1.012
  513    H    LEU  76           H        LEU  76  -3.737  -2.599  -4.042
  514    HA   LEU  76           HA       LEU  76  -4.589  -4.155  -6.389
  515   1HB   LEU  76          2HB       LEU  76  -6.352  -2.842  -5.287
  516   2HB   LEU  76          1HB       LEU  76  -5.388  -1.388  -5.465
  517    HG   LEU  76           HG       LEU  76  -5.563  -1.601  -7.926
  518   1HD1  LEU  76          1HD1      LEU  76  -5.901  -4.012  -8.055
  519   2HD1  LEU  76          2HD1      LEU  76  -7.191  -3.142  -8.882
  520   3HD1  LEU  76          3HD1      LEU  76  -7.480  -3.837  -7.288
  521   1HD2  LEU  76          1HD2      LEU  76  -8.201  -1.533  -6.465
  522   2HD2  LEU  76          2HD2      LEU  76  -7.893  -0.895  -8.082
  523   3HD2  LEU  76          3HD2      LEU  76  -7.102  -0.172  -6.680
  524    H    ALA  77           H        ALA  77  -2.654  -1.559  -5.205
  525    HA   ALA  77           HA       ALA  77  -1.661  -0.676  -7.732
  526   1HB   ALA  77          1HB       ALA  77  -0.664  -0.179  -4.928
  527   2HB   ALA  77          2HB       ALA  77  -1.817   0.827  -5.807
  528   3HB   ALA  77          3HB       ALA  77  -0.153   0.687  -6.377
  529    H    THR  78           H        THR  78   0.720  -0.730  -8.135
  530    HA   THR  78           HA       THR  78   1.641  -3.469  -7.720
  531    HB   THR  78           HB       THR  78   3.102  -3.003  -9.675
  532    HG1  THR  78           1HG      THR  78   2.602  -1.019 -10.841
  533   1HG2  THR  78          1HG2      THR  78   1.197  -2.774 -11.317
  534   2HG2  THR  78          2HG2      THR  78   0.138  -2.498  -9.927
  535   3HG2  THR  78          3HG2      THR  78   0.991  -4.032 -10.098
  536    H    ARG  79           H        ARG  79   4.258  -3.418  -7.981
  537    HA   ARG  79           HA       ARG  79   5.255  -2.645  -5.512
  538   1HB   ARG  79          2HB       ARG  79   6.747  -3.040  -8.114
  539   2HB   ARG  79          1HB       ARG  79   7.514  -2.908  -6.539
  540   1HG   ARG  79          2HG       ARG  79   6.271  -4.919  -5.814
  541   2HG   ARG  79          1HG       ARG  79   5.632  -5.067  -7.452
  542   1HD   ARG  79          2HD       ARG  79   7.593  -6.513  -7.027
  543   2HD   ARG  79          1HD       ARG  79   7.844  -5.370  -8.345
  544    HE   ARG  79           HE       ARG  79   8.921  -4.985  -5.624
  545   1HH1  ARG  79          1HH1      ARG  79   9.163  -4.696  -9.093
  546   2HH1  ARG  79          2HH1      ARG  79  10.833  -4.233  -9.076
  547   1HH2  ARG  79          1HH2      ARG  79  11.120  -4.336  -5.575
  548   2HH2  ARG  79          2HH2      ARG  79  11.954  -4.028  -7.058
  549    H    GLU  80           H        GLU  80   5.689  -1.087  -8.634
  550    HA   GLU  80           HA       GLU  80   7.239   1.068  -7.771
  551   1HB   GLU  80          2HB       GLU  80   6.367   2.120  -9.956
  552   2HB   GLU  80          1HB       GLU  80   7.308   0.639 -10.045
  553   1HG   GLU  80          2HG       GLU  80   4.373   0.346  -9.875
  554   2HG   GLU  80          1HG       GLU  80   5.035   0.998 -11.375
  555    H    GLU  81           H        GLU  81   3.766   0.683  -7.885
  556    HA   GLU  81           HA       GLU  81   3.113   3.412  -7.377
  557   1HB   GLU  81          2HB       GLU  81   1.453   1.014  -6.609
  558   2HB   GLU  81          1HB       GLU  81   0.898   2.659  -6.846
  559   1HG   GLU  81          2HG       GLU  81   1.873   0.757  -8.939
  560   2HG   GLU  81          1HG       GLU  81   0.222   1.306  -8.664
  561    H    GLN  82           H        GLN  82   3.294   0.519  -5.334
  562    HA   GLN  82           HA       GLN  82   2.716   1.810  -2.903
  563   1HB   GLN  82          2HB       GLN  82   4.449  -0.620  -3.341
  564   2HB   GLN  82          1HB       GLN  82   3.741  -0.121  -1.812
  565   1HG   GLN  82          2HG       GLN  82   1.489  -0.351  -3.007
  566   2HG   GLN  82          1HG       GLN  82   2.393  -1.260  -4.222
  567   1HE2  GLN  82          1HE2      GLN  82   1.460  -3.224  -3.777
  568   2HE2  GLN  82          2HE2      GLN  82   1.709  -4.065  -2.280
  569    H    ILE  83           H        ILE  83   5.662   1.247  -4.668
  570    HA   ILE  83           HA       ILE  83   7.518   2.253  -2.851
  571    HB   ILE  83           HB       ILE  83   7.446   2.220  -5.863
  572   1HG1  ILE  83          2HG1      ILE  83   9.376   0.782  -4.066
  573   2HG1  ILE  83          1HG1      ILE  83   7.765   0.133  -4.344
  574   1HG2  ILE  83          1HG2      ILE  83   8.764   4.142  -5.338
  575   2HG2  ILE  83          2HG2      ILE  83   9.860   2.839  -5.799
  576   3HG2  ILE  83          3HG2      ILE  83   9.653   3.261  -4.100
  577   1HD1  ILE  83          1HD1      ILE  83   8.214   0.052  -6.741
  578   2HD1  ILE  83          2HD1      ILE  83   9.415  -0.866  -5.834
  579   3HD1  ILE  83          3HD1      ILE  83   9.820   0.729  -6.467
  580    H    ALA  84           H        ALA  84   5.631   3.925  -5.375
  581    HA   ALA  84           HA       ALA  84   6.748   6.473  -4.971
  582   1HB   ALA  84          1HB       ALA  84   5.470   5.853  -6.965
  583   2HB   ALA  84          2HB       ALA  84   4.837   7.319  -6.217
  584   3HB   ALA  84          3HB       ALA  84   3.998   5.782  -5.999
  585    H    VAL  85           H        VAL  85   3.893   4.943  -3.542
  586    HA   VAL  85           HA       VAL  85   3.073   7.200  -2.026
  587    HB   VAL  85           HB       VAL  85   2.573   4.292  -1.423
  588   1HG1  VAL  85          1HG1      VAL  85   1.972   5.773   0.410
  589   2HG1  VAL  85          2HG1      VAL  85   0.517   5.134  -0.353
  590   3HG1  VAL  85          3HG1      VAL  85   1.034   6.786  -0.689
  591   1HG2  VAL  85          1HG2      VAL  85   1.974   4.805  -3.726
  592   2HG2  VAL  85          2HG2      VAL  85   0.993   6.165  -3.178
  593   3HG2  VAL  85          3HG2      VAL  85   0.536   4.517  -2.749
  594    H    ALA  86           H        ALA  86   4.866   4.246  -1.124
  595    HA   ALA  86           HA       ALA  86   5.578   4.970   1.459
  596   1HB   ALA  86          1HB       ALA  86   7.409   3.369   1.215
  597   2HB   ALA  86          2HB       ALA  86   7.151   3.337  -0.529
  598   3HB   ALA  86          3HB       ALA  86   5.903   2.727   0.559
  599    H    GLU  87           H        GLU  87   6.808   5.985  -1.625
  600    HA   GLU  87           HA       GLU  87   9.281   7.088  -0.853
  601   1HB   GLU  87          2HB       GLU  87   7.371   7.764  -3.078
  602   2HB   GLU  87          1HB       GLU  87   8.810   8.735  -2.810
  603   1HG   GLU  87          2HG       GLU  87   8.767   5.783  -3.388
  604   2HG   GLU  87          1HG       GLU  87   9.135   7.057  -4.548
  605    H    VAL  88           H        VAL  88   6.046   8.580  -1.009
  606    HA   VAL  88           HA       VAL  88   6.828  11.067   0.080
  607    HB   VAL  88           HB       VAL  88   4.144   9.701   0.450
  608   1HG1  VAL  88          1HG1      VAL  88   4.546  11.539   2.010
  609   2HG1  VAL  88          2HG1      VAL  88   3.310  11.968   0.821
  610   3HG1  VAL  88          3HG1      VAL  88   4.947  12.606   0.661
  611   1HG2  VAL  88          1HG2      VAL  88   3.415  11.013  -1.484
  612   2HG2  VAL  88          2HG2      VAL  88   4.724   9.917  -1.924
  613   3HG2  VAL  88          3HG2      VAL  88   5.051  11.634  -1.691
  614    H    THR  89           H        THR  89   5.624   8.096   1.561
  615    HA   THR  89           HA       THR  89   5.458   9.027   4.184
  616    HB   THR  89           HB       THR  89   6.285   6.201   3.682
  617    HG1  THR  89           1HG      THR  89   4.843   6.488   1.992
  618   1HG2  THR  89          1HG2      THR  89   5.637   7.143   5.923
  619   2HG2  THR  89          2HG2      THR  89   4.717   5.733   5.406
  620   3HG2  THR  89          3HG2      THR  89   4.009   7.343   5.285
  621    H    ARG  90           H        ARG  90   8.156   7.374   2.526
  622    HA   ARG  90           HA       ARG  90   9.723   7.016   4.824
  623   1HB   ARG  90          2HB       ARG  90  11.565   6.499   3.354
  624   2HB   ARG  90          1HB       ARG  90  10.095   5.798   2.694
  625   1HG   ARG  90          2HG       ARG  90  10.026   7.279   0.924
  626   2HG   ARG  90          1HG       ARG  90  11.045   8.466   1.742
  627   1HD   ARG  90          2HD       ARG  90  12.974   7.070   1.490
  628   2HD   ARG  90          1HD       ARG  90  11.995   5.751   0.854
  629    HE   ARG  90           HE       ARG  90  11.735   6.940  -1.168
  630   1HH1  ARG  90          1HH1      ARG  90  13.860   8.577   1.112
  631   2HH1  ARG  90          2HH1      ARG  90  14.654   9.508  -0.122
  632   1HH2  ARG  90          1HH2      ARG  90  12.772   8.166  -2.769
  633   2HH2  ARG  90          2HH2      ARG  90  14.028   9.297  -2.320
  634    H    LEU  91           H        LEU  91   9.394   9.724   2.676
  635    HA   LEU  91           HA       LEU  91  11.868  10.929   3.495
  636   1HB   LEU  91          2HB       LEU  91  11.225  12.849   2.131
  637   2HB   LEU  91          1HB       LEU  91  11.114  11.340   1.256
  638    HG   LEU  91           HG       LEU  91   8.576  11.469   1.805
  639   1HD1  LEU  91          1HD1      LEU  91   7.716  13.744   2.004
  640   2HD1  LEU  91          2HD1      LEU  91   9.361  14.363   2.143
  641   3HD1  LEU  91          3HD1      LEU  91   8.702  13.315   3.400
  642   1HD2  LEU  91          1HD2      LEU  91   9.877  13.360  -0.149
  643   2HD2  LEU  91          2HD2      LEU  91   8.204  12.804  -0.207
  644   3HD2  LEU  91          3HD2      LEU  91   9.524  11.654  -0.427
  645    H    ARG  92           H        ARG  92   8.695  10.912   4.756
  646    HA   ARG  92           HA       ARG  92   8.864  13.499   6.014
  647   1HB   ARG  92          2HB       ARG  92   6.927  11.347   6.759
  648   2HB   ARG  92          1HB       ARG  92   6.731  13.088   6.882
  649   1HG   ARG  92          2HG       ARG  92   6.382  13.318   4.579
  650   2HG   ARG  92          1HG       ARG  92   6.979  11.686   4.254
  651   1HD   ARG  92          2HD       ARG  92   4.386  12.538   5.469
  652   2HD   ARG  92          1HD       ARG  92   4.682  11.426   4.130
  653    HE   ARG  92           HE       ARG  92   5.879  10.264   6.315
  654   1HH1  ARG  92          1HH1      ARG  92   2.643  11.325   5.454
  655   2HH1  ARG  92          2HH1      ARG  92   1.851  10.146   6.463
  656   1HH2  ARG  92          1HH2      ARG  92   4.823   8.733   7.669
  657   2HH2  ARG  92          2HH2      ARG  92   3.086   8.691   7.719
  658    H    GLN  93           H        GLN  93   8.800  10.113   7.050
  659    HA   GLN  93           HA       GLN  93   9.688  11.074   9.644
  660   1HB   GLN  93          2HB       GLN  93   8.669   9.248  10.693
  661   2HB   GLN  93          1HB       GLN  93   7.549   9.756   9.430
  662   1HG   GLN  93          2HG       GLN  93   9.485   7.573   8.874
  663   2HG   GLN  93          1HG       GLN  93   8.030   7.249   9.820
  664   1HE2  GLN  93          1HE2      GLN  93   8.771   6.299   7.187
  665   2HE2  GLN  93          2HE2      GLN  93   7.511   6.799   6.123
  666    H    GLY  94           H        GLY  94  10.845   9.196   6.993
  667   1HA   GLY  94          2HA       GLY  94  13.165   9.026   6.612
  668   2HA   GLY  94          1HA       GLY  94  13.448   9.313   8.324
  669    H    TRP  95           H        TRP  95  11.412   6.979   6.669
  670    HA   TRP  95           HA       TRP  95  11.275   4.745   6.686
  671   1HB   TRP  95          2HB       TRP  95  14.127   4.608   7.659
  672   2HB   TRP  95          1HB       TRP  95  13.233   3.396   6.741
  673    HD1  TRP  95           HD       TRP  95  14.956   6.801   6.264
  674    HE1  TRP  95           1HE      TRP  95  15.548   7.063   3.793
  675    HE3  TRP  95           3HE      TRP  95  12.628   2.636   4.456
  676    HZ2  TRP  95           2HZ      TRP  95  15.090   5.679   1.370
  677    HZ3  TRP  95           3HZ      TRP  95  12.750   2.179   2.044
  678    HH2  TRP  95           HH       TRP  95  13.955   3.667   0.534
  679    H    GLY  96           H        GLY  96  11.521   6.617   9.300
  680   1HA   GLY  96          2HA       GLY  96  11.952   4.778  11.419
  681   2HA   GLY  96          1HA       GLY  96  11.222   6.370  11.561
  682    H    ALA  97           H        ALA  97   9.279   5.265   9.382
  683    HA   ALA  97           HA       ALA  97   7.322   4.245  11.242
  684   1HB   ALA  97          1HB       ALA  97   5.801   4.235   9.330
  685   2HB   ALA  97          2HB       ALA  97   7.142   4.622   8.253
  686   3HB   ALA  97          3HB       ALA  97   6.628   5.786   9.474
  687    H    TRP  98           H        TRP  98   9.594   3.054   8.947
  688    HA   TRP  98           HA       TRP  98   8.523   0.327   9.209
  689   1HB   TRP  98          2HB       TRP  98  10.631   1.491   7.366
  690   2HB   TRP  98          1HB       TRP  98  10.156  -0.203   7.395
  691    HD1  TRP  98           HD       TRP  98   7.781  -0.839   6.376
  692    HE1  TRP  98           1HE      TRP  98   6.250   0.357   4.687
  693    HE3  TRP  98           3HE      TRP  98   9.819   3.885   6.608
  694    HZ2  TRP  98           2HZ      TRP  98   5.956   2.969   3.586
  695    HZ3  TRP  98           3HZ      TRP  98   8.851   5.640   5.191
  696    HH2  TRP  98           HH       TRP  98   6.963   5.185   3.728
  697    HA   PRO  99           HA       PRO  99  11.640   0.364  12.414
  698   1HB   PRO  99          2HB       PRO  99  10.433  -2.159  13.269
  699   2HB   PRO  99          1HB       PRO  99  10.558  -0.621  14.121
  700   1HG   PRO  99          2HG       PRO  99   8.213  -1.475  13.177
  701   2HG   PRO  99          1HG       PRO  99   8.678   0.240  13.131
  702   1HD   PRO  99          2HD       PRO  99   8.825  -1.794  10.921
  703   2HD   PRO  99          1HD       PRO  99   8.118  -0.158  10.888
  704    H    VAL 100           H        VAL 100  11.035  -3.069  11.994
  705    HA   VAL 100           HA       VAL 100  13.829  -3.578  12.235
  706    HB   VAL 100           HB       VAL 100  11.589  -5.505  11.602
  707   1HG1  VAL 100          1HG1      VAL 100  13.784  -6.424  11.081
  708   2HG1  VAL 100          2HG1      VAL 100  13.091  -7.221  12.494
  709   3HG1  VAL 100          3HG1      VAL 100  14.353  -6.007  12.698
  710   1HG2  VAL 100          1HG2      VAL 100  11.151  -4.321  13.675
  711   2HG2  VAL 100          2HG2      VAL 100  12.770  -4.703  14.259
  712   3HG2  VAL 100          3HG2      VAL 100  11.595  -5.995  14.011
  713    H    CYS 101           H        CYS 101  11.640  -3.212   9.611
  714    HA   CYS 101           HA       CYS 101  13.252  -4.913   7.877
  715   1HB   CYS 101          2HB       CYS 101  10.632  -3.517   7.321
  716   2HB   CYS 101          1HB       CYS 101  11.430  -4.676   6.253
  717    H    ALA 102           H        ALA 102  12.674  -1.494   8.371
  718    HA   ALA 102           HA       ALA 102  13.532  -0.659   5.792
  719   1HB   ALA 102          1HB       ALA 102  13.598   0.885   8.379
  720   2HB   ALA 102          2HB       ALA 102  12.254   0.826   7.239
  721   3HB   ALA 102          3HB       ALA 102  13.784   1.560   6.761
  722    H    ALA 103           H        ALA 103  15.235  -0.960   8.897
  723    HA   ALA 103           HA       ALA 103  17.729  -0.067   7.987
  724   1HB   ALA 103          1HB       ALA 103  18.659  -1.171   9.956
  725   2HB   ALA 103          2HB       ALA 103  17.145  -2.046  10.186
  726   3HB   ALA 103          3HB       ALA 103  17.182  -0.291  10.358
  727    H    ARG 104           H        ARG 104  16.271  -3.263   8.023
  728    HA   ARG 104           HA       ARG 104  18.452  -4.710   7.002
  729   1HB   ARG 104          2HB       ARG 104  15.707  -5.136   7.706
  730   2HB   ARG 104          1HB       ARG 104  16.023  -5.880   6.145
  731   1HG   ARG 104          2HG       ARG 104  16.325  -7.378   8.083
  732   2HG   ARG 104          1HG       ARG 104  17.747  -7.234   7.057
  733   1HD   ARG 104          2HD       ARG 104  18.318  -7.214   9.438
  734   2HD   ARG 104          1HD       ARG 104  18.762  -5.706   8.646
  735    HE   ARG 104           HE       ARG 104  16.197  -5.800  10.030
  736   1HH1  ARG 104          1HH1      ARG 104  19.531  -4.770   9.969
  737   2HH1  ARG 104          2HH1      ARG 104  19.337  -3.600  11.245
  738   1HH2  ARG 104          1HH2      ARG 104  15.923  -4.277  11.716
  739   2HH2  ARG 104          2HH2      ARG 104  17.277  -3.327  12.251
  740    H    ALA 105           H        ALA 105  15.800  -2.985   5.452
  741    HA   ALA 105           HA       ALA 105  16.351  -3.997   2.820
  742   1HB   ALA 105          1HB       ALA 105  14.117  -3.364   3.541
  743   2HB   ALA 105          2HB       ALA 105  14.628  -2.445   2.125
  744   3HB   ALA 105          3HB       ALA 105  14.647  -1.691   3.719
  745    H    GLY 106           H        GLY 106  17.474  -1.316   4.715
  746   1HA   GLY 106          2HA       GLY 106  19.572  -0.284   3.919
  747   2HA   GLY 106          1HA       GLY 106  18.845  -0.245   2.320
  748    H    ALA 107           H        ALA 107  17.826   0.741   5.564
  749    HA   ALA 107           HA       ALA 107  16.292   2.935   4.843
  750   1HB   ALA 107          1HB       ALA 107  17.812   2.509   7.416
  751   2HB   ALA 107          2HB       ALA 107  16.196   1.897   7.059
  752   3HB   ALA 107          3HB       ALA 107  16.473   3.634   7.173
  753    H    ARG 108           H        ARG 108  16.722   5.219   5.016
  754    HA   ARG 108           HA       ARG 108  19.538   5.842   4.474
  755   1HB   ARG 108          2HB       ARG 108  17.227   6.722   2.734
  756   2HB   ARG 108          1HB       ARG 108  18.932   7.068   2.470
  757   1HG   ARG 108          2HG       ARG 108  19.378   4.705   2.114
  758   2HG   ARG 108          1HG       ARG 108  17.684   4.319   2.430
  759   1HD   ARG 108          2HD       ARG 108  18.077   4.364   0.043
  760   2HD   ARG 108          1HD       ARG 108  17.051   5.728   0.493
  761    HE   ARG 108           HE       ARG 108  19.897   6.278   0.351
  762   1HH1  ARG 108          1HH1      ARG 108  16.843   6.279  -1.386
  763   2HH1  ARG 108          2HH1      ARG 108  17.339   7.531  -2.485
  764   1HH2  ARG 108          1HH2      ARG 108  20.551   7.881  -1.114
  765   2HH2  ARG 108          2HH2      ARG 108  19.450   8.425  -2.352
  Start of MODEL    9
    1   1H    ASN   1          1HT       ASN   1  27.254  -7.234 -20.375
    2   2H    ASN   1          2HT       ASN   1  28.540  -7.077 -19.293
    3   3H    ASN   1          3HT       ASN   1  26.951  -7.185 -18.708
    4    HA   ASN   1           HA       ASN   1  28.300  -9.234 -18.503
    5   1HB   ASN   1          2HB       ASN   1  26.520 -10.750 -19.332
    6   2HB   ASN   1          1HB       ASN   1  25.909  -9.424 -18.354
    7   1HD2  ASN   1          1HD2      ASN   1  24.595 -11.123 -20.365
    8   2HD2  ASN   1          2HD2      ASN   1  23.924 -10.030 -21.521
    9    H    VAL   2           H        VAL   2  30.130  -9.552 -19.466
   10    HA   VAL   2           HA       VAL   2  30.614  -9.716 -22.244
   11    HB   VAL   2           HB       VAL   2  32.168 -10.987 -19.977
   12   1HG1  VAL   2          1HG1      VAL   2  32.998 -10.403 -22.818
   13   2HG1  VAL   2          2HG1      VAL   2  32.722 -12.000 -22.123
   14   3HG1  VAL   2          3HG1      VAL   2  34.056 -11.003 -21.541
   15   1HG2  VAL   2          1HG2      VAL   2  32.535  -8.337 -21.368
   16   2HG2  VAL   2          2HG2      VAL   2  33.624  -9.020 -20.162
   17   3HG2  VAL   2          3HG2      VAL   2  31.977  -8.578 -19.713
   18    H    VAL   3           H        VAL   3  29.911 -12.167 -19.796
   19    HA   VAL   3           HA       VAL   3  29.905 -14.332 -21.611
   20    HB   VAL   3           HB       VAL   3  30.281 -14.633 -19.192
   21   1HG1  VAL   3          1HG1      VAL   3  28.725 -13.023 -18.295
   22   2HG1  VAL   3          2HG1      VAL   3  28.360 -14.623 -17.650
   23   3HG1  VAL   3          3HG1      VAL   3  27.359 -13.941 -18.931
   24   1HG2  VAL   3          1HG2      VAL   3  28.919 -16.641 -18.905
   25   2HG2  VAL   3          2HG2      VAL   3  29.579 -16.532 -20.537
   26   3HG2  VAL   3          3HG2      VAL   3  27.887 -16.132 -20.242
   27    H    VAL   4           H        VAL   4  28.233 -15.228 -22.765
   28    HA   VAL   4           HA       VAL   4  25.893 -13.611 -23.175
   29    HB   VAL   4           HB       VAL   4  26.291 -16.416 -24.186
   30   1HG1  VAL   4          1HG1      VAL   4  24.049 -15.519 -24.450
   31   2HG1  VAL   4          2HG1      VAL   4  24.843 -15.676 -26.018
   32   3HG1  VAL   4          3HG1      VAL   4  24.703 -14.091 -25.256
   33   1HG2  VAL   4          1HG2      VAL   4  28.272 -15.170 -24.793
   34   2HG2  VAL   4          2HG2      VAL   4  27.284 -13.844 -25.405
   35   3HG2  VAL   4          3HG2      VAL   4  27.265 -15.406 -26.224
   36    H    THR   5           H        THR   5  23.803 -14.101 -22.605
   37    HA   THR   5           HA       THR   5  23.600 -15.978 -20.361
   38    HB   THR   5           HB       THR   5  21.913 -14.256 -19.448
   39    HG1  THR   5           1HG      THR   5  21.703 -12.828 -21.109
   40   1HG2  THR   5          1HG2      THR   5  24.865 -13.605 -19.529
   41   2HG2  THR   5          2HG2      THR   5  24.065 -14.690 -18.392
   42   3HG2  THR   5          3HG2      THR   5  23.709 -12.963 -18.362
   43    HA   PRO   6           HA       PRO   6  19.831 -17.442 -22.389
   44   1HB   PRO   6          2HB       PRO   6  19.426 -18.897 -19.900
   45   2HB   PRO   6          1HB       PRO   6  19.724 -19.535 -21.520
   46   1HG   PRO   6          2HG       PRO   6  21.542 -19.730 -19.536
   47   2HG   PRO   6          1HG       PRO   6  22.006 -19.544 -21.238
   48   1HD   PRO   6          2HD       PRO   6  21.875 -17.470 -19.075
   49   2HD   PRO   6          1HD       PRO   6  23.137 -17.736 -20.298
   50    H    ALA   7           H        ALA   7  17.643 -17.944 -21.230
   51    HA   ALA   7           HA       ALA   7  15.732 -17.141 -20.251
   52   1HB   ALA   7          1HB       ALA   7  17.154 -17.047 -18.224
   53   2HB   ALA   7          2HB       ALA   7  15.851 -15.860 -18.264
   54   3HB   ALA   7          3HB       ALA   7  17.508 -15.365 -18.612
   55    H    HIS   8           H        HIS   8  14.786 -16.286 -21.891
   56    HA   HIS   8           HA       HIS   8  15.348 -13.726 -22.983
   57   1HB   HIS   8          2HB       HIS   8  12.709 -15.220 -23.027
   58   2HB   HIS   8          1HB       HIS   8  13.216 -13.945 -24.129
   59    HD1  HIS   8           1HD      HIS   8  12.418 -17.012 -24.842
   60    HD2  HIS   8           2HD      HIS   8  16.209 -15.314 -24.764
   61    HE1  HIS   8           1HE      HIS   8  13.874 -18.456 -26.315
   62    H    GLU   9           H        GLU   9  14.120 -14.781 -20.078
   63    HA   GLU   9           HA       GLU   9  12.158 -12.735 -19.592
   64   1HB   GLU   9          2HB       GLU   9  12.228 -13.498 -17.266
   65   2HB   GLU   9          1HB       GLU   9  12.099 -14.857 -18.374
   66   1HG   GLU   9          2HG       GLU   9  14.526 -15.222 -18.149
   67   2HG   GLU   9          1HG       GLU   9  14.582 -13.926 -16.955
   68    H    ALA  10           H        ALA  10  12.357 -10.855 -18.402
   69    HA   ALA  10           HA       ALA  10  14.977  -9.663 -18.583
   70   1HB   ALA  10          1HB       ALA  10  13.859  -7.544 -18.154
   71   2HB   ALA  10          2HB       ALA  10  12.357  -8.396 -17.788
   72   3HB   ALA  10          3HB       ALA  10  13.019  -8.438 -19.421
   73    H    VAL  11           H        VAL  11  15.318 -11.411 -16.892
   74    HA   VAL  11           HA       VAL  11  15.107 -10.335 -14.211
   75    HB   VAL  11           HB       VAL  11  16.314 -12.893 -15.192
   76   1HG1  VAL  11          1HG1      VAL  11  16.000 -11.920 -12.357
   77   2HG1  VAL  11          2HG1      VAL  11  17.524 -12.126 -13.221
   78   3HG1  VAL  11          3HG1      VAL  11  16.531 -13.530 -12.835
   79   1HG2  VAL  11          1HG2      VAL  11  14.431 -13.933 -14.010
   80   2HG2  VAL  11          2HG2      VAL  11  13.899 -12.862 -15.308
   81   3HG2  VAL  11          3HG2      VAL  11  13.809 -12.330 -13.628
   82    H    VAL  12           H        VAL  12  17.687 -11.324 -16.428
   83    HA   VAL  12           HA       VAL  12  19.680 -10.026 -15.210
   84    HB   VAL  12           HB       VAL  12  19.538 -10.603 -18.135
   85   1HG1  VAL  12          1HG1      VAL  12  21.361  -9.120 -17.460
   86   2HG1  VAL  12          2HG1      VAL  12  21.976 -10.679 -18.012
   87   3HG1  VAL  12          3HG1      VAL  12  21.902 -10.319 -16.288
   88   1HG2  VAL  12          1HG2      VAL  12  19.029 -12.627 -16.863
   89   2HG2  VAL  12          2HG2      VAL  12  20.497 -12.405 -15.911
   90   3HG2  VAL  12          3HG2      VAL  12  20.610 -12.750 -17.637
   91    H    ARG  13           H        ARG  13  18.534  -8.157 -14.725
   92    HA   ARG  13           HA       ARG  13  17.502  -6.341 -16.569
   93   1HB   ARG  13          2HB       ARG  13  17.458  -4.729 -14.720
   94   2HB   ARG  13          1HB       ARG  13  16.781  -6.287 -14.266
   95   1HG   ARG  13          2HG       ARG  13  18.767  -6.863 -13.065
   96   2HG   ARG  13          1HG       ARG  13  19.584  -5.414 -13.653
   97   1HD   ARG  13          2HD       ARG  13  18.038  -4.009 -12.432
   98   2HD   ARG  13          1HD       ARG  13  17.120  -5.422 -11.914
   99    HE   ARG  13           HE       ARG  13  19.291  -6.098 -10.767
  100   1HH1  ARG  13          1HH1      ARG  13  18.368  -2.763 -11.288
  101   2HH1  ARG  13          2HH1      ARG  13  19.215  -2.166  -9.893
  102   1HH2  ARG  13          1HH2      ARG  13  20.422  -5.321  -8.932
  103   2HH2  ARG  13          2HH2      ARG  13  20.418  -3.614  -8.576
  104    H    VAL  14           H        VAL  14  18.573  -5.459 -18.009
  105    HA   VAL  14           HA       VAL  14  20.960  -3.895 -17.386
  106    HB   VAL  14           HB       VAL  14  20.246  -4.813 -20.149
  107   1HG1  VAL  14          1HG1      VAL  14  21.814  -2.969 -19.997
  108   2HG1  VAL  14          2HG1      VAL  14  22.612  -4.411 -20.621
  109   3HG1  VAL  14          3HG1      VAL  14  22.858  -3.926 -18.943
  110   1HG2  VAL  14          1HG2      VAL  14  20.505  -6.847 -18.849
  111   2HG2  VAL  14          2HG2      VAL  14  22.055  -6.272 -18.232
  112   3HG2  VAL  14          3HG2      VAL  14  21.870  -6.642 -19.948
  113    H    GLY  15           H        GLY  15  21.057  -1.940 -18.696
  114   1HA   GLY  15          2HA       GLY  15  19.693  -0.517 -20.240
  115   2HA   GLY  15          1HA       GLY  15  18.365  -0.854 -19.144
  116    H    THR  16           H        THR  16  21.284   0.932 -19.656
  117    HA   THR  16           HA       THR  16  21.118   2.197 -17.063
  118    HB   THR  16           HB       THR  16  23.151   2.579 -19.254
  119    HG1  THR  16           1HG      THR  16  23.072   0.795 -17.027
  120   1HG2  THR  16          1HG2      THR  16  23.073   4.399 -17.663
  121   2HG2  THR  16          2HG2      THR  16  24.549   3.458 -17.449
  122   3HG2  THR  16          3HG2      THR  16  23.204   3.263 -16.325
  123    H    LYS  17           H        LYS  17  20.386   2.755 -20.335
  124    HA   LYS  17           HA       LYS  17  20.071   5.622 -20.009
  125   1HB   LYS  17          2HB       LYS  17  19.781   3.837 -22.433
  126   2HB   LYS  17          1HB       LYS  17  19.466   5.566 -22.449
  127   1HG   LYS  17          2HG       LYS  17  21.616   5.460 -23.250
  128   2HG   LYS  17          1HG       LYS  17  21.874   5.762 -21.533
  129   1HD   LYS  17          2HD       LYS  17  22.297   3.398 -21.158
  130   2HD   LYS  17          1HD       LYS  17  21.982   3.057 -22.861
  131   1HE   LYS  17          2HE       LYS  17  23.869   4.490 -23.489
  132   2HE   LYS  17          1HE       LYS  17  24.190   4.805 -21.784
  133   1HZ   LYS  17          1HZ       LYS  17  24.617   2.445 -21.470
  134   2HZ   LYS  17          2HZ       LYS  17  25.645   3.092 -22.650
  135   3HZ   LYS  17          3HZ       LYS  17  24.313   2.152 -23.110
  136    HA   PRO  18           HA       PRO  18  15.780   4.622 -19.082
  137   1HB   PRO  18          2HB       PRO  18  15.264   6.767 -17.614
  138   2HB   PRO  18          1HB       PRO  18  16.292   5.470 -16.978
  139   1HG   PRO  18          2HG       PRO  18  17.080   8.045 -18.259
  140   2HG   PRO  18          1HG       PRO  18  17.686   7.330 -16.754
  141   1HD   PRO  18          2HD       PRO  18  18.982   7.105 -19.137
  142   2HD   PRO  18          1HD       PRO  18  19.069   5.858 -17.882
  143    H    GLY  19           H        GLY  19  14.148   5.075 -20.274
  144   1HA   GLY  19          2HA       GLY  19  12.674   6.870 -21.188
  145   2HA   GLY  19          1HA       GLY  19  14.142   7.522 -21.909
  146    H    THR  20           H        THR  20  15.412   5.492 -22.926
  147    HA   THR  20           HA       THR  20  14.006   4.605 -25.188
  148    HB   THR  20           HB       THR  20  16.475   3.411 -23.897
  149    HG1  THR  20           1HG      THR  20  17.176   5.369 -24.437
  150   1HG2  THR  20          1HG2      THR  20  16.969   2.578 -26.149
  151   2HG2  THR  20          2HG2      THR  20  15.422   3.210 -26.715
  152   3HG2  THR  20          3HG2      THR  20  15.461   1.916 -25.519
  153    H    GLU  21           H        GLU  21  14.695   3.143 -22.077
  154    HA   GLU  21           HA       GLU  21  12.588   1.211 -22.469
  155   1HB   GLU  21          2HB       GLU  21  14.010  -0.478 -21.377
  156   2HB   GLU  21          1HB       GLU  21  14.695   0.096 -22.889
  157   1HG   GLU  21          2HG       GLU  21  16.042   1.719 -21.415
  158   2HG   GLU  21          1HG       GLU  21  15.620   0.614 -20.104
  159    H    VAL  22           H        VAL  22  11.790   0.444 -20.438
  160    HA   VAL  22           HA       VAL  22  11.524   2.687 -18.614
  161    HB   VAL  22           HB       VAL  22   9.997   0.081 -18.614
  162   1HG1  VAL  22          1HG1      VAL  22   9.882   1.276 -16.494
  163   2HG1  VAL  22          2HG1      VAL  22   8.330   1.340 -17.328
  164   3HG1  VAL  22          3HG1      VAL  22   9.394   2.747 -17.335
  165   1HG2  VAL  22          1HG2      VAL  22   9.742   1.253 -20.746
  166   2HG2  VAL  22          2HG2      VAL  22   9.284   2.724 -19.887
  167   3HG2  VAL  22          3HG2      VAL  22   8.246   1.300 -19.812
  168    HA   PRO  23           HA       PRO  23  14.496   0.739 -15.891
  169   1HB   PRO  23          2HB       PRO  23  13.994   3.149 -14.288
  170   2HB   PRO  23          1HB       PRO  23  15.511   2.541 -14.959
  171   1HG   PRO  23          2HG       PRO  23  14.286   4.696 -15.968
  172   2HG   PRO  23          1HG       PRO  23  15.159   3.549 -17.002
  173   1HD   PRO  23          2HD       PRO  23  12.227   3.829 -16.525
  174   2HD   PRO  23          1HD       PRO  23  13.100   3.523 -18.035
  175    HA   PRO  24           HA       PRO  24  11.983  -0.992 -12.542
  176   1HB   PRO  24          2HB       PRO  24  14.227  -1.479 -10.971
  177   2HB   PRO  24          1HB       PRO  24  13.547  -2.603 -12.152
  178   1HG   PRO  24          2HG       PRO  24  15.806  -0.664 -12.461
  179   2HG   PRO  24          1HG       PRO  24  15.674  -2.338 -13.041
  180   1HD   PRO  24          2HD       PRO  24  15.295  -0.347 -14.734
  181   2HD   PRO  24          1HD       PRO  24  14.205  -1.748 -14.754
  182    H    VAL  25           H        VAL  25  11.800  -0.562 -10.233
  183    HA   VAL  25           HA       VAL  25  11.807   2.262  -9.764
  184    HB   VAL  25           HB       VAL  25   9.928   0.951  -8.913
  185   1HG1  VAL  25          1HG1      VAL  25  10.248  -0.663  -7.078
  186   2HG1  VAL  25          2HG1      VAL  25  11.994  -0.534  -7.314
  187   3HG1  VAL  25          3HG1      VAL  25  10.972  -1.172  -8.602
  188   1HG2  VAL  25          1HG2      VAL  25  10.516   2.946  -7.687
  189   2HG2  VAL  25          2HG2      VAL  25  11.648   2.031  -6.695
  190   3HG2  VAL  25          3HG2      VAL  25   9.917   1.706  -6.587
  191    H    ILE  26           H        ILE  26  13.268   3.416  -8.782
  192    HA   ILE  26           HA       ILE  26  15.839   2.380  -8.338
  193    HB   ILE  26           HB       ILE  26  14.777   5.111  -7.638
  194   1HG1  ILE  26          2HG1      ILE  26  14.474   4.587 -10.005
  195   2HG1  ILE  26          1HG1      ILE  26  15.731   5.802  -9.799
  196   1HG2  ILE  26          1HG2      ILE  26  17.613   4.139  -7.967
  197   2HG2  ILE  26          2HG2      ILE  26  16.851   4.692  -6.474
  198   3HG2  ILE  26          3HG2      ILE  26  17.134   5.827  -7.795
  199   1HD1  ILE  26          1HD1      ILE  26  16.165   2.871 -10.326
  200   2HD1  ILE  26          2HD1      ILE  26  17.436   4.071 -10.100
  201   3HD1  ILE  26          3HD1      ILE  26  16.354   4.183 -11.488
  202    H    ASP  27           H        ASP  27  13.420   3.538  -6.045
  203    HA   ASP  27           HA       ASP  27  15.222   2.856  -3.856
  204   1HB   ASP  27          2HB       ASP  27  12.665   4.459  -3.841
  205   2HB   ASP  27          1HB       ASP  27  13.629   4.094  -2.418
  206    H    GLY  28           H        GLY  28  13.113   1.428  -5.686
  207   1HA   GLY  28          2HA       GLY  28  11.310   0.297  -3.756
  208   2HA   GLY  28          1HA       GLY  28  11.443  -0.161  -5.449
  209    H    SER  29           H        SER  29  14.477  -0.083  -4.294
  210    HA   SER  29           HA       SER  29  14.658  -2.940  -3.987
  211   1HB   SER  29          2HB       SER  29  16.735  -0.851  -3.344
  212   2HB   SER  29          1HB       SER  29  17.015  -2.568  -3.624
  213    HG   SER  29           HG       SER  29  16.319  -2.265  -5.774
  214    H    ILE  30           H        ILE  30  14.759  -0.126  -1.968
  215    HA   ILE  30           HA       ILE  30  15.137  -1.501   0.514
  216    HB   ILE  30           HB       ILE  30  13.662   1.000   0.821
  217   1HG1  ILE  30          2HG1      ILE  30  14.725   1.565  -1.359
  218   2HG1  ILE  30          1HG1      ILE  30  15.315   2.561  -0.041
  219   1HG2  ILE  30          1HG2      ILE  30  15.534   1.589   2.238
  220   2HG2  ILE  30          2HG2      ILE  30  16.435   0.195   1.643
  221   3HG2  ILE  30          3HG2      ILE  30  14.954  -0.044   2.569
  222   1HD1  ILE  30          1HD1      ILE  30  17.102   1.912  -1.551
  223   2HD1  ILE  30          2HD1      ILE  30  16.756   0.209  -1.245
  224   3HD1  ILE  30          3HD1      ILE  30  17.357   1.235   0.059
  225    H    TRP  31           H        TRP  31  12.530  -0.398  -1.465
  226    HA   TRP  31           HA       TRP  31  10.488  -0.829   0.453
  227   1HB   TRP  31          2HB       TRP  31  10.437  -0.239  -2.528
  228   2HB   TRP  31          1HB       TRP  31   8.975  -0.463  -1.551
  229    HD1  TRP  31           HD       TRP  31  10.670   2.312  -2.886
  230    HE1  TRP  31           1HE      TRP  31  10.525   4.423  -1.390
  231    HE3  TRP  31           3HE      TRP  31   9.324   0.088   1.460
  232    HZ2  TRP  31           2HZ      TRP  31   9.969   5.010   1.309
  233    HZ3  TRP  31           3HZ      TRP  31   9.009   1.466   3.469
  234    HH2  TRP  31           HH       TRP  31   9.325   3.881   3.389
  235    H    ASP  32           H        ASP  32  11.879  -2.711  -2.173
  236    HA   ASP  32           HA       ASP  32   9.942  -4.798  -1.928
  237   1HB   ASP  32          2HB       ASP  32  11.056  -4.394  -4.045
  238   2HB   ASP  32          1HB       ASP  32  12.627  -4.727  -3.312
  239    H    ALA  33           H        ALA  33  13.186  -4.155  -0.600
  240    HA   ALA  33           HA       ALA  33  13.453  -6.745   0.511
  241   1HB   ALA  33          1HB       ALA  33  15.268  -5.793   1.844
  242   2HB   ALA  33          2HB       ALA  33  14.784  -4.174   1.340
  243   3HB   ALA  33          3HB       ALA  33  15.392  -5.323   0.148
  244    H    ILE  34           H        ILE  34  12.070  -3.711   1.652
  245    HA   ILE  34           HA       ILE  34  11.389  -4.625   4.256
  246    HB   ILE  34           HB       ILE  34  10.134  -2.519   2.511
  247   1HG1  ILE  34          2HG1      ILE  34  11.967  -2.324   4.916
  248   2HG1  ILE  34          1HG1      ILE  34  12.441  -2.056   3.243
  249   1HG2  ILE  34          1HG2      ILE  34   9.008  -1.713   4.559
  250   2HG2  ILE  34          2HG2      ILE  34   9.589  -3.143   5.412
  251   3HG2  ILE  34          3HG2      ILE  34   8.460  -3.317   4.069
  252   1HD1  ILE  34          1HD1      ILE  34  10.466  -0.397   4.793
  253   2HD1  ILE  34          2HD1      ILE  34  10.981  -0.115   3.131
  254   3HD1  ILE  34          3HD1      ILE  34  12.140   0.036   4.450
  255    H    ALA  35           H        ALA  35   9.595  -4.518   1.191
  256    HA   ALA  35           HA       ALA  35   7.236  -5.730   2.066
  257   1HB   ALA  35          1HB       ALA  35   8.545  -5.952  -0.642
  258   2HB   ALA  35          2HB       ALA  35   7.465  -4.658  -0.117
  259   3HB   ALA  35          3HB       ALA  35   6.856  -6.306  -0.273
  260    H    GLY  36           H        GLY  36  10.279  -7.087   0.964
  261   1HA   GLY  36          2HA       GLY  36   9.384  -9.823   1.070
  262   2HA   GLY  36          1HA       GLY  36  11.049  -9.274   0.913
  263    H    CYS  37           H        CYS  37  10.222  -7.564   3.387
  264    HA   CYS  37           HA       CYS  37  11.313  -9.455   5.286
  265   1HB   CYS  37          2HB       CYS  37  12.327  -7.262   5.138
  266   2HB   CYS  37          1HB       CYS  37  10.777  -6.488   5.429
  267    H    GLU  38           H        GLU  38   8.581  -7.147   5.258
  268    HA   GLU  38           HA       GLU  38   7.471  -8.526   7.567
  269   1HB   GLU  38          2HB       GLU  38   6.895  -5.889   6.259
  270   2HB   GLU  38          1HB       GLU  38   5.759  -6.596   7.403
  271   1HG   GLU  38          2HG       GLU  38   7.447  -6.634   9.122
  272   2HG   GLU  38          1HG       GLU  38   8.657  -6.047   7.986
  273    H    ALA  39           H        ALA  39   6.884  -8.146   4.164
  274    HA   ALA  39           HA       ALA  39   4.290  -9.428   4.490
  275   1HB   ALA  39          1HB       ALA  39   5.426  -8.159   2.020
  276   2HB   ALA  39          2HB       ALA  39   4.320  -7.383   3.153
  277   3HB   ALA  39          3HB       ALA  39   3.787  -8.779   2.216
  278    H    GLY  40           H        GLY  40   7.458 -10.196   3.740
  279   1HA   GLY  40          2HA       GLY  40   8.357 -12.282   3.227
  280   2HA   GLY  40          1HA       GLY  40   6.723 -12.884   2.948
  281    H    GLY  41           H        GLY  41   7.148  -9.984   1.475
  282   1HA   GLY  41          2HA       GLY  41   7.680  -9.299  -0.638
  283   2HA   GLY  41          1HA       GLY  41   8.264 -10.921  -1.020
  284    H    ASN  42           H        ASN  42   5.162  -9.454  -0.042
  285    HA   ASN  42           HA       ASN  42   3.893 -10.703  -2.341
  286   1HB   ASN  42          2HB       ASN  42   3.679 -12.247  -0.357
  287   2HB   ASN  42          1HB       ASN  42   2.787 -10.967   0.461
  288   1HD2  ASN  42          1HD2      ASN  42   2.438 -11.555  -2.983
  289   2HD2  ASN  42          2HD2      ASN  42   0.823 -12.182  -2.889
  290    H    TRP  43           H        TRP  43   3.314  -8.902  -3.319
  291    HA   TRP  43           HA       TRP  43   2.635  -6.536  -1.812
  292   1HB   TRP  43          2HB       TRP  43   2.687  -7.021  -4.787
  293   2HB   TRP  43          1HB       TRP  43   2.560  -5.453  -3.996
  294    HD1  TRP  43           HD       TRP  43   5.053  -8.421  -4.147
  295    HE1  TRP  43           1HE      TRP  43   7.448  -7.462  -4.017
  296    HE3  TRP  43           3HE      TRP  43   3.932  -3.472  -3.525
  297    HZ2  TRP  43           2HZ      TRP  43   8.694  -4.955  -3.680
  298    HZ3  TRP  43           3HZ      TRP  43   5.766  -1.853  -3.326
  299    HH2  TRP  43           HH       TRP  43   8.116  -2.609  -3.419
  300    H    ALA  44           H        ALA  44   0.982  -9.170  -2.967
  301    HA   ALA  44           HA       ALA  44  -1.536  -7.674  -3.245
  302   1HB   ALA  44          1HB       ALA  44  -0.866 -10.475  -4.149
  303   2HB   ALA  44          2HB       ALA  44  -0.978  -9.046  -5.178
  304   3HB   ALA  44          3HB       ALA  44  -2.418  -9.666  -4.371
  305    H    ILE  45           H        ILE  45   0.088  -8.971  -0.843
  306    HA   ILE  45           HA       ILE  45  -1.742 -10.789   0.304
  307    HB   ILE  45           HB       ILE  45   0.795 -10.538   0.774
  308   1HG1  ILE  45          2HG1      ILE  45  -1.126 -10.874   3.075
  309   2HG1  ILE  45          1HG1      ILE  45  -0.748 -12.110   1.882
  310   1HG2  ILE  45          1HG2      ILE  45  -0.300  -8.505   2.714
  311   2HG2  ILE  45          2HG2      ILE  45   0.845  -8.207   1.405
  312   3HG2  ILE  45          3HG2      ILE  45   1.319  -9.201   2.783
  313   1HD1  ILE  45          1HD1      ILE  45   1.176 -10.882   3.844
  314   2HD1  ILE  45          2HD1      ILE  45   1.592 -12.084   2.622
  315   3HD1  ILE  45          3HD1      ILE  45   0.478 -12.500   3.927
  316    H    ASN  46           H        ASN  46  -3.213 -10.423   1.932
  317    HA   ASN  46           HA       ASN  46  -3.617  -7.762   2.986
  318   1HB   ASN  46          2HB       ASN  46  -4.782  -7.926   0.684
  319   2HB   ASN  46          1HB       ASN  46  -5.918  -9.003   1.491
  320   1HD2  ASN  46          1HD2      ASN  46  -6.065  -6.237   0.311
  321   2HD2  ASN  46          2HD2      ASN  46  -6.825  -5.290   1.549
  322    H    THR  47           H        THR  47  -3.447  -8.452   4.969
  323    HA   THR  47           HA       THR  47  -4.513 -10.903   5.928
  324    HB   THR  47           HB       THR  47  -3.873  -9.880   8.183
  325    HG1  THR  47           1HG      THR  47  -2.303  -8.013   7.603
  326   1HG2  THR  47          1HG2      THR  47  -1.782 -10.016   6.006
  327   2HG2  THR  47          2HG2      THR  47  -2.361 -11.369   6.978
  328   3HG2  THR  47          3HG2      THR  47  -1.455 -10.060   7.739
  329    H    GLY  48           H        GLY  48  -5.690  -7.682   5.621
  330   1HA   GLY  48          2HA       GLY  48  -7.955  -7.065   5.782
  331   2HA   GLY  48          1HA       GLY  48  -8.239  -8.477   6.797
  332    H    ASN  49           H        ASN  49  -5.465  -6.548   7.423
  333    HA   ASN  49           HA       ASN  49  -6.638  -5.871  10.009
  334   1HB   ASN  49          2HB       ASN  49  -3.778  -5.684   9.056
  335   2HB   ASN  49          1HB       ASN  49  -4.319  -5.268  10.676
  336   1HD2  ASN  49          1HD2      ASN  49  -2.368  -7.182  10.076
  337   2HD2  ASN  49          2HD2      ASN  49  -2.953  -8.732  10.579
  338    H    GLY  50           H        GLY  50  -6.947  -4.421   7.281
  339   1HA   GLY  50          2HA       GLY  50  -7.581  -2.226   6.850
  340   2HA   GLY  50          1HA       GLY  50  -6.903  -1.752   8.404
  341    H    TYR  51           H        TYR  51  -4.505  -3.483   7.380
  342    HA   TYR  51           HA       TYR  51  -3.291  -1.341   5.784
  343   1HB   TYR  51          2HB       TYR  51  -1.652  -3.367   7.299
  344   2HB   TYR  51          1HB       TYR  51  -1.171  -1.800   6.694
  345    HD1  TYR  51           1HD      TYR  51  -0.297  -2.391   9.272
  346    HD2  TYR  51           2HD      TYR  51  -4.137  -0.962   8.123
  347    HE1  TYR  51           1HE      TYR  51  -0.611  -1.453  11.525
  348    HE2  TYR  51           2HE      TYR  51  -4.461  -0.018  10.377
  349    HH   TYR  51           HH       TYR  51  -3.561  -0.537  12.737
  350    H    TYR  52           H        TYR  52  -1.932  -2.034   4.053
  351    HA   TYR  52           HA       TYR  52  -3.136  -4.475   2.941
  352   1HB   TYR  52          2HB       TYR  52  -2.394  -1.909   1.541
  353   2HB   TYR  52          1HB       TYR  52  -3.052  -3.341   0.744
  354    HD1  TYR  52           1HD      TYR  52  -3.796  -0.855   3.406
  355    HD2  TYR  52           2HD      TYR  52  -5.374  -3.647   0.620
  356    HE1  TYR  52           1HE      TYR  52  -6.055  -0.117   3.976
  357    HE2  TYR  52           2HE      TYR  52  -7.656  -2.910   1.167
  358    HH   TYR  52           HH       TYR  52  -8.362  -0.108   2.822
  359    H    GLY  53           H        GLY  53  -1.861  -5.205   0.881
  360   1HA   GLY  53          2HA       GLY  53   0.448  -6.343   2.052
  361   2HA   GLY  53          1HA       GLY  53  -0.129  -6.622   0.423
  362    H    GLY  54           H        GLY  54   2.315  -6.755   0.303
  363   1HA   GLY  54          2HA       GLY  54   4.103  -5.850  -0.853
  364   2HA   GLY  54          1HA       GLY  54   3.248  -4.313  -0.921
  365    H    VAL  55           H        VAL  55   3.882  -2.731   0.378
  366    HA   VAL  55           HA       VAL  55   6.031  -3.285   2.268
  367    HB   VAL  55           HB       VAL  55   4.895  -0.561   1.671
  368   1HG1  VAL  55          1HG1      VAL  55   7.701  -1.413   2.354
  369   2HG1  VAL  55          2HG1      VAL  55   6.513  -0.916   3.551
  370   3HG1  VAL  55          3HG1      VAL  55   7.051   0.226   2.321
  371   1HG2  VAL  55          1HG2      VAL  55   6.564  -0.366  -0.122
  372   2HG2  VAL  55          2HG2      VAL  55   5.380  -1.626  -0.472
  373   3HG2  VAL  55          3HG2      VAL  55   6.990  -2.064   0.097
  374    H    GLN  56           H        GLN  56   2.796  -3.387   2.338
  375    HA   GLN  56           HA       GLN  56   1.339  -3.787   4.000
  376   1HB   GLN  56          2HB       GLN  56   3.238  -5.353   4.496
  377   2HB   GLN  56          1HB       GLN  56   3.752  -4.219   5.738
  378   1HG   GLN  56          2HG       GLN  56   1.751  -4.546   6.981
  379   2HG   GLN  56          1HG       GLN  56   1.012  -5.458   5.661
  380   1HE2  GLN  56          1HE2      GLN  56   3.494  -6.841   5.068
  381   2HE2  GLN  56          2HE2      GLN  56   3.689  -8.041   6.306
  382    H    PHE  57           H        PHE  57   1.398  -1.079   3.800
  383    HA   PHE  57           HA       PHE  57   1.125  -0.447   6.647
  384   1HB   PHE  57          2HB       PHE  57   1.496   1.921   6.198
  385   2HB   PHE  57          1HB       PHE  57   2.903   0.931   5.858
  386    HD1  PHE  57           1HD      PHE  57   2.688   0.051   3.180
  387    HD2  PHE  57           2HD      PHE  57   1.373   3.734   4.843
  388    HE1  PHE  57           1HE      PHE  57   2.949   1.129   0.992
  389    HE2  PHE  57           2HE      PHE  57   1.622   4.819   2.652
  390    HZ   PHE  57           HZ       PHE  57   2.426   3.522   0.715
  391    H    ASP  58           H        ASP  58  -0.403   1.587   6.906
  392    HA   ASP  58           HA       ASP  58  -2.889   0.285   6.364
  393   1HB   ASP  58          2HB       ASP  58  -3.868   1.969   7.853
  394   2HB   ASP  58          1HB       ASP  58  -2.455   1.197   8.566
  395    H    GLN  59           H        GLN  59  -4.852   1.492   5.819
  396    HA   GLN  59           HA       GLN  59  -4.711   2.583   3.245
  397   1HB   GLN  59          2HB       GLN  59  -6.681   1.447   3.973
  398   2HB   GLN  59          1HB       GLN  59  -6.872   2.516   5.343
  399   1HG   GLN  59          2HG       GLN  59  -8.484   2.980   3.598
  400   2HG   GLN  59          1HG       GLN  59  -7.400   4.343   3.854
  401   1HE2  GLN  59          1HE2      GLN  59  -6.300   1.540   2.167
  402   2HE2  GLN  59          2HE2      GLN  59  -6.287   2.219   0.572
  403    H    GLY  60           H        GLY  60  -4.906   3.986   6.417
  404   1HA   GLY  60          2HA       GLY  60  -5.694   6.599   5.655
  405   2HA   GLY  60          1HA       GLY  60  -4.913   6.171   7.171
  406    H    THR  61           H        THR  61  -2.520   5.290   6.489
  407    HA   THR  61           HA       THR  61  -1.022   7.564   5.807
  408    HB   THR  61           HB       THR  61  -0.229   4.682   5.786
  409    HG1  THR  61           1HG      THR  61  -0.642   4.969   7.862
  410   1HG2  THR  61          1HG2      THR  61   1.399   6.014   4.593
  411   2HG2  THR  61          2HG2      THR  61   2.060   5.543   6.158
  412   3HG2  THR  61          3HG2      THR  61   1.448   7.179   5.918
  413    H    TRP  62           H        TRP  62  -1.887   4.697   3.940
  414    HA   TRP  62           HA       TRP  62  -0.522   5.238   1.575
  415   1HB   TRP  62          2HB       TRP  62  -1.637   3.121   2.054
  416   2HB   TRP  62          1HB       TRP  62  -3.199   3.932   2.066
  417    HD1  TRP  62           HD       TRP  62  -4.320   4.486  -0.247
  418    HE1  TRP  62           1HE      TRP  62  -3.877   3.648  -2.633
  419    HE3  TRP  62           3HE      TRP  62   0.290   2.413   0.477
  420    HZ2  TRP  62           2HZ      TRP  62  -1.821   2.276  -4.057
  421    HZ3  TRP  62           3HZ      TRP  62   1.436   1.361  -1.421
  422    HH2  TRP  62           HH       TRP  62   0.421   1.284  -3.638
  423    H    GLU  63           H        GLU  63  -3.760   6.105   2.608
  424    HA   GLU  63           HA       GLU  63  -4.501   7.491   0.267
  425   1HB   GLU  63          2HB       GLU  63  -6.197   6.597   1.699
  426   2HB   GLU  63          1HB       GLU  63  -5.581   7.473   3.091
  427   1HG   GLU  63          2HG       GLU  63  -6.220   9.593   1.991
  428   2HG   GLU  63          1HG       GLU  63  -6.918   8.659   0.668
  429    H    ALA  64           H        ALA  64  -2.968   8.399   3.276
  430    HA   ALA  64           HA       ALA  64  -3.256  11.199   3.076
  431   1HB   ALA  64          1HB       ALA  64  -1.083   9.634   4.465
  432   2HB   ALA  64          2HB       ALA  64  -2.653  10.047   5.156
  433   3HB   ALA  64          3HB       ALA  64  -1.504  11.323   4.753
  434    H    ASN  65           H        ASN  65  -0.664   9.002   2.035
  435    HA   ASN  65           HA       ASN  65   0.827  11.147   0.830
  436   1HB   ASN  65          2HB       ASN  65   1.186   8.169   0.454
  437   2HB   ASN  65          1HB       ASN  65   2.369   9.433   0.131
  438   1HD2  ASN  65          1HD2      ASN  65   1.706  10.929   2.561
  439   2HD2  ASN  65          2HD2      ASN  65   2.376  10.019   3.874
  440    H    GLY  66           H        GLY  66  -1.932   9.519  -0.013
  441   1HA   GLY  66          2HA       GLY  66  -3.245  10.026  -1.866
  442   2HA   GLY  66          1HA       GLY  66  -1.840  10.747  -2.640
  443    H    GLY  67           H        GLY  67  -2.506   7.489  -1.373
  444   1HA   GLY  67          2HA       GLY  67  -1.065   6.352  -3.588
  445   2HA   GLY  67          1HA       GLY  67  -1.778   5.481  -2.239
  446    H    LEU  68           H        LEU  68  -4.356   7.048  -2.895
  447    HA   LEU  68           HA       LEU  68  -5.570   4.850  -4.064
  448   1HB   LEU  68          2HB       LEU  68  -6.525   7.645  -3.605
  449   2HB   LEU  68          1HB       LEU  68  -7.563   6.408  -4.283
  450    HG   LEU  68           HG       LEU  68  -6.962   5.072  -2.157
  451   1HD1  LEU  68          1HD1      LEU  68  -5.172   6.468  -1.371
  452   2HD1  LEU  68          2HD1      LEU  68  -6.496   6.469  -0.208
  453   3HD1  LEU  68          3HD1      LEU  68  -6.259   7.853  -1.276
  454   1HD2  LEU  68          1HD2      LEU  68  -8.799   6.141  -0.927
  455   2HD2  LEU  68          2HD2      LEU  68  -9.188   5.928  -2.634
  456   3HD2  LEU  68          3HD2      LEU  68  -8.722   7.517  -2.028
  457    H    ARG  69           H        ARG  69  -4.118   7.620  -5.498
  458    HA   ARG  69           HA       ARG  69  -5.399   7.512  -8.015
  459   1HB   ARG  69          2HB       ARG  69  -3.413   8.770  -8.814
  460   2HB   ARG  69          1HB       ARG  69  -4.152   9.477  -7.381
  461   1HG   ARG  69          2HG       ARG  69  -2.444   8.622  -5.980
  462   2HG   ARG  69          1HG       ARG  69  -1.789   7.633  -7.284
  463   1HD   ARG  69          2HD       ARG  69  -1.888  10.644  -7.342
  464   2HD   ARG  69          1HD       ARG  69  -0.498   9.717  -6.777
  465    HE   ARG  69           HE       ARG  69  -1.440   9.078  -9.451
  466   1HH1  ARG  69          1HH1      ARG  69   0.822  10.906  -7.472
  467   2HH1  ARG  69          2HH1      ARG  69   1.942  11.155  -8.785
  468   1HH2  ARG  69          1HH2      ARG  69   0.044   9.413 -11.154
  469   2HH2  ARG  69          2HH2      ARG  69   1.495  10.319 -10.857
  470    H    TYR  70           H        TYR  70  -2.708   5.842  -6.552
  471    HA   TYR  70           HA       TYR  70  -1.842   4.546  -8.987
  472   1HB   TYR  70          2HB       TYR  70  -1.264   3.901  -6.086
  473   2HB   TYR  70          1HB       TYR  70  -0.332   3.354  -7.477
  474    HD1  TYR  70           1HD      TYR  70  -0.911   5.978  -5.097
  475    HD2  TYR  70           2HD      TYR  70   1.076   5.031  -8.729
  476    HE1  TYR  70           1HE      TYR  70   0.527   7.937  -4.808
  477    HE2  TYR  70           2HE      TYR  70   2.528   6.996  -8.451
  478    HH   TYR  70           HH       TYR  70   2.534   8.867  -5.499
  479    H    ALA  71           H        ALA  71  -3.779   4.084  -6.207
  480    HA   ALA  71           HA       ALA  71  -5.723   2.422  -7.066
  481   1HB   ALA  71          1HB       ALA  71  -5.119   0.181  -6.290
  482   2HB   ALA  71          2HB       ALA  71  -3.496   0.741  -5.891
  483   3HB   ALA  71          3HB       ALA  71  -4.026   0.700  -7.573
  484    HA   PRO  72           HA       PRO  72  -6.723   3.953  -3.043
  485   1HB   PRO  72          2HB       PRO  72  -8.916   2.066  -3.006
  486   2HB   PRO  72          1HB       PRO  72  -8.936   3.821  -2.974
  487   1HG   PRO  72          2HG       PRO  72  -9.672   2.311  -5.134
  488   2HG   PRO  72          1HG       PRO  72  -9.121   3.990  -5.218
  489   1HD   PRO  72          2HD       PRO  72  -7.735   1.518  -6.001
  490   2HD   PRO  72          1HD       PRO  72  -7.453   3.193  -6.517
  491    H    ARG  73           H        ARG  73  -5.705   0.862  -3.701
  492    HA   ARG  73           HA       ARG  73  -5.160   0.394  -0.883
  493   1HB   ARG  73          2HB       ARG  73  -5.991  -1.877  -0.905
  494   2HB   ARG  73          1HB       ARG  73  -7.296  -0.811  -1.415
  495   1HG   ARG  73          2HG       ARG  73  -6.546  -1.340  -3.792
  496   2HG   ARG  73          1HG       ARG  73  -5.621  -2.649  -3.062
  497   1HD   ARG  73          2HD       ARG  73  -8.590  -2.283  -2.695
  498   2HD   ARG  73          1HD       ARG  73  -7.873  -3.295  -3.945
  499    HE   ARG  73           HE       ARG  73  -6.754  -4.220  -1.643
  500   1HH1  ARG  73          1HH1      ARG  73 -10.033  -3.676  -2.752
  501   2HH1  ARG  73          2HH1      ARG  73 -10.707  -5.010  -1.864
  502   1HH2  ARG  73          1HH2      ARG  73  -7.633  -6.013  -0.499
  503   2HH2  ARG  73          2HH2      ARG  73  -9.339  -6.333  -0.570
  504    H    ALA  74           H        ALA  74  -3.219  -0.514  -0.586
  505    HA   ALA  74           HA       ALA  74  -1.276  -0.427  -2.547
  506   1HB   ALA  74          1HB       ALA  74  -1.117  -2.024  -0.003
  507   2HB   ALA  74          2HB       ALA  74  -0.877  -0.280  -0.104
  508   3HB   ALA  74          3HB       ALA  74   0.225  -1.372  -0.943
  509    H    ASP  75           H        ASP  75  -3.365  -3.093  -1.661
  510    HA   ASP  75           HA       ASP  75  -1.638  -4.999  -2.999
  511   1HB   ASP  75          2HB       ASP  75  -3.169  -6.711  -2.243
  512   2HB   ASP  75          1HB       ASP  75  -2.750  -5.658  -0.899
  513    H    LEU  76           H        LEU  76  -3.588  -2.763  -4.100
  514    HA   LEU  76           HA       LEU  76  -4.397  -4.388  -6.418
  515   1HB   LEU  76          2HB       LEU  76  -6.210  -3.072  -5.382
  516   2HB   LEU  76          1HB       LEU  76  -5.273  -1.608  -5.610
  517    HG   LEU  76           HG       LEU  76  -5.406  -1.950  -8.066
  518   1HD1  LEU  76          1HD1      LEU  76  -5.729  -4.366  -8.082
  519   2HD1  LEU  76          2HD1      LEU  76  -7.026  -3.547  -8.951
  520   3HD1  LEU  76          3HD1      LEU  76  -7.310  -4.166  -7.326
  521   1HD2  LEU  76          1HD2      LEU  76  -8.055  -1.834  -6.629
  522   2HD2  LEU  76          2HD2      LEU  76  -7.740  -1.268  -8.270
  523   3HD2  LEU  76          3HD2      LEU  76  -6.963  -0.473  -6.900
  524    H    ALA  77           H        ALA  77  -2.602  -1.648  -5.255
  525    HA   ALA  77           HA       ALA  77  -1.570  -0.847  -7.793
  526   1HB   ALA  77          1HB       ALA  77  -0.175   0.659  -6.474
  527   2HB   ALA  77          2HB       ALA  77  -0.672  -0.163  -4.994
  528   3HB   ALA  77          3HB       ALA  77  -1.856   0.734  -5.946
  529    H    THR  78           H        THR  78   0.806  -0.786  -8.132
  530    HA   THR  78           HA       THR  78   1.832  -3.486  -7.695
  531    HB   THR  78           HB       THR  78   3.225  -3.045  -9.651
  532    HG1  THR  78           1HG      THR  78   2.079  -0.671 -10.385
  533   1HG2  THR  78          1HG2      THR  78   1.024  -3.895 -10.111
  534   2HG2  THR  78          2HG2      THR  78   1.387  -2.657 -11.316
  535   3HG2  THR  78          3HG2      THR  78   0.319  -2.286  -9.957
  536    H    ARG  79           H        ARG  79   4.481  -3.261  -8.012
  537    HA   ARG  79           HA       ARG  79   5.508  -2.403  -5.582
  538   1HB   ARG  79          2HB       ARG  79   6.828  -2.751  -8.265
  539   2HB   ARG  79          1HB       ARG  79   7.730  -2.367  -6.807
  540   1HG   ARG  79          2HG       ARG  79   6.769  -4.448  -5.797
  541   2HG   ARG  79          1HG       ARG  79   6.156  -4.843  -7.408
  542   1HD   ARG  79          2HD       ARG  79   8.226  -5.239  -8.246
  543   2HD   ARG  79          1HD       ARG  79   9.002  -4.077  -7.174
  544    HE   ARG  79           HE       ARG  79   8.911  -5.713  -5.421
  545   1HH1  ARG  79          1HH1      ARG  79   8.089  -6.845  -8.630
  546   2HH1  ARG  79          2HH1      ARG  79   8.524  -8.498  -8.319
  547   1HH2  ARG  79          1HH2      ARG  79   9.550  -7.885  -5.002
  548   2HH2  ARG  79          2HH2      ARG  79   9.362  -9.100  -6.249
  549    H    GLU  80           H        GLU  80   5.802  -0.855  -8.731
  550    HA   GLU  80           HA       GLU  80   7.189   1.407  -7.892
  551   1HB   GLU  80          2HB       GLU  80   6.147   2.381 -10.072
  552   2HB   GLU  80          1HB       GLU  80   7.272   1.034 -10.160
  553   1HG   GLU  80          2HG       GLU  80   4.394   0.376  -9.969
  554   2HG   GLU  80          1HG       GLU  80   4.971   1.076 -11.481
  555    H    GLU  81           H        GLU  81   3.736   0.880  -8.273
  556    HA   GLU  81           HA       GLU  81   2.818   3.423  -7.567
  557   1HB   GLU  81          2HB       GLU  81   1.730   0.664  -7.556
  558   2HB   GLU  81          1HB       GLU  81   0.842   1.902  -6.686
  559   1HG   GLU  81          2HG       GLU  81   0.003   1.559  -8.918
  560   2HG   GLU  81          1HG       GLU  81   0.596   3.194  -8.693
  561    H    GLN  82           H        GLN  82   3.197   0.511  -5.529
  562    HA   GLN  82           HA       GLN  82   2.361   1.699  -3.124
  563   1HB   GLN  82          2HB       GLN  82   4.284  -0.585  -3.576
  564   2HB   GLN  82          1HB       GLN  82   3.650  -0.126  -2.006
  565   1HG   GLN  82          2HG       GLN  82   1.343  -0.524  -3.056
  566   2HG   GLN  82          1HG       GLN  82   2.236  -1.385  -4.314
  567   1HE2  GLN  82          1HE2      GLN  82   1.516  -3.418  -3.803
  568   2HE2  GLN  82          2HE2      GLN  82   1.900  -4.214  -2.310
  569    H    ILE  83           H        ILE  83   5.474   1.323  -4.618
  570    HA   ILE  83           HA       ILE  83   7.097   2.246  -2.556
  571    HB   ILE  83           HB       ILE  83   7.383   2.055  -5.527
  572   1HG1  ILE  83          2HG1      ILE  83   9.185   0.840  -3.478
  573   2HG1  ILE  83          1HG1      ILE  83   7.566   0.183  -3.678
  574   1HG2  ILE  83          1HG2      ILE  83   9.780   2.725  -5.251
  575   2HG2  ILE  83          2HG2      ILE  83   9.353   3.342  -3.654
  576   3HG2  ILE  83          3HG2      ILE  83   8.615   4.039  -5.093
  577   1HD1  ILE  83          1HD1      ILE  83   8.045  -0.240  -6.031
  578   2HD1  ILE  83          2HD1      ILE  83   9.183  -1.062  -4.962
  579   3HD1  ILE  83          3HD1      ILE  83   9.670   0.407  -5.809
  580    H    ALA  84           H        ALA  84   5.380   3.940  -5.110
  581    HA   ALA  84           HA       ALA  84   6.580   6.465  -4.733
  582   1HB   ALA  84          1HB       ALA  84   3.804   5.846  -5.738
  583   2HB   ALA  84          2HB       ALA  84   5.268   5.854  -6.721
  584   3HB   ALA  84          3HB       ALA  84   4.694   7.349  -5.982
  585    H    VAL  85           H        VAL  85   3.723   4.950  -3.319
  586    HA   VAL  85           HA       VAL  85   2.877   7.204  -1.808
  587    HB   VAL  85           HB       VAL  85   2.361   4.283  -1.300
  588   1HG1  VAL  85          1HG1      VAL  85   0.817   6.751  -0.494
  589   2HG1  VAL  85          2HG1      VAL  85   1.730   5.689   0.578
  590   3HG1  VAL  85          3HG1      VAL  85   0.286   5.088  -0.236
  591   1HG2  VAL  85          1HG2      VAL  85   0.828   6.222  -3.024
  592   2HG2  VAL  85          2HG2      VAL  85   0.334   4.573  -2.639
  593   3HG2  VAL  85          3HG2      VAL  85   1.793   4.858  -3.589
  594    H    ALA  86           H        ALA  86   4.601   4.217  -0.867
  595    HA   ALA  86           HA       ALA  86   4.980   4.930   1.823
  596   1HB   ALA  86          1HB       ALA  86   6.580   3.095   1.886
  597   2HB   ALA  86          2HB       ALA  86   6.586   3.030   0.123
  598   3HB   ALA  86          3HB       ALA  86   5.119   2.629   1.016
  599    H    GLU  87           H        GLU  87   6.748   5.607  -1.079
  600    HA   GLU  87           HA       GLU  87   9.126   6.411   0.285
  601   1HB   GLU  87          2HB       GLU  87  10.091   6.835  -1.751
  602   2HB   GLU  87          1HB       GLU  87   8.894   5.620  -2.164
  603   1HG   GLU  87          2HG       GLU  87   8.408   6.981  -3.818
  604   2HG   GLU  87          1HG       GLU  87   7.504   7.895  -2.608
  605    H    VAL  88           H        VAL  88   6.195   8.092  -0.701
  606    HA   VAL  88           HA       VAL  88   7.042  10.688  -0.001
  607    HB   VAL  88           HB       VAL  88   4.295   9.446   0.393
  608   1HG1  VAL  88          1HG1      VAL  88   3.474  11.720   0.606
  609   2HG1  VAL  88          2HG1      VAL  88   5.111  12.351   0.429
  610   3HG1  VAL  88          3HG1      VAL  88   4.684  11.395   1.852
  611   1HG2  VAL  88          1HG2      VAL  88   5.392  11.215  -1.797
  612   2HG2  VAL  88          2HG2      VAL  88   3.720  10.675  -1.650
  613   3HG2  VAL  88          3HG2      VAL  88   5.002   9.502  -1.945
  614    H    THR  89           H        THR  89   5.704   8.030   1.905
  615    HA   THR  89           HA       THR  89   5.593   9.412   4.347
  616    HB   THR  89           HB       THR  89   6.080   6.598   4.710
  617    HG1  THR  89           1HG      THR  89   3.883   7.136   2.997
  618   1HG2  THR  89          1HG2      THR  89   3.599   8.280   4.926
  619   2HG2  THR  89          2HG2      THR  89   4.824   8.095   6.180
  620   3HG2  THR  89          3HG2      THR  89   3.862   6.703   5.673
  621    H    ARG  90           H        ARG  90   8.052   7.291   2.953
  622    HA   ARG  90           HA       ARG  90   9.707   7.035   5.190
  623   1HB   ARG  90          2HB       ARG  90  11.406   6.264   3.682
  624   2HB   ARG  90          1HB       ARG  90   9.857   5.719   3.049
  625   1HG   ARG  90          2HG       ARG  90   9.855   7.302   1.340
  626   2HG   ARG  90          1HG       ARG  90  11.099   8.276   2.116
  627   1HD   ARG  90          2HD       ARG  90  12.767   6.604   1.609
  628   2HD   ARG  90          1HD       ARG  90  11.531   5.540   0.931
  629    HE   ARG  90           HE       ARG  90  11.207   7.775  -0.520
  630   1HH1  ARG  90          1HH1      ARG  90  14.106   5.956   0.253
  631   2HH1  ARG  90          2HH1      ARG  90  14.883   6.337  -1.253
  632   1HH2  ARG  90          1HH2      ARG  90  12.222   8.291  -2.460
  633   2HH2  ARG  90          2HH2      ARG  90  13.827   7.688  -2.781
  634    H    LEU  91           H        LEU  91   9.411   9.609   2.852
  635    HA   LEU  91           HA       LEU  91  12.068  10.603   3.345
  636   1HB   LEU  91          2HB       LEU  91  11.549  12.416   1.804
  637   2HB   LEU  91          1HB       LEU  91  11.161  10.856   1.123
  638    HG   LEU  91           HG       LEU  91   8.722  11.411   1.870
  639   1HD1  LEU  91          1HD1      LEU  91   9.230  13.388   3.178
  640   2HD1  LEU  91          2HD1      LEU  91   8.223  13.809   1.793
  641   3HD1  LEU  91          3HD1      LEU  91   9.951  14.164   1.767
  642   1HD2  LEU  91          1HD2      LEU  91   9.475  11.168  -0.432
  643   2HD2  LEU  91          2HD2      LEU  91  10.052  12.835  -0.429
  644   3HD2  LEU  91          3HD2      LEU  91   8.328  12.497  -0.270
  645    H    ARG  92           H        ARG  92   8.992  11.094   4.712
  646    HA   ARG  92           HA       ARG  92   9.616  13.673   5.858
  647   1HB   ARG  92          2HB       ARG  92   7.318  11.962   6.702
  648   2HB   ARG  92          1HB       ARG  92   7.421  13.714   6.634
  649   1HG   ARG  92          2HG       ARG  92   6.981  13.787   4.381
  650   2HG   ARG  92          1HG       ARG  92   7.552  12.137   4.109
  651   1HD   ARG  92          2HD       ARG  92   4.941  13.085   5.205
  652   2HD   ARG  92          1HD       ARG  92   5.265  11.882   3.952
  653    HE   ARG  92           HE       ARG  92   6.349  10.774   6.170
  654   1HH1  ARG  92          1HH1      ARG  92   3.151  12.013   5.381
  655   2HH1  ARG  92          2HH1      ARG  92   2.349  11.014   6.560
  656   1HH2  ARG  92          1HH2      ARG  92   5.274   9.521   7.751
  657   2HH2  ARG  92          2HH2      ARG  92   3.550   9.600   7.892
  658    H    GLN  93           H        GLN  93   9.217  10.326   6.846
  659    HA   GLN  93           HA       GLN  93   9.728  11.084   9.610
  660   1HB   GLN  93          2HB       GLN  93   8.825   8.883  10.176
  661   2HB   GLN  93          1HB       GLN  93   7.725   9.789   9.138
  662   1HG   GLN  93          2HG       GLN  93   8.745   8.537   7.195
  663   2HG   GLN  93          1HG       GLN  93   9.493   7.485   8.396
  664   1HE2  GLN  93          1HE2      GLN  93   7.493   6.968   6.320
  665   2HE2  GLN  93          2HE2      GLN  93   6.136   6.261   7.150
  666    H    GLY  94           H        GLY  94  11.124   9.102   7.052
  667   1HA   GLY  94          2HA       GLY  94  13.425   8.614   6.886
  668   2HA   GLY  94          1HA       GLY  94  13.607   9.035   8.589
  669    H    TRP  95           H        TRP  95  11.384   6.818   6.995
  670    HA   TRP  95           HA       TRP  95  10.954   4.624   7.219
  671   1HB   TRP  95          2HB       TRP  95  13.777   4.083   8.071
  672   2HB   TRP  95          1HB       TRP  95  12.731   3.126   7.022
  673    HD1  TRP  95           HD       TRP  95  14.722   6.429   6.908
  674    HE1  TRP  95           1HE      TRP  95  15.469   6.835   4.505
  675    HE3  TRP  95           3HE      TRP  95  12.394   2.471   4.672
  676    HZ2  TRP  95           2HZ      TRP  95  15.189   5.626   2.018
  677    HZ3  TRP  95           3HZ      TRP  95  12.695   2.171   2.246
  678    HH2  TRP  95           HH       TRP  95  14.058   3.723   0.938
  679    H    GLY  96           H        GLY  96  10.846   6.469   9.511
  680   1HA   GLY  96          2HA       GLY  96  11.433   5.023  11.875
  681   2HA   GLY  96          1HA       GLY  96  10.342   6.395  11.747
  682    H    ALA  97           H        ALA  97   8.660   5.094   9.738
  683    HA   ALA  97           HA       ALA  97   7.000   3.556  11.509
  684   1HB   ALA  97          1HB       ALA  97   5.432   3.459   9.656
  685   2HB   ALA  97          2HB       ALA  97   6.656   4.116   8.569
  686   3HB   ALA  97          3HB       ALA  97   6.020   5.108   9.882
  687    H    TRP  98           H        TRP  98   9.348   2.912   9.029
  688    HA   TRP  98           HA       TRP  98   8.655   0.058   9.110
  689   1HB   TRP  98          2HB       TRP  98  10.541   1.607   7.313
  690   2HB   TRP  98          1HB       TRP  98  10.264  -0.129   7.215
  691    HD1  TRP  98           HD       TRP  98   7.837  -0.936   6.366
  692    HE1  TRP  98           1HE      TRP  98   6.118   0.205   4.822
  693    HE3  TRP  98           3HE      TRP  98   9.568   3.908   6.631
  694    HZ2  TRP  98           2HZ      TRP  98   5.584   2.814   3.822
  695    HZ3  TRP  98           3HZ      TRP  98   8.404   5.635   5.348
  696    HH2  TRP  98           HH       TRP  98   6.452   5.100   3.983
  697    HA   PRO  99           HA       PRO  99  11.831   0.206  12.255
  698   1HB   PRO  99          2HB       PRO  99  10.905  -2.528  12.856
  699   2HB   PRO  99          1HB       PRO  99  10.968  -1.102  13.887
  700   1HG   PRO  99          2HG       PRO  99   8.642  -1.992  12.973
  701   2HG   PRO  99          1HG       PRO  99   8.993  -0.249  13.046
  702   1HD   PRO  99          2HD       PRO  99   9.187  -2.092  10.669
  703   2HD   PRO  99          1HD       PRO  99   8.348  -0.526  10.799
  704    H    VAL 100           H        VAL 100  11.949  -3.246  11.936
  705    HA   VAL 100           HA       VAL 100  14.778  -3.088  11.693
  706    HB   VAL 100           HB       VAL 100  13.006  -5.530  11.449
  707   1HG1  VAL 100          1HG1      VAL 100  15.921  -5.271  12.180
  708   2HG1  VAL 100          2HG1      VAL 100  15.274  -5.927  10.676
  709   3HG1  VAL 100          3HG1      VAL 100  14.985  -6.765  12.201
  710   1HG2  VAL 100          1HG2      VAL 100  12.528  -4.385  13.529
  711   2HG2  VAL 100          2HG2      VAL 100  14.249  -4.304  13.910
  712   3HG2  VAL 100          3HG2      VAL 100  13.430  -5.867  13.848
  713    H    CYS 101           H        CYS 101  12.156  -3.424   9.513
  714    HA   CYS 101           HA       CYS 101  13.567  -4.909   7.522
  715   1HB   CYS 101          2HB       CYS 101  10.963  -3.387   7.334
  716   2HB   CYS 101          1HB       CYS 101  11.578  -4.517   6.126
  717    H    ALA 102           H        ALA 102  13.015  -1.502   8.121
  718    HA   ALA 102           HA       ALA 102  13.813  -0.612   5.538
  719   1HB   ALA 102          1HB       ALA 102  13.971   1.598   6.558
  720   2HB   ALA 102          2HB       ALA 102  13.809   0.876   8.159
  721   3HB   ALA 102          3HB       ALA 102  12.472   0.788   7.011
  722    H    ALA 103           H        ALA 103  15.508  -0.900   8.647
  723    HA   ALA 103           HA       ALA 103  17.978   0.105   7.767
  724   1HB   ALA 103          1HB       ALA 103  17.409  -0.156  10.135
  725   2HB   ALA 103          2HB       ALA 103  18.931  -0.955   9.744
  726   3HB   ALA 103          3HB       ALA 103  17.463  -1.909   9.953
  727    H    ARG 104           H        ARG 104  16.600  -3.117   7.712
  728    HA   ARG 104           HA       ARG 104  18.934  -4.441   6.767
  729   1HB   ARG 104          2HB       ARG 104  16.092  -5.110   7.241
  730   2HB   ARG 104          1HB       ARG 104  16.918  -6.085   6.033
  731   1HG   ARG 104          2HG       ARG 104  16.990  -7.142   8.204
  732   2HG   ARG 104          1HG       ARG 104  18.608  -6.701   7.670
  733   1HD   ARG 104          2HD       ARG 104  17.005  -4.940   9.494
  734   2HD   ARG 104          1HD       ARG 104  17.978  -6.270  10.113
  735    HE   ARG 104           HE       ARG 104  18.995  -3.858   8.778
  736   1HH1  ARG 104          1HH1      ARG 104  19.561  -6.797  10.573
  737   2HH1  ARG 104          2HH1      ARG 104  21.184  -6.373  11.028
  738   1HH2  ARG 104          1HH2      ARG 104  21.129  -3.261   9.389
  739   2HH2  ARG 104          2HH2      ARG 104  22.073  -4.356  10.362
  740    H    ALA 105           H        ALA 105  16.286  -2.773   5.245
  741    HA   ALA 105           HA       ALA 105  16.735  -3.885   2.615
  742   1HB   ALA 105          1HB       ALA 105  14.507  -3.279   3.343
  743   2HB   ALA 105          2HB       ALA 105  14.983  -2.337   1.929
  744   3HB   ALA 105          3HB       ALA 105  15.009  -1.599   3.532
  745    H    GLY 106           H        GLY 106  17.920  -1.202   4.441
  746   1HA   GLY 106          2HA       GLY 106  19.919  -0.061   3.652
  747   2HA   GLY 106          1HA       GLY 106  19.259  -0.158   2.025
  748    H    ALA 107           H        ALA 107  18.289   1.100   5.214
  749    HA   ALA 107           HA       ALA 107  16.494   3.010   4.185
  750   1HB   ALA 107          1HB       ALA 107  17.814   2.877   6.892
  751   2HB   ALA 107          2HB       ALA 107  16.295   2.104   6.442
  752   3HB   ALA 107          3HB       ALA 107  16.414   3.863   6.468
  753    H    ARG 108           H        ARG 108  16.663   5.277   4.178
  754    HA   ARG 108           HA       ARG 108  17.633   7.299   3.855
  755   1HB   ARG 108          2HB       ARG 108  20.117   6.242   5.185
  756   2HB   ARG 108          1HB       ARG 108  19.492   7.888   5.187
  757   1HG   ARG 108          2HG       ARG 108  17.866   5.695   6.372
  758   2HG   ARG 108          1HG       ARG 108  19.225   6.373   7.291
  759   1HD   ARG 108          2HD       ARG 108  18.211   8.648   6.887
  760   2HD   ARG 108          1HD       ARG 108  16.796   7.816   6.243
  761    HE   ARG 108           HE       ARG 108  17.315   6.734   8.752
  762   1HH1  ARG 108          1HH1      ARG 108  16.410   9.838   7.394
  763   2HH1  ARG 108          2HH1      ARG 108  15.548  10.348   8.821
  764   1HH2  ARG 108          1HH2      ARG 108  16.200   7.390  10.606
  765   2HH2  ARG 108          2HH2      ARG 108  15.408   8.938  10.650
  Start of MODEL   10
    1   1H    ASN   1          1HT       ASN   1   8.056  -9.381  11.573
    2   2H    ASN   1          2HT       ASN   1   6.911  -8.247  12.088
    3   3H    ASN   1          3HT       ASN   1   6.621  -9.157  10.689
    4    HA   ASN   1           HA       ASN   1   6.717 -10.124  13.482
    5   1HB   ASN   1          2HB       ASN   1   4.533 -10.134  11.383
    6   2HB   ASN   1          1HB       ASN   1   4.404 -10.865  12.979
    7   1HD2  ASN   1          1HD2      ASN   1   2.872  -8.707  11.690
    8   2HD2  ASN   1          2HD2      ASN   1   2.982  -7.361  12.779
    9    H    VAL   2           H        VAL   2   7.162 -12.218  13.792
   10    HA   VAL   2           HA       VAL   2   8.039 -13.794  11.535
   11    HB   VAL   2           HB       VAL   2   7.897 -14.723  14.399
   12   1HG1  VAL   2          1HG1      VAL   2   9.775 -16.155  13.743
   13   2HG1  VAL   2          2HG1      VAL   2   9.688 -15.512  12.101
   14   3HG1  VAL   2          3HG1      VAL   2   8.347 -16.458  12.754
   15   1HG2  VAL   2          1HG2      VAL   2  10.202 -13.937  14.677
   16   2HG2  VAL   2          2HG2      VAL   2   9.079 -12.607  14.395
   17   3HG2  VAL   2          3HG2      VAL   2  10.125 -13.170  13.090
   18    H    VAL   3           H        VAL   3   5.499 -13.381  11.086
   19    HA   VAL   3           HA       VAL   3   3.883 -15.516  12.075
   20    HB   VAL   3           HB       VAL   3   2.909 -13.306  11.684
   21   1HG1  VAL   3          1HG1      VAL   3   2.529 -12.472   9.428
   22   2HG1  VAL   3          2HG1      VAL   3   3.451 -13.823   8.769
   23   3HG1  VAL   3          3HG1      VAL   3   4.251 -12.618   9.779
   24   1HG2  VAL   3          1HG2      VAL   3   0.909 -14.019  10.467
   25   2HG2  VAL   3          2HG2      VAL   3   1.455 -15.258  11.598
   26   3HG2  VAL   3          3HG2      VAL   3   1.777 -15.434   9.871
   27    H    VAL   4           H        VAL   4   3.306 -17.353  10.986
   28    HA   VAL   4           HA       VAL   4   4.651 -17.865   8.438
   29    HB   VAL   4           HB       VAL   4   2.957 -19.828   9.958
   30   1HG1  VAL   4          1HG1      VAL   4   3.493 -20.434   7.680
   31   2HG1  VAL   4          2HG1      VAL   4   4.356 -21.483   8.808
   32   3HG1  VAL   4          3HG1      VAL   4   5.208 -20.172   7.994
   33   1HG2  VAL   4          1HG2      VAL   4   4.995 -20.666  11.033
   34   2HG2  VAL   4          2HG2      VAL   4   4.643 -19.007  11.514
   35   3HG2  VAL   4          3HG2      VAL   4   5.906 -19.332  10.328
   36    H    THR   5           H        THR   5   3.507 -18.335   6.585
   37    HA   THR   5           HA       THR   5   0.675 -17.582   6.652
   38    HB   THR   5           HB       THR   5   1.198 -16.542   4.338
   39    HG1  THR   5           1HG      THR   5   3.595 -15.661   4.931
   40   1HG2  THR   5          1HG2      THR   5   2.230 -15.200   6.839
   41   2HG2  THR   5          2HG2      THR   5   0.538 -15.272   6.348
   42   3HG2  THR   5          3HG2      THR   5   1.707 -14.396   5.359
   43    HA   PRO   6           HA       PRO   6   0.181 -21.186   3.998
   44   1HB   PRO   6          2HB       PRO   6  -2.567 -20.320   3.663
   45   2HB   PRO   6          1HB       PRO   6  -1.957 -21.732   4.528
   46   1HG   PRO   6          2HG       PRO   6  -3.110 -19.627   5.782
   47   2HG   PRO   6          1HG       PRO   6  -1.846 -20.622   6.530
   48   1HD   PRO   6          2HD       PRO   6  -1.594 -17.958   5.169
   49   2HD   PRO   6          1HD       PRO   6  -0.874 -18.506   6.701
   50    H    ALA   7           H        ALA   7  -0.733 -21.499   1.854
   51    HA   ALA   7           HA       ALA   7  -0.324 -21.115  -0.361
   52   1HB   ALA   7          1HB       ALA   7  -1.644 -18.492   0.302
   53   2HB   ALA   7          2HB       ALA   7  -2.475 -19.992  -0.099
   54   3HB   ALA   7          3HB       ALA   7  -1.473 -19.188  -1.306
   55    H    HIS   8           H        HIS   8   1.769 -20.612   1.332
   56    HA   HIS   8           HA       HIS   8   3.204 -18.302   0.396
   57   1HB   HIS   8          2HB       HIS   8   3.456 -19.604   2.659
   58   2HB   HIS   8          1HB       HIS   8   4.479 -20.681   1.718
   59    HD1  HIS   8           1HD      HIS   8   4.426 -17.329   3.335
   60    HD2  HIS   8           2HD      HIS   8   6.915 -19.536   0.836
   61    HE1  HIS   8           1HE      HIS   8   6.666 -16.152   3.338
   62    H    GLU   9           H        GLU   9   2.263 -21.152  -0.873
   63    HA   GLU   9           HA       GLU   9   4.475 -21.972  -2.425
   64   1HB   GLU   9          2HB       GLU   9   2.712 -23.011  -3.886
   65   2HB   GLU   9          1HB       GLU   9   2.614 -23.450  -2.184
   66   1HG   GLU   9          2HG       GLU   9   0.862 -21.702  -1.907
   67   2HG   GLU   9          1HG       GLU   9   0.898 -21.469  -3.655
   68    H    ALA  10           H        ALA  10   4.925 -21.586  -4.621
   69    HA   ALA  10           HA       ALA  10   4.219 -18.837  -5.371
   70   1HB   ALA  10          1HB       ALA  10   6.410 -18.673  -6.442
   71   2HB   ALA  10          2HB       ALA  10   6.775 -20.329  -5.958
   72   3HB   ALA  10          3HB       ALA  10   6.569 -19.076  -4.732
   73    H    VAL  11           H        VAL  11   2.397 -20.131  -6.235
   74    HA   VAL  11           HA       VAL  11   2.704 -21.524  -8.669
   75    HB   VAL  11           HB       VAL  11   0.310 -20.018  -7.680
   76   1HG1  VAL  11          1HG1      VAL  11   0.133 -20.458 -10.052
   77   2HG1  VAL  11          2HG1      VAL  11  -0.972 -21.513  -9.171
   78   3HG1  VAL  11          3HG1      VAL  11   0.551 -22.150  -9.792
   79   1HG2  VAL  11          1HG2      VAL  11  -0.491 -22.198  -6.878
   80   2HG2  VAL  11          2HG2      VAL  11   1.000 -21.699  -6.078
   81   3HG2  VAL  11          3HG2      VAL  11   1.048 -22.917  -7.354
   82    H    VAL  12           H        VAL  12   1.189 -18.357  -8.196
   83    HA   VAL  12           HA       VAL  12   0.852 -16.702  -9.719
   84    HB   VAL  12           HB       VAL  12   2.372 -15.863  -8.135
   85   1HG1  VAL  12          1HG1      VAL  12   4.622 -16.904  -9.833
   86   2HG1  VAL  12          2HG1      VAL  12   4.107 -17.561  -8.282
   87   3HG1  VAL  12          3HG1      VAL  12   4.792 -15.936  -8.368
   88   1HG2  VAL  12          1HG2      VAL  12   3.192 -15.023 -10.903
   89   2HG2  VAL  12          2HG2      VAL  12   3.494 -14.103  -9.429
   90   3HG2  VAL  12          3HG2      VAL  12   1.838 -14.387  -9.969
   91    H    ARG  13           H        ARG  13   0.301 -17.760 -11.541
   92    HA   ARG  13           HA       ARG  13   2.357 -18.412 -13.456
   93   1HB   ARG  13          2HB       ARG  13   0.534 -19.566 -14.676
   94   2HB   ARG  13          1HB       ARG  13   0.787 -20.177 -13.043
   95   1HG   ARG  13          2HG       ARG  13  -1.135 -19.025 -12.241
   96   2HG   ARG  13          1HG       ARG  13  -1.314 -18.166 -13.774
   97   1HD   ARG  13          2HD       ARG  13  -1.596 -21.135 -13.341
   98   2HD   ARG  13          1HD       ARG  13  -2.908 -19.992 -13.642
   99    HE   ARG  13           HE       ARG  13  -1.201 -19.651 -15.743
  100   1HH1  ARG  13          1HH1      ARG  13  -2.886 -22.389 -14.361
  101   2HH1  ARG  13          2HH1      ARG  13  -3.077 -23.208 -15.876
  102   1HH2  ARG  13          1HH2      ARG  13  -1.447 -20.719 -17.756
  103   2HH2  ARG  13          2HH2      ARG  13  -2.231 -22.273 -17.814
  104    H    VAL  14           H        VAL  14   2.853 -17.059 -14.860
  105    HA   VAL  14           HA       VAL  14   0.916 -15.219 -16.057
  106    HB   VAL  14           HB       VAL  14   3.861 -14.690 -15.810
  107   1HG1  VAL  14          1HG1      VAL  14   3.177 -12.348 -16.139
  108   2HG1  VAL  14          2HG1      VAL  14   1.514 -12.900 -16.353
  109   3HG1  VAL  14          3HG1      VAL  14   2.763 -13.395 -17.496
  110   1HG2  VAL  14          1HG2      VAL  14   2.993 -14.911 -13.544
  111   2HG2  VAL  14          2HG2      VAL  14   1.707 -13.764 -13.916
  112   3HG2  VAL  14          3HG2      VAL  14   3.386 -13.228 -13.896
  113    H    GLY  15           H        GLY  15   1.620 -14.601 -18.277
  114   1HA   GLY  15          2HA       GLY  15   3.489 -16.217 -19.641
  115   2HA   GLY  15          1HA       GLY  15   1.835 -16.728 -19.935
  116    H    THR  16           H        THR  16   0.365 -15.242 -20.857
  117    HA   THR  16           HA       THR  16   1.616 -13.895 -22.984
  118    HB   THR  16           HB       THR  16  -1.311 -13.836 -22.317
  119    HG1  THR  16           1HG      THR  16   0.301 -15.945 -23.004
  120   1HG2  THR  16          1HG2      THR  16  -1.564 -13.648 -24.726
  121   2HG2  THR  16          2HG2      THR  16   0.186 -13.714 -24.920
  122   3HG2  THR  16          3HG2      THR  16  -0.557 -12.347 -24.095
  123    H    LYS  17           H        LYS  17  -0.015 -12.889 -20.118
  124    HA   LYS  17           HA       LYS  17   0.440 -10.074 -20.816
  125   1HB   LYS  17          2HB       LYS  17  -1.302 -11.200 -18.611
  126   2HB   LYS  17          1HB       LYS  17  -1.161  -9.508 -19.057
  127   1HG   LYS  17          2HG       LYS  17  -3.124 -10.076 -20.080
  128   2HG   LYS  17          1HG       LYS  17  -1.973 -10.349 -21.388
  129   1HD   LYS  17          2HD       LYS  17  -1.947 -12.728 -20.905
  130   2HD   LYS  17          1HD       LYS  17  -3.030 -12.480 -19.532
  131   1HE   LYS  17          2HE       LYS  17  -3.665 -11.959 -22.435
  132   2HE   LYS  17          1HE       LYS  17  -4.271 -13.295 -21.456
  133   1HZ   LYS  17          1HZ       LYS  17  -5.962 -11.669 -21.518
  134   2HZ   LYS  17          2HZ       LYS  17  -4.883 -10.410 -21.166
  135   3HZ   LYS  17          3HZ       LYS  17  -5.267 -11.556 -19.972
  136    HA   PRO  18           HA       PRO  18   3.912 -11.006 -18.030
  137   1HB   PRO  18          2HB       PRO  18   4.922  -8.442 -19.059
  138   2HB   PRO  18          1HB       PRO  18   5.668 -10.043 -19.104
  139   1HG   PRO  18          2HG       PRO  18   4.712  -8.903 -21.319
  140   2HG   PRO  18          1HG       PRO  18   4.557 -10.649 -21.041
  141   1HD   PRO  18          2HD       PRO  18   2.520  -8.484 -20.633
  142   2HD   PRO  18          1HD       PRO  18   2.323 -10.068 -21.414
  143    H    GLY  19           H        GLY  19   5.084  -9.718 -16.466
  144   1HA   GLY  19          2HA       GLY  19   5.035  -7.746 -15.016
  145   2HA   GLY  19          1HA       GLY  19   3.281  -7.782 -15.153
  146    H    THR  20           H        THR  20   5.515 -10.429 -14.666
  147    HA   THR  20           HA       THR  20   4.112 -11.507 -12.436
  148    HB   THR  20           HB       THR  20   7.001 -12.085 -13.057
  149    HG1  THR  20           1HG      THR  20   6.477 -13.079 -14.868
  150   1HG2  THR  20          1HG2      THR  20   5.985 -13.174 -11.115
  151   2HG2  THR  20          2HG2      THR  20   6.381 -14.347 -12.370
  152   3HG2  THR  20          3HG2      THR  20   4.712 -13.826 -12.145
  153    H    GLU  21           H        GLU  21   7.165  -9.826 -12.876
  154    HA   GLU  21           HA       GLU  21   6.930  -8.705 -10.195
  155   1HB   GLU  21          2HB       GLU  21   9.472  -9.663 -11.531
  156   2HB   GLU  21          1HB       GLU  21   9.411  -8.759 -10.022
  157   1HG   GLU  21          2HG       GLU  21   8.222 -10.556  -8.949
  158   2HG   GLU  21          1HG       GLU  21   8.152 -11.452 -10.465
  159    H    VAL  22           H        VAL  22   6.511  -6.645 -10.490
  160    HA   VAL  22           HA       VAL  22   6.967  -5.310 -12.969
  161    HB   VAL  22           HB       VAL  22   6.089  -4.255 -10.266
  162   1HG1  VAL  22          1HG1      VAL  22   5.278  -2.276 -11.472
  163   2HG1  VAL  22          2HG1      VAL  22   6.034  -2.874 -12.949
  164   3HG1  VAL  22          3HG1      VAL  22   7.031  -2.430 -11.563
  165   1HG2  VAL  22          1HG2      VAL  22   4.542  -4.986 -12.747
  166   2HG2  VAL  22          2HG2      VAL  22   3.857  -4.230 -11.308
  167   3HG2  VAL  22          3HG2      VAL  22   4.545  -5.851 -11.211
  168    HA   PRO  23           HA       PRO  23  11.135  -3.952 -12.464
  169   1HB   PRO  23          2HB       PRO  23  10.162  -1.494 -13.826
  170   2HB   PRO  23          1HB       PRO  23  11.552  -2.517 -14.210
  171   1HG   PRO  23          2HG       PRO  23   9.343  -2.675 -15.671
  172   2HG   PRO  23          1HG       PRO  23  10.235  -4.144 -15.231
  173   1HD   PRO  23          2HD       PRO  23   7.724  -3.050 -14.068
  174   2HD   PRO  23          1HD       PRO  23   8.168  -4.730 -14.408
  175    HA   PRO  24           HA       PRO  24  10.727  -1.639  -8.712
  176   1HB   PRO  24          2HB       PRO  24  13.419  -1.379  -8.264
  177   2HB   PRO  24          1HB       PRO  24  12.479  -2.823  -7.867
  178   1HG   PRO  24          2HG       PRO  24  14.125  -2.252 -10.306
  179   2HG   PRO  24          1HG       PRO  24  14.075  -3.724  -9.310
  180   1HD   PRO  24          2HD       PRO  24  12.725  -3.638 -11.583
  181   2HD   PRO  24          1HD       PRO  24  11.988  -4.349 -10.136
  182    H    VAL  25           H        VAL  25  10.808   0.399  -8.102
  183    HA   VAL  25           HA       VAL  25  12.061   2.442  -9.723
  184    HB   VAL  25           HB       VAL  25  10.592   2.748  -7.090
  185   1HG1  VAL  25          1HG1      VAL  25  10.369   5.103  -7.751
  186   2HG1  VAL  25          2HG1      VAL  25  11.338   4.785  -9.190
  187   3HG1  VAL  25          3HG1      VAL  25  12.060   4.628  -7.590
  188   1HG2  VAL  25          1HG2      VAL  25   9.097   1.809  -8.748
  189   2HG2  VAL  25          2HG2      VAL  25   9.573   3.045  -9.914
  190   3HG2  VAL  25          3HG2      VAL  25   8.681   3.500  -8.462
  191    H    ILE  26           H        ILE  26  13.549   3.990  -8.492
  192    HA   ILE  26           HA       ILE  26  15.818   2.475  -8.028
  193    HB   ILE  26           HB       ILE  26  15.285   5.374  -7.396
  194   1HG1  ILE  26          2HG1      ILE  26  16.934   5.639  -9.341
  195   2HG1  ILE  26          1HG1      ILE  26  16.681   3.927  -9.645
  196   1HG2  ILE  26          1HG2      ILE  26  17.698   5.674  -7.132
  197   2HG2  ILE  26          2HG2      ILE  26  17.932   3.930  -7.272
  198   3HG2  ILE  26          3HG2      ILE  26  17.041   4.594  -5.903
  199   1HD1  ILE  26          1HD1      ILE  26  14.385   4.287 -10.155
  200   2HD1  ILE  26          2HD1      ILE  26  15.335   5.463 -11.064
  201   3HD1  ILE  26          3HD1      ILE  26  14.471   5.961  -9.611
  202    H    ASP  27           H        ASP  27  13.528   3.750  -5.726
  203    HA   ASP  27           HA       ASP  27  15.191   2.736  -3.552
  204   1HB   ASP  27          2HB       ASP  27  12.935   4.711  -3.536
  205   2HB   ASP  27          1HB       ASP  27  13.574   3.989  -2.066
  206    H    GLY  28           H        GLY  28  12.813   1.778  -5.461
  207   1HA   GLY  28          2HA       GLY  28  11.032   0.606  -3.524
  208   2HA   GLY  28          1HA       GLY  28  10.996   0.314  -5.259
  209    H    SER  29           H        SER  29  14.092  -0.018  -4.387
  210    HA   SER  29           HA       SER  29  14.036  -2.888  -4.222
  211   1HB   SER  29          2HB       SER  29  16.330  -0.996  -3.708
  212   2HB   SER  29          1HB       SER  29  16.449  -2.720  -4.057
  213    HG   SER  29           HG       SER  29  16.473  -2.190  -6.081
  214    H    ILE  30           H        ILE  30  14.608  -0.179  -2.121
  215    HA   ILE  30           HA       ILE  30  15.073  -1.618   0.288
  216    HB   ILE  30           HB       ILE  30  13.693   0.990   0.576
  217   1HG1  ILE  30          2HG1      ILE  30  14.965   1.463  -1.488
  218   2HG1  ILE  30          1HG1      ILE  30  15.595   2.356  -0.112
  219   1HG2  ILE  30          1HG2      ILE  30  16.281  -0.088   1.647
  220   2HG2  ILE  30          2HG2      ILE  30  14.709  -0.135   2.444
  221   3HG2  ILE  30          3HG2      ILE  30  15.502   1.413   2.144
  222   1HD1  ILE  30          1HD1      ILE  30  16.800  -0.153  -1.253
  223   2HD1  ILE  30          2HD1      ILE  30  17.444   0.802   0.085
  224   3HD1  ILE  30          3HD1      ILE  30  17.367   1.491  -1.541
  225    H    TRP  31           H        TRP  31  12.326  -0.310  -1.371
  226    HA   TRP  31           HA       TRP  31  10.399  -0.759   0.644
  227   1HB   TRP  31          2HB       TRP  31  10.137  -0.337  -2.340
  228   2HB   TRP  31          1HB       TRP  31   8.768  -0.396  -1.234
  229    HD1  TRP  31           HD       TRP  31  10.608   2.125  -2.922
  230    HE1  TRP  31           1HE      TRP  31  10.656   4.357  -1.628
  231    HE3  TRP  31           3HE      TRP  31   9.199   0.412   1.607
  232    HZ2  TRP  31           2HZ      TRP  31  10.168   5.245   0.998
  233    HZ3  TRP  31           3HZ      TRP  31   9.018   1.984   3.488
  234    HH2  TRP  31           HH       TRP  31   9.494   4.356   3.186
  235    H    ASP  32           H        ASP  32  11.631  -2.650  -2.027
  236    HA   ASP  32           HA       ASP  32   9.634  -4.691  -1.759
  237   1HB   ASP  32          2HB       ASP  32  10.445  -4.469  -3.938
  238   2HB   ASP  32          1HB       ASP  32  12.128  -4.366  -3.395
  239    H    ALA  33           H        ALA  33  12.933  -4.151  -0.602
  240    HA   ALA  33           HA       ALA  33  13.228  -6.755   0.469
  241   1HB   ALA  33          1HB       ALA  33  15.162  -5.341   0.040
  242   2HB   ALA  33          2HB       ALA  33  15.101  -5.823   1.737
  243   3HB   ALA  33          3HB       ALA  33  14.609  -4.197   1.262
  244    H    ILE  34           H        ILE  34  11.931  -3.707   1.675
  245    HA   ILE  34           HA       ILE  34  11.343  -4.574   4.312
  246    HB   ILE  34           HB       ILE  34   9.987  -2.538   2.553
  247   1HG1  ILE  34          2HG1      ILE  34  11.902  -2.226   4.877
  248   2HG1  ILE  34          1HG1      ILE  34  12.327  -2.042   3.179
  249   1HG2  ILE  34          1HG2      ILE  34   8.391  -3.292   4.208
  250   2HG2  ILE  34          2HG2      ILE  34   8.949  -1.671   4.619
  251   3HG2  ILE  34          3HG2      ILE  34   9.577  -3.068   5.494
  252   1HD1  ILE  34          1HD1      ILE  34  10.424  -0.312   4.741
  253   2HD1  ILE  34          2HD1      ILE  34  10.794  -0.133   3.025
  254   3HD1  ILE  34          3HD1      ILE  34  12.058   0.113   4.231
  255    H    ALA  35           H        ALA  35   9.486  -4.626   1.295
  256    HA   ALA  35           HA       ALA  35   7.165  -5.859   2.211
  257   1HB   ALA  35          1HB       ALA  35   8.531  -6.222  -0.453
  258   2HB   ALA  35          2HB       ALA  35   7.399  -4.935  -0.041
  259   3HB   ALA  35          3HB       ALA  35   6.850  -6.608  -0.092
  260    H    GLY  36           H        GLY  36  10.279  -7.166   1.290
  261   1HA   GLY  36          2HA       GLY  36   9.531  -9.919   1.438
  262   2HA   GLY  36          1HA       GLY  36  11.171  -9.288   1.436
  263    H    CYS  37           H        CYS  37  10.115  -7.576   3.806
  264    HA   CYS  37           HA       CYS  37  11.115  -9.406   5.804
  265   1HB   CYS  37          2HB       CYS  37  11.980  -7.145   5.780
  266   2HB   CYS  37          1HB       CYS  37  10.356  -6.486   5.920
  267    H    GLU  38           H        GLU  38   8.195  -7.364   5.470
  268    HA   GLU  38           HA       GLU  38   7.059  -8.714   7.789
  269   1HB   GLU  38          2HB       GLU  38   6.960  -6.232   7.582
  270   2HB   GLU  38          1HB       GLU  38   5.929  -6.425   6.172
  271   1HG   GLU  38          2HG       GLU  38   4.578  -5.916   8.085
  272   2HG   GLU  38          1HG       GLU  38   4.264  -7.575   7.579
  273    H    ALA  39           H        ALA  39   6.617  -8.450   4.336
  274    HA   ALA  39           HA       ALA  39   4.129  -9.939   4.498
  275   1HB   ALA  39          1HB       ALA  39   5.393  -8.627   2.111
  276   2HB   ALA  39          2HB       ALA  39   4.142  -7.913   3.126
  277   3HB   ALA  39          3HB       ALA  39   3.787  -9.350   2.167
  278    H    GLY  40           H        GLY  40   7.394 -10.464   3.973
  279   1HA   GLY  40          2HA       GLY  40   8.474 -12.492   3.504
  280   2HA   GLY  40          1HA       GLY  40   6.927 -13.164   2.992
  281    H    GLY  41           H        GLY  41   6.960 -10.292   1.654
  282   1HA   GLY  41          2HA       GLY  41   7.926  -9.398  -0.291
  283   2HA   GLY  41          1HA       GLY  41   8.512 -11.004  -0.724
  284    H    ASN  42           H        ASN  42   5.354  -9.513   0.046
  285    HA   ASN  42           HA       ASN  42   4.341 -10.379  -2.523
  286   1HB   ASN  42          2HB       ASN  42   3.851 -12.212  -0.821
  287   2HB   ASN  42          1HB       ASN  42   2.838 -11.030   0.010
  288   1HD2  ASN  42          1HD2      ASN  42   2.188 -13.555  -1.378
  289   2HD2  ASN  42          2HD2      ASN  42   0.980 -13.142  -2.542
  290    H    TRP  43           H        TRP  43   3.113  -8.872  -3.322
  291    HA   TRP  43           HA       TRP  43   2.642  -6.515  -1.647
  292   1HB   TRP  43          2HB       TRP  43   2.678  -6.848  -4.638
  293   2HB   TRP  43          1HB       TRP  43   2.496  -5.319  -3.785
  294    HD1  TRP  43           HD       TRP  43   5.073  -8.189  -4.068
  295    HE1  TRP  43           1HE      TRP  43   7.426  -7.170  -3.878
  296    HE3  TRP  43           3HE      TRP  43   3.768  -3.342  -3.202
  297    HZ2  TRP  43           2HZ      TRP  43   8.577  -4.612  -3.427
  298    HZ3  TRP  43           3HZ      TRP  43   5.532  -1.661  -2.911
  299    HH2  TRP  43           HH       TRP  43   7.895  -2.284  -3.033
  300    H    ALA  44           H        ALA  44   1.037  -9.089  -3.005
  301    HA   ALA  44           HA       ALA  44  -1.511  -7.648  -3.273
  302   1HB   ALA  44          1HB       ALA  44  -2.322  -9.663  -4.410
  303   2HB   ALA  44          2HB       ALA  44  -0.759 -10.437  -4.144
  304   3HB   ALA  44          3HB       ALA  44  -0.875  -9.016  -5.183
  305    H    ILE  45           H        ILE  45   0.219  -9.399  -1.066
  306    HA   ILE  45           HA       ILE  45  -1.673 -11.013   0.165
  307    HB   ILE  45           HB       ILE  45   0.881 -10.935   0.502
  308   1HG1  ILE  45          2HG1      ILE  45  -0.925 -11.116   2.921
  309   2HG1  ILE  45          1HG1      ILE  45  -0.644 -12.399   1.749
  310   1HG2  ILE  45          1HG2      ILE  45   0.086  -8.831   2.507
  311   2HG2  ILE  45          2HG2      ILE  45   1.076  -8.581   1.068
  312   3HG2  ILE  45          3HG2      ILE  45   1.671  -9.594   2.384
  313   1HD1  ILE  45          1HD1      ILE  45   1.417 -11.191   3.580
  314   2HD1  ILE  45          2HD1      ILE  45   1.715 -12.462   2.393
  315   3HD1  ILE  45          3HD1      ILE  45   0.647 -12.769   3.764
  316    H    ASN  46           H        ASN  46  -3.110 -10.617   1.823
  317    HA   ASN  46           HA       ASN  46  -3.340  -8.002   3.013
  318   1HB   ASN  46          2HB       ASN  46  -4.400  -7.775   0.722
  319   2HB   ASN  46          1HB       ASN  46  -5.615  -8.935   1.249
  320   1HD2  ASN  46          1HD2      ASN  46  -5.783  -6.096   0.466
  321   2HD2  ASN  46          2HD2      ASN  46  -6.598  -5.318   1.781
  322    H    THR  47           H        THR  47  -3.474  -8.740   5.016
  323    HA   THR  47           HA       THR  47  -4.934 -11.133   5.637
  324    HB   THR  47           HB       THR  47  -4.214 -10.491   8.023
  325    HG1  THR  47           1HG      THR  47  -2.410  -8.979   7.986
  326   1HG2  THR  47          1HG2      THR  47  -2.090 -10.944   5.918
  327   2HG2  THR  47          2HG2      THR  47  -3.084 -12.200   6.658
  328   3HG2  THR  47          3HG2      THR  47  -1.938 -11.290   7.641
  329    H    GLY  48           H        GLY  48  -5.682  -7.829   5.454
  330   1HA   GLY  48          2HA       GLY  48  -7.807  -6.896   5.765
  331   2HA   GLY  48          1HA       GLY  48  -8.249  -8.287   6.749
  332    H    ASN  49           H        ASN  49  -5.260  -6.633   7.238
  333    HA   ASN  49           HA       ASN  49  -5.987  -6.139   9.985
  334   1HB   ASN  49          2HB       ASN  49  -3.773  -7.090   9.262
  335   2HB   ASN  49          1HB       ASN  49  -3.379  -5.513   8.591
  336   1HD2  ASN  49          1HD2      ASN  49  -1.602  -5.315   9.963
  337   2HD2  ASN  49          2HD2      ASN  49  -1.778  -4.970  11.652
  338    H    GLY  50           H        GLY  50  -6.482  -4.434   7.249
  339   1HA   GLY  50          2HA       GLY  50  -7.341  -2.231   7.146
  340   2HA   GLY  50          1HA       GLY  50  -6.498  -1.858   8.649
  341    H    TYR  51           H        TYR  51  -4.327  -3.537   7.169
  342    HA   TYR  51           HA       TYR  51  -3.183  -1.328   5.623
  343   1HB   TYR  51          2HB       TYR  51  -1.468  -3.433   6.935
  344   2HB   TYR  51          1HB       TYR  51  -1.002  -1.858   6.343
  345    HD1  TYR  51           1HD      TYR  51  -3.744  -0.915   8.070
  346    HD2  TYR  51           2HD      TYR  51   0.063  -2.664   8.811
  347    HE1  TYR  51           1HE      TYR  51  -3.788  -0.047  10.381
  348    HE2  TYR  51           2HE      TYR  51   0.022  -1.814  11.116
  349    HH   TYR  51           HH       TYR  51  -2.703  -0.720  12.627
  350    H    TYR  52           H        TYR  52  -1.741  -2.169   3.889
  351    HA   TYR  52           HA       TYR  52  -2.964  -4.645   2.882
  352   1HB   TYR  52          2HB       TYR  52  -2.196  -2.239   1.234
  353   2HB   TYR  52          1HB       TYR  52  -3.105  -3.653   0.696
  354    HD1  TYR  52           1HD      TYR  52  -3.388  -0.358   1.860
  355    HD2  TYR  52           2HD      TYR  52  -5.267  -4.154   2.143
  356    HE1  TYR  52           1HE      TYR  52  -5.457   0.734   2.617
  357    HE2  TYR  52           2HE      TYR  52  -7.356  -3.078   2.859
  358    HH   TYR  52           HH       TYR  52  -7.916   0.218   2.574
  359    H    GLY  53           H        GLY  53  -1.638  -5.476   0.895
  360   1HA   GLY  53          2HA       GLY  53   0.674  -6.473   2.155
  361   2HA   GLY  53          1HA       GLY  53   0.182  -6.801   0.504
  362    H    GLY  54           H        GLY  54   2.615  -6.828   0.476
  363   1HA   GLY  54          2HA       GLY  54   4.406  -5.892  -0.616
  364   2HA   GLY  54          1HA       GLY  54   3.477  -4.409  -0.811
  365    H    VAL  55           H        VAL  55   3.878  -2.726   0.495
  366    HA   VAL  55           HA       VAL  55   6.123  -2.955   2.328
  367    HB   VAL  55           HB       VAL  55   4.553  -0.426   1.979
  368   1HG1  VAL  55          1HG1      VAL  55   6.453  -0.632   3.573
  369   2HG1  VAL  55          2HG1      VAL  55   6.656   0.624   2.354
  370   3HG1  VAL  55          3HG1      VAL  55   7.514  -0.910   2.195
  371   1HG2  VAL  55          1HG2      VAL  55   5.871   0.125  -0.016
  372   2HG2  VAL  55          2HG2      VAL  55   4.834  -1.274  -0.294
  373   3HG2  VAL  55          3HG2      VAL  55   6.559  -1.498  -0.007
  374    H    GLN  56           H        GLN  56   2.883  -3.427   2.494
  375    HA   GLN  56           HA       GLN  56   1.486  -3.966   4.181
  376   1HB   GLN  56          2HB       GLN  56   4.103  -4.162   5.660
  377   2HB   GLN  56          1HB       GLN  56   2.567  -4.678   6.337
  378   1HG   GLN  56          2HG       GLN  56   3.613  -5.762   3.745
  379   2HG   GLN  56          1HG       GLN  56   4.061  -6.456   5.299
  380   1HE2  GLN  56          1HE2      GLN  56   0.889  -5.135   4.538
  381   2HE2  GLN  56          2HE2      GLN  56   0.051  -6.642   4.599
  382    H    PHE  57           H        PHE  57   1.543  -1.193   3.797
  383    HA   PHE  57           HA       PHE  57   1.191  -0.377   6.586
  384   1HB   PHE  57          2HB       PHE  57   1.606   1.940   5.986
  385   2HB   PHE  57          1HB       PHE  57   2.993   0.912   5.704
  386    HD1  PHE  57           1HD      PHE  57   1.408   3.656   4.533
  387    HD2  PHE  57           2HD      PHE  57   2.871  -0.068   3.071
  388    HE1  PHE  57           1HE      PHE  57   1.725   4.653   2.307
  389    HE2  PHE  57           2HE      PHE  57   3.183   0.923   0.844
  390    HZ   PHE  57           HZ       PHE  57   2.629   3.297   0.457
  391    H    ASP  58           H        ASP  58  -0.317   1.667   6.692
  392    HA   ASP  58           HA       ASP  58  -2.789   0.287   6.236
  393   1HB   ASP  58          2HB       ASP  58  -3.764   1.898   7.752
  394   2HB   ASP  58          1HB       ASP  58  -2.254   1.281   8.413
  395    H    GLN  59           H        GLN  59  -4.746   1.403   5.699
  396    HA   GLN  59           HA       GLN  59  -4.729   2.492   3.125
  397   1HB   GLN  59          2HB       GLN  59  -6.585   1.227   3.928
  398   2HB   GLN  59          1HB       GLN  59  -6.788   2.283   5.312
  399   1HG   GLN  59          2HG       GLN  59  -8.533   2.843   3.895
  400   2HG   GLN  59          1HG       GLN  59  -7.341   4.108   3.641
  401   1HE2  GLN  59          1HE2      GLN  59  -5.616   2.545   1.935
  402   2HE2  GLN  59          2HE2      GLN  59  -6.442   2.336   0.426
  403    H    GLY  60           H        GLY  60  -4.857   3.963   6.296
  404   1HA   GLY  60          2HA       GLY  60  -5.806   6.515   5.463
  405   2HA   GLY  60          1HA       GLY  60  -5.055   6.148   7.007
  406    H    THR  61           H        THR  61  -2.578   5.390   6.431
  407    HA   THR  61           HA       THR  61  -1.187   7.716   5.734
  408    HB   THR  61           HB       THR  61  -0.257   4.873   5.730
  409    HG1  THR  61           1HG      THR  61  -0.460   5.072   7.810
  410   1HG2  THR  61          1HG2      THR  61   1.312   6.278   4.506
  411   2HG2  THR  61          2HG2      THR  61   2.004   5.801   6.057
  412   3HG2  THR  61          3HG2      THR  61   1.345   7.424   5.848
  413    H    TRP  62           H        TRP  62  -1.990   4.834   3.918
  414    HA   TRP  62           HA       TRP  62  -0.679   5.331   1.522
  415   1HB   TRP  62          2HB       TRP  62  -1.769   3.223   2.082
  416   2HB   TRP  62          1HB       TRP  62  -3.336   4.027   2.107
  417    HD1  TRP  62           HD       TRP  62  -4.529   4.455  -0.174
  418    HE1  TRP  62           1HE      TRP  62  -4.088   3.613  -2.572
  419    HE3  TRP  62           3HE      TRP  62   0.161   2.600   0.500
  420    HZ2  TRP  62           2HZ      TRP  62  -2.008   2.309  -4.000
  421    HZ3  TRP  62           3HZ      TRP  62   1.320   1.574  -1.401
  422    HH2  TRP  62           HH       TRP  62   0.267   1.426  -3.599
  423    H    GLU  63           H        GLU  63  -3.925   6.199   2.587
  424    HA   GLU  63           HA       GLU  63  -4.703   7.483   0.194
  425   1HB   GLU  63          2HB       GLU  63  -6.370   6.621   1.668
  426   2HB   GLU  63          1HB       GLU  63  -5.764   7.566   3.018
  427   1HG   GLU  63          2HG       GLU  63  -6.536   9.603   2.004
  428   2HG   GLU  63          1HG       GLU  63  -6.994   8.743   0.536
  429    H    ALA  64           H        ALA  64  -3.149   8.561   3.138
  430    HA   ALA  64           HA       ALA  64  -3.519  11.350   2.734
  431   1HB   ALA  64          1HB       ALA  64  -2.988  10.405   4.925
  432   2HB   ALA  64          2HB       ALA  64  -1.825  11.649   4.455
  433   3HB   ALA  64          3HB       ALA  64  -1.390   9.943   4.338
  434    H    ASN  65           H        ASN  65  -0.837   9.137   1.947
  435    HA   ASN  65           HA       ASN  65   0.737  11.144   0.662
  436   1HB   ASN  65          2HB       ASN  65   0.821   8.196   0.013
  437   2HB   ASN  65          1HB       ASN  65   2.124   9.375  -0.129
  438   1HD2  ASN  65          1HD2      ASN  65   1.623  10.584   2.454
  439   2HD2  ASN  65          2HD2      ASN  65   2.193   9.443   3.633
  440    H    GLY  66           H        GLY  66  -2.076   9.462  -0.166
  441   1HA   GLY  66          2HA       GLY  66  -3.476   9.963  -1.966
  442   2HA   GLY  66          1HA       GLY  66  -2.120  10.733  -2.782
  443    H    GLY  67           H        GLY  67  -2.549   7.444  -1.441
  444   1HA   GLY  67          2HA       GLY  67  -1.074   6.397  -3.699
  445   2HA   GLY  67          1HA       GLY  67  -1.695   5.480  -2.329
  446    H    LEU  68           H        LEU  68  -4.274   6.971  -2.889
  447    HA   LEU  68           HA       LEU  68  -5.627   4.821  -3.999
  448   1HB   LEU  68          2HB       LEU  68  -6.622   7.636  -3.947
  449   2HB   LEU  68          1HB       LEU  68  -7.562   6.165  -3.798
  450    HG   LEU  68           HG       LEU  68  -5.578   7.044  -1.703
  451   1HD1  LEU  68          1HD1      LEU  68  -7.264   8.774  -1.980
  452   2HD1  LEU  68          2HD1      LEU  68  -7.483   7.908  -0.460
  453   3HD1  LEU  68          3HD1      LEU  68  -8.540   7.565  -1.830
  454   1HD2  LEU  68          1HD2      LEU  68  -6.852   5.551  -0.271
  455   2HD2  LEU  68          2HD2      LEU  68  -6.164   4.698  -1.655
  456   3HD2  LEU  68          3HD2      LEU  68  -7.880   5.112  -1.637
  457    H    ARG  69           H        ARG  69  -4.133   7.580  -5.393
  458    HA   ARG  69           HA       ARG  69  -5.535   7.633  -7.855
  459   1HB   ARG  69          2HB       ARG  69  -3.872   9.177  -8.569
  460   2HB   ARG  69          1HB       ARG  69  -4.193   9.514  -6.875
  461   1HG   ARG  69          2HG       ARG  69  -2.184   8.084  -6.343
  462   2HG   ARG  69          1HG       ARG  69  -1.822   8.121  -8.069
  463   1HD   ARG  69          2HD       ARG  69  -2.012  10.488  -6.206
  464   2HD   ARG  69          1HD       ARG  69  -0.555   9.853  -6.970
  465    HE   ARG  69           HE       ARG  69  -2.069  10.442  -9.103
  466   1HH1  ARG  69          1HH1      ARG  69  -1.241  12.280  -6.241
  467   2HH1  ARG  69          2HH1      ARG  69  -1.385  13.820  -7.022
  468   1HH2  ARG  69          1HH2      ARG  69  -2.272  12.471 -10.153
  469   2HH2  ARG  69          2HH2      ARG  69  -1.972  13.934  -9.253
  470    H    TYR  70           H        TYR  70  -2.834   5.864  -6.567
  471    HA   TYR  70           HA       TYR  70  -2.082   4.750  -9.147
  472   1HB   TYR  70          2HB       TYR  70  -1.315   3.914  -6.349
  473   2HB   TYR  70          1HB       TYR  70  -0.447   3.524  -7.836
  474    HD1  TYR  70           1HD      TYR  70   0.748   5.431  -9.050
  475    HD2  TYR  70           2HD      TYR  70  -0.875   5.822  -5.135
  476    HE1  TYR  70           1HE      TYR  70   2.155   7.415  -8.668
  477    HE2  TYR  70           2HE      TYR  70   0.519   7.796  -4.746
  478    HH   TYR  70           HH       TYR  70   2.375   8.937  -5.516
  479    H    ALA  71           H        ALA  71  -3.836   4.150  -6.263
  480    HA   ALA  71           HA       ALA  71  -5.739   2.378  -7.131
  481   1HB   ALA  71          1HB       ALA  71  -3.939   0.762  -7.569
  482   2HB   ALA  71          2HB       ALA  71  -4.979   0.218  -6.252
  483   3HB   ALA  71          3HB       ALA  71  -3.399   0.916  -5.898
  484    HA   PRO  72           HA       PRO  72  -6.877   3.944  -3.134
  485   1HB   PRO  72          2HB       PRO  72  -9.018   1.996  -3.197
  486   2HB   PRO  72          1HB       PRO  72  -9.086   3.749  -3.142
  487   1HG   PRO  72          2HG       PRO  72  -9.700   2.258  -5.348
  488   2HG   PRO  72          1HG       PRO  72  -9.180   3.948  -5.388
  489   1HD   PRO  72          2HD       PRO  72  -7.717   1.517  -6.147
  490   2HD   PRO  72          1HD       PRO  72  -7.455   3.204  -6.635
  491    H    ARG  73           H        ARG  73  -5.718   0.906  -3.765
  492    HA   ARG  73           HA       ARG  73  -5.083   0.572  -0.969
  493   1HB   ARG  73          2HB       ARG  73  -5.826  -1.765  -0.859
  494   2HB   ARG  73          1HB       ARG  73  -7.190  -0.704  -1.194
  495   1HG   ARG  73          2HG       ARG  73  -6.790  -1.250  -3.645
  496   2HG   ARG  73          1HG       ARG  73  -5.751  -2.551  -3.056
  497   1HD   ARG  73          2HD       ARG  73  -8.591  -2.224  -2.124
  498   2HD   ARG  73          1HD       ARG  73  -8.185  -3.123  -3.585
  499    HE   ARG  73           HE       ARG  73  -6.582  -4.247  -1.726
  500   1HH1  ARG  73          1HH1      ARG  73  -9.999  -3.473  -1.591
  501   2HH1  ARG  73          2HH1      ARG  73 -10.441  -4.970  -0.821
  502   1HH2  ARG  73          1HH2      ARG  73  -7.150  -6.208  -0.752
  503   2HH2  ARG  73          2HH2      ARG  73  -8.805  -6.530  -0.314
  504    H    ALA  74           H        ALA  74  -3.192  -0.571  -0.679
  505    HA   ALA  74           HA       ALA  74  -1.304  -0.323  -2.720
  506   1HB   ALA  74          1HB       ALA  74  -0.891  -0.252  -0.232
  507   2HB   ALA  74          2HB       ALA  74   0.286  -1.155  -1.184
  508   3HB   ALA  74          3HB       ALA  74  -0.943  -2.015  -0.264
  509    H    ASP  75           H        ASP  75  -3.344  -2.980  -1.861
  510    HA   ASP  75           HA       ASP  75  -1.684  -4.865  -3.298
  511   1HB   ASP  75          2HB       ASP  75  -3.301  -6.579  -2.587
  512   2HB   ASP  75          1HB       ASP  75  -2.621  -5.686  -1.236
  513    H    LEU  76           H        LEU  76  -3.482  -2.570  -4.383
  514    HA   LEU  76           HA       LEU  76  -4.839  -4.185  -6.431
  515   1HB   LEU  76          2HB       LEU  76  -6.219  -2.513  -5.230
  516   2HB   LEU  76          1HB       LEU  76  -5.166  -1.244  -5.826
  517    HG   LEU  76           HG       LEU  76  -5.830  -1.777  -8.137
  518   1HD1  LEU  76          1HD1      LEU  76  -6.327  -4.150  -7.822
  519   2HD1  LEU  76          2HD1      LEU  76  -7.682  -3.297  -8.563
  520   3HD1  LEU  76          3HD1      LEU  76  -7.741  -3.727  -6.854
  521   1HD2  LEU  76          1HD2      LEU  76  -7.035  -0.070  -6.865
  522   2HD2  LEU  76          2HD2      LEU  76  -8.165  -1.297  -6.289
  523   3HD2  LEU  76          3HD2      LEU  76  -8.094  -0.898  -8.008
  524    H    ALA  77           H        ALA  77  -2.563  -1.463  -6.000
  525    HA   ALA  77           HA       ALA  77  -1.854  -1.737  -8.829
  526   1HB   ALA  77          1HB       ALA  77  -1.127   0.471  -6.902
  527   2HB   ALA  77          2HB       ALA  77  -2.380   0.534  -8.151
  528   3HB   ALA  77          3HB       ALA  77  -0.685   0.389  -8.613
  529    H    THR  78           H        THR  78   0.610  -1.217  -9.107
  530    HA   THR  78           HA       THR  78   1.716  -3.669  -8.061
  531    HB   THR  78           HB       THR  78   3.323  -3.468  -9.850
  532    HG1  THR  78           1HG      THR  78   3.279  -1.553 -11.179
  533   1HG2  THR  78          1HG2      THR  78   1.165  -4.296 -10.489
  534   2HG2  THR  78          2HG2      THR  78   1.716  -3.201 -11.760
  535   3HG2  THR  78          3HG2      THR  78   0.517  -2.658 -10.581
  536    H    ARG  79           H        ARG  79   4.130  -3.731  -7.640
  537    HA   ARG  79           HA       ARG  79   4.739  -2.550  -5.272
  538   1HB   ARG  79          2HB       ARG  79   6.908  -3.385  -5.510
  539   2HB   ARG  79          1HB       ARG  79   5.919  -4.419  -6.525
  540   1HG   ARG  79          2HG       ARG  79   6.624  -3.045  -8.479
  541   2HG   ARG  79          1HG       ARG  79   7.763  -2.232  -7.403
  542   1HD   ARG  79          2HD       ARG  79   7.715  -5.215  -7.641
  543   2HD   ARG  79          1HD       ARG  79   8.591  -4.228  -8.807
  544    HE   ARG  79           HE       ARG  79   9.213  -3.764  -6.008
  545   1HH1  ARG  79          1HH1      ARG  79  10.017  -5.374  -8.999
  546   2HH1  ARG  79          2HH1      ARG  79  11.646  -5.758  -8.522
  547   1HH2  ARG  79          1HH2      ARG  79  11.402  -4.182  -5.396
  548   2HH2  ARG  79          2HH2      ARG  79  12.447  -5.045  -6.487
  549    H    GLU  80           H        GLU  80   5.359  -1.224  -8.448
  550    HA   GLU  80           HA       GLU  80   7.097   0.845  -7.689
  551   1HB   GLU  80          2HB       GLU  80   6.645   1.824  -9.852
  552   2HB   GLU  80          1HB       GLU  80   6.809   0.080 -10.011
  553   1HG   GLU  80          2HG       GLU  80   4.303  -0.052  -9.962
  554   2HG   GLU  80          1HG       GLU  80   4.288   1.707 -10.087
  555    H    GLU  81           H        GLU  81   3.569   0.631  -7.605
  556    HA   GLU  81           HA       GLU  81   3.135   3.385  -7.161
  557   1HB   GLU  81          2HB       GLU  81   1.140   2.587  -7.762
  558   2HB   GLU  81          1HB       GLU  81   1.635   0.929  -7.446
  559   1HG   GLU  81          2HG       GLU  81   1.230   2.366  -5.024
  560   2HG   GLU  81          1HG       GLU  81  -0.189   2.434  -6.047
  561    H    GLN  82           H        GLN  82   3.208   0.478  -5.077
  562    HA   GLN  82           HA       GLN  82   2.853   1.830  -2.650
  563   1HB   GLN  82          2HB       GLN  82   4.448  -0.681  -3.146
  564   2HB   GLN  82          1HB       GLN  82   3.949  -0.098  -1.565
  565   1HG   GLN  82          2HG       GLN  82   1.577  -0.248  -2.395
  566   2HG   GLN  82          1HG       GLN  82   2.219  -1.109  -3.792
  567   1HE2  GLN  82          1HE2      GLN  82   1.292  -3.033  -3.395
  568   2HE2  GLN  82          2HE2      GLN  82   1.664  -4.014  -2.013
  569    H    ILE  83           H        ILE  83   5.726   1.292  -4.580
  570    HA   ILE  83           HA       ILE  83   7.648   2.296  -2.833
  571    HB   ILE  83           HB       ILE  83   7.415   2.493  -5.841
  572   1HG1  ILE  83          2HG1      ILE  83   9.284   0.803  -4.191
  573   2HG1  ILE  83          1HG1      ILE  83   7.702   0.241  -4.672
  574   1HG2  ILE  83          1HG2      ILE  83   9.765   3.220  -4.100
  575   2HG2  ILE  83          2HG2      ILE  83   8.808   4.322  -5.085
  576   3HG2  ILE  83          3HG2      ILE  83   9.804   3.088  -5.857
  577   1HD1  ILE  83          1HD1      ILE  83   8.306   0.490  -7.018
  578   2HD1  ILE  83          2HD1      ILE  83   9.412  -0.590  -6.168
  579   3HD1  ILE  83          3HD1      ILE  83   9.905   1.061  -6.539
  580    H    ALA  84           H        ALA  84   5.591   3.996  -5.207
  581    HA   ALA  84           HA       ALA  84   6.708   6.549  -4.778
  582   1HB   ALA  84          1HB       ALA  84   4.731   7.376  -5.969
  583   2HB   ALA  84          2HB       ALA  84   3.970   5.795  -5.793
  584   3HB   ALA  84          3HB       ALA  84   5.427   5.966  -6.769
  585    H    VAL  85           H        VAL  85   3.882   4.964  -3.403
  586    HA   VAL  85           HA       VAL  85   2.934   7.183  -1.916
  587    HB   VAL  85           HB       VAL  85   2.486   4.241  -1.430
  588   1HG1  VAL  85          1HG1      VAL  85   0.875   6.656  -0.593
  589   2HG1  VAL  85          2HG1      VAL  85   1.817   5.614   0.472
  590   3HG1  VAL  85          3HG1      VAL  85   0.394   4.977  -0.352
  591   1HG2  VAL  85          1HG2      VAL  85   0.930   6.195  -3.116
  592   2HG2  VAL  85          2HG2      VAL  85   0.453   4.530  -2.773
  593   3HG2  VAL  85          3HG2      VAL  85   1.917   4.856  -3.705
  594    H    ALA  86           H        ALA  86   4.752   4.272  -0.929
  595    HA   ALA  86           HA       ALA  86   5.214   5.018   1.718
  596   1HB   ALA  86          1HB       ALA  86   7.019   3.385   1.696
  597   2HB   ALA  86          2HB       ALA  86   6.964   3.327  -0.065
  598   3HB   ALA  86          3HB       ALA  86   5.592   2.747   0.881
  599    H    GLU  87           H        GLU  87   6.701   5.966  -1.265
  600    HA   GLU  87           HA       GLU  87   9.131   7.015  -0.255
  601   1HB   GLU  87          2HB       GLU  87   7.522   7.651  -2.718
  602   2HB   GLU  87          1HB       GLU  87   8.938   8.611  -2.303
  603   1HG   GLU  87          2HG       GLU  87  10.210   6.419  -2.229
  604   2HG   GLU  87          1HG       GLU  87   8.786   5.697  -2.986
  605    H    VAL  88           H        VAL  88   5.923   8.548  -0.648
  606    HA   VAL  88           HA       VAL  88   6.727  11.122   0.162
  607    HB   VAL  88           HB       VAL  88   4.052   9.755   0.566
  608   1HG1  VAL  88          1HG1      VAL  88   4.737  12.683   0.860
  609   2HG1  VAL  88          2HG1      VAL  88   4.386  11.574   2.192
  610   3HG1  VAL  88          3HG1      VAL  88   3.134  11.961   1.004
  611   1HG2  VAL  88          1HG2      VAL  88   4.954  11.785  -1.481
  612   2HG2  VAL  88          2HG2      VAL  88   3.346  11.071  -1.356
  613   3HG2  VAL  88          3HG2      VAL  88   4.729  10.062  -1.776
  614    H    THR  89           H        THR  89   5.410   8.432   2.035
  615    HA   THR  89           HA       THR  89   5.498   9.723   4.527
  616    HB   THR  89           HB       THR  89   5.470   6.775   3.832
  617    HG1  THR  89           1HG      THR  89   3.528   7.403   3.207
  618   1HG2  THR  89          1HG2      THR  89   5.945   6.587   6.052
  619   2HG2  THR  89          2HG2      THR  89   4.211   6.863   6.183
  620   3HG2  THR  89          3HG2      THR  89   5.340   8.197   6.435
  621    H    ARG  90           H        ARG  90   7.859   7.705   2.836
  622    HA   ARG  90           HA       ARG  90   9.684   7.349   4.925
  623   1HB   ARG  90          2HB       ARG  90  10.999   6.351   3.373
  624   2HB   ARG  90          1HB       ARG  90   9.566   6.478   2.363
  625   1HG   ARG  90          2HG       ARG  90  10.440   8.577   1.428
  626   2HG   ARG  90          1HG       ARG  90  11.887   8.396   2.414
  627   1HD   ARG  90          2HD       ARG  90  12.012   6.059   1.221
  628   2HD   ARG  90          1HD       ARG  90  11.013   6.871   0.011
  629    HE   ARG  90           HE       ARG  90  13.535   8.074   0.907
  630   1HH1  ARG  90          1HH1      ARG  90  11.504   6.862  -1.653
  631   2HH1  ARG  90          2HH1      ARG  90  12.613   7.268  -2.917
  632   1HH2  ARG  90          1HH2      ARG  90  15.041   8.590  -0.743
  633   2HH2  ARG  90          2HH2      ARG  90  14.639   8.227  -2.399
  634    H    LEU  91           H        LEU  91   9.204  10.048   2.745
  635    HA   LEU  91           HA       LEU  91  11.717  11.318   3.090
  636   1HB   LEU  91          2HB       LEU  91   9.128  12.764   2.553
  637   2HB   LEU  91          1HB       LEU  91  10.745  13.267   2.109
  638    HG   LEU  91           HG       LEU  91   9.220  10.958   0.924
  639   1HD1  LEU  91          1HD1      LEU  91   8.321  13.094   0.229
  640   2HD1  LEU  91          2HD1      LEU  91   9.205  12.353  -1.108
  641   3HD1  LEU  91          3HD1      LEU  91   9.935  13.671  -0.188
  642   1HD2  LEU  91          1HD2      LEU  91  11.082  10.873  -0.699
  643   2HD2  LEU  91          2HD2      LEU  91  11.597  10.490   0.946
  644   3HD2  LEU  91          3HD2      LEU  91  11.945  12.078   0.259
  645    H    ARG  92           H        ARG  92   8.883  11.155   4.972
  646    HA   ARG  92           HA       ARG  92   9.335  13.655   6.337
  647   1HB   ARG  92          2HB       ARG  92   7.214  11.664   7.020
  648   2HB   ARG  92          1HB       ARG  92   7.174  13.418   7.175
  649   1HG   ARG  92          2HG       ARG  92   6.903  13.726   4.867
  650   2HG   ARG  92          1HG       ARG  92   7.358  12.058   4.515
  651   1HD   ARG  92          2HD       ARG  92   4.808  13.135   5.607
  652   2HD   ARG  92          1HD       ARG  92   5.080  12.001   4.287
  653    HE   ARG  92           HE       ARG  92   5.983  10.770   6.584
  654   1HH1  ARG  92          1HH1      ARG  92   2.984  11.966   5.245
  655   2HH1  ARG  92          2HH1      ARG  92   1.976  10.873   6.147
  656   1HH2  ARG  92          1HH2      ARG  92   4.651   9.356   7.837
  657   2HH2  ARG  92          2HH2      ARG  92   2.921   9.397   7.631
  658    H    GLN  93           H        GLN  93   9.256  10.204   7.025
  659    HA   GLN  93           HA       GLN  93  10.180  10.869   9.714
  660   1HB   GLN  93          2HB       GLN  93   8.943   9.199  10.557
  661   2HB   GLN  93          1HB       GLN  93   8.060   9.425   9.051
  662   1HG   GLN  93          2HG       GLN  93  10.213   7.366   9.456
  663   2HG   GLN  93          1HG       GLN  93   8.491   7.066   9.672
  664   1HE2  GLN  93          1HE2      GLN  93   7.138   7.134   7.832
  665   2HE2  GLN  93          2HE2      GLN  93   7.802   6.883   6.253
  666    H    GLY  94           H        GLY  94  11.309   9.278   6.855
  667   1HA   GLY  94          2HA       GLY  94  13.556   8.913   6.360
  668   2HA   GLY  94          1HA       GLY  94  13.954   9.238   8.038
  669    H    TRP  95           H        TRP  95  11.749   6.868   6.639
  670    HA   TRP  95           HA       TRP  95  11.579   4.623   6.786
  671   1HB   TRP  95          2HB       TRP  95  14.555   4.478   7.271
  672   2HB   TRP  95          1HB       TRP  95  13.514   3.255   6.541
  673    HD1  TRP  95           HD       TRP  95  15.033   6.690   5.736
  674    HE1  TRP  95           1HE      TRP  95  15.268   6.889   3.190
  675    HE3  TRP  95           3HE      TRP  95  12.664   2.377   4.397
  676    HZ2  TRP  95           2HZ      TRP  95  14.519   5.409   0.902
  677    HZ3  TRP  95           3HZ      TRP  95  12.456   1.844   2.004
  678    HH2  TRP  95           HH       TRP  95  13.365   3.331   0.294
  679    H    GLY  96           H        GLY  96  11.787   6.479   9.169
  680   1HA   GLY  96          2HA       GLY  96  12.572   4.804  11.358
  681   2HA   GLY  96          1HA       GLY  96  11.680   6.315  11.473
  682    H    ALA  97           H        ALA  97   9.547   5.447   9.695
  683    HA   ALA  97           HA       ALA  97   7.882   4.150  11.616
  684   1HB   ALA  97          1HB       ALA  97   6.970   5.821  10.094
  685   2HB   ALA  97          2HB       ALA  97   6.143   4.276   9.890
  686   3HB   ALA  97          3HB       ALA  97   7.352   4.791   8.715
  687    H    TRP  98           H        TRP  98   9.823   3.178   8.965
  688    HA   TRP  98           HA       TRP  98   8.776   0.463   9.017
  689   1HB   TRP  98          2HB       TRP  98  10.778   1.863   7.233
  690   2HB   TRP  98          1HB       TRP  98  10.443   0.136   7.141
  691    HD1  TRP  98           HD       TRP  98   7.982  -0.594   6.315
  692    HE1  TRP  98           1HE      TRP  98   6.276   0.613   4.802
  693    HE3  TRP  98           3HE      TRP  98   9.894   4.167   6.564
  694    HZ2  TRP  98           2HZ      TRP  98   5.816   3.255   3.834
  695    HZ3  TRP  98           3HZ      TRP  98   8.766   5.951   5.315
  696    HH2  TRP  98           HH       TRP  98   6.772   5.501   3.987
  697    HA   PRO  99           HA       PRO  99  11.764  -0.039  12.272
  698   1HB   PRO  99          2HB       PRO  99  10.741  -2.826  12.114
  699   2HB   PRO  99          1HB       PRO  99  10.857  -1.744  13.509
  700   1HG   PRO  99          2HG       PRO  99   8.496  -2.172  12.426
  701   2HG   PRO  99          1HG       PRO  99   8.971  -0.516  12.870
  702   1HD   PRO  99          2HD       PRO  99   9.041  -1.820  10.159
  703   2HD   PRO  99          1HD       PRO  99   8.370  -0.238  10.623
  704    H    VAL 100           H        VAL 100  12.588  -2.940  12.481
  705    HA   VAL 100           HA       VAL 100  15.120  -2.661  11.365
  706    HB   VAL 100           HB       VAL 100  13.897  -5.357  11.920
  707   1HG1  VAL 100          1HG1      VAL 100  16.195  -5.858  12.693
  708   2HG1  VAL 100          2HG1      VAL 100  16.687  -4.246  12.169
  709   3HG1  VAL 100          3HG1      VAL 100  16.111  -5.421  10.987
  710   1HG2  VAL 100          1HG2      VAL 100  13.283  -3.987  13.802
  711   2HG2  VAL 100          2HG2      VAL 100  14.921  -3.344  13.920
  712   3HG2  VAL 100          3HG2      VAL 100  14.612  -5.044  14.275
  713    H    CYS 101           H        CYS 101  12.193  -3.764   9.896
  714    HA   CYS 101           HA       CYS 101  13.146  -5.216   7.721
  715   1HB   CYS 101          2HB       CYS 101  10.794  -3.301   7.819
  716   2HB   CYS 101          1HB       CYS 101  11.084  -4.491   6.550
  717    H    ALA 102           H        ALA 102  12.929  -1.708   8.196
  718    HA   ALA 102           HA       ALA 102  13.812  -1.040   5.562
  719   1HB   ALA 102          1HB       ALA 102  13.835   0.607   8.090
  720   2HB   ALA 102          2HB       ALA 102  12.538   0.550   6.897
  721   3HB   ALA 102          3HB       ALA 102  14.108   1.224   6.462
  722    H    ALA 103           H        ALA 103  15.370  -1.502   8.681
  723    HA   ALA 103           HA       ALA 103  17.956  -0.689   7.982
  724   1HB   ALA 103          1HB       ALA 103  17.133  -2.808   9.963
  725   2HB   ALA 103          2HB       ALA 103  17.271  -1.082  10.293
  726   3HB   ALA 103          3HB       ALA 103  18.709  -2.020   9.889
  727    H    ARG 104           H        ARG 104  16.368  -3.834   7.755
  728    HA   ARG 104           HA       ARG 104  18.545  -5.220   6.621
  729   1HB   ARG 104          2HB       ARG 104  15.719  -5.723   7.121
  730   2HB   ARG 104          1HB       ARG 104  16.286  -6.469   5.629
  731   1HG   ARG 104          2HG       ARG 104  16.802  -8.149   7.048
  732   2HG   ARG 104          1HG       ARG 104  18.277  -7.201   7.233
  733   1HD   ARG 104          2HD       ARG 104  17.449  -7.859   9.404
  734   2HD   ARG 104          1HD       ARG 104  17.303  -6.111   9.208
  735    HE   ARG 104           HE       ARG 104  14.898  -6.721   8.531
  736   1HH1  ARG 104          1HH1      ARG 104  16.805  -8.387  10.953
  737   2HH1  ARG 104          2HH1      ARG 104  15.425  -8.861  11.902
  738   1HH2  ARG 104          1HH2      ARG 104  13.064  -7.378   9.775
  739   2HH2  ARG 104          2HH2      ARG 104  13.305  -8.278  11.240
  740    H    ALA 105           H        ALA 105  16.159  -3.081   5.303
  741    HA   ALA 105           HA       ALA 105  16.458  -4.024   2.577
  742   1HB   ALA 105          1HB       ALA 105  14.883  -1.711   3.675
  743   2HB   ALA 105          2HB       ALA 105  14.285  -3.358   3.473
  744   3HB   ALA 105          3HB       ALA 105  14.744  -2.408   2.061
  745    H    GLY 106           H        GLY 106  17.780  -1.505   4.566
  746   1HA   GLY 106          2HA       GLY 106  19.778  -0.349   3.866
  747   2HA   GLY 106          1HA       GLY 106  19.197  -0.441   2.209
  748    H    ALA 107           H        ALA 107  18.254   0.892   5.347
  749    HA   ALA 107           HA       ALA 107  16.487   2.840   4.272
  750   1HB   ALA 107          1HB       ALA 107  17.719   2.692   7.021
  751   2HB   ALA 107          2HB       ALA 107  16.219   1.908   6.530
  752   3HB   ALA 107          3HB       ALA 107  16.327   3.668   6.552
  753    H    ARG 108           H        ARG 108  16.738   5.124   4.255
  754    HA   ARG 108           HA       ARG 108  19.213   6.382   4.677
  755   1HB   ARG 108          2HB       ARG 108  19.558   6.807   2.100
  756   2HB   ARG 108          1HB       ARG 108  20.246   5.397   2.887
  757   1HG   ARG 108          2HG       ARG 108  19.340   4.322   1.136
  758   2HG   ARG 108          1HG       ARG 108  17.879   4.369   2.129
  759   1HD   ARG 108          2HD       ARG 108  17.523   5.078  -0.236
  760   2HD   ARG 108          1HD       ARG 108  17.088   6.322   0.940
  761    HE   ARG 108           HE       ARG 108  19.723   6.797   0.266
  762   1HH1  ARG 108          1HH1      ARG 108  16.725   6.586  -1.558
  763   2HH1  ARG 108          2HH1      ARG 108  17.178   7.866  -2.646
  764   1HH2  ARG 108          1HH2      ARG 108  20.314   8.404  -1.202
  765   2HH2  ARG 108          2HH2      ARG 108  19.225   8.863  -2.471
  Start of MODEL   11
    1   1H    ASN   1          1HT       ASN   1  43.897  17.558 -41.216
    2   2H    ASN   1          2HT       ASN   1  45.514  17.074 -41.283
    3   3H    ASN   1          3HT       ASN   1  45.112  18.606 -40.679
    4    HA   ASN   1           HA       ASN   1  45.689  16.902 -38.994
    5   1HB   ASN   1          2HB       ASN   1  43.620  17.424 -37.568
    6   2HB   ASN   1          1HB       ASN   1  44.612  18.767 -38.112
    7   1HD2  ASN   1          1HD2      ASN   1  42.970  20.245 -37.902
    8   2HD2  ASN   1          2HD2      ASN   1  41.601  20.293 -38.965
    9    H    VAL   2           H        VAL   2  45.801  14.842 -39.342
   10    HA   VAL   2           HA       VAL   2  43.688  13.166 -40.206
   11    HB   VAL   2           HB       VAL   2  46.058  12.550 -40.475
   12   1HG1  VAL   2          1HG1      VAL   2  47.339  11.655 -38.586
   13   2HG1  VAL   2          2HG1      VAL   2  46.044  12.134 -37.486
   14   3HG1  VAL   2          3HG1      VAL   2  46.953  13.363 -38.370
   15   1HG2  VAL   2          1HG2      VAL   2  44.385  10.808 -40.593
   16   2HG2  VAL   2          2HG2      VAL   2  44.454  10.587 -38.844
   17   3HG2  VAL   2          3HG2      VAL   2  45.854  10.185 -39.840
   18    H    VAL   3           H        VAL   3  44.783  14.211 -37.041
   19    HA   VAL   3           HA       VAL   3  43.032  12.433 -35.655
   20    HB   VAL   3           HB       VAL   3  44.619  14.787 -34.622
   21   1HG1  VAL   3          1HG1      VAL   3  44.218  13.843 -32.397
   22   2HG1  VAL   3          2HG1      VAL   3  43.173  12.616 -33.109
   23   3HG1  VAL   3          3HG1      VAL   3  42.712  14.314 -33.182
   24   1HG2  VAL   3          1HG2      VAL   3  46.144  13.096 -33.740
   25   2HG2  VAL   3          2HG2      VAL   3  46.018  12.984 -35.496
   26   3HG2  VAL   3          3HG2      VAL   3  45.168  11.824 -34.474
   27    H    VAL   4           H        VAL   4  40.962  12.851 -36.297
   28    HA   VAL   4           HA       VAL   4  39.918  15.540 -36.333
   29    HB   VAL   4           HB       VAL   4  38.291  13.018 -36.485
   30   1HG1  VAL   4          1HG1      VAL   4  37.025  15.070 -36.247
   31   2HG1  VAL   4          2HG1      VAL   4  36.792  14.386 -37.857
   32   3HG1  VAL   4          3HG1      VAL   4  37.864  15.768 -37.634
   33   1HG2  VAL   4          1HG2      VAL   4  39.714  14.379 -38.769
   34   2HG2  VAL   4          2HG2      VAL   4  38.573  13.042 -38.913
   35   3HG2  VAL   4          3HG2      VAL   4  40.115  12.799 -38.092
   36    H    THR   5           H        THR   5  38.410  16.379 -34.931
   37    HA   THR   5           HA       THR   5  37.948  14.890 -32.445
   38    HB   THR   5           HB       THR   5  37.853  17.308 -31.434
   39    HG1  THR   5           1HG      THR   5  38.627  18.836 -32.678
   40   1HG2  THR   5          1HG2      THR   5  39.454  15.614 -30.729
   41   2HG2  THR   5          2HG2      THR   5  40.256  17.177 -30.891
   42   3HG2  THR   5          3HG2      THR   5  40.459  15.948 -32.139
   43    HA   PRO   6           HA       PRO   6  33.864  15.809 -34.093
   44   1HB   PRO   6          2HB       PRO   6  32.875  13.643 -32.471
   45   2HB   PRO   6          1HB       PRO   6  33.078  13.701 -34.223
   46   1HG   PRO   6          2HG       PRO   6  34.559  12.100 -32.586
   47   2HG   PRO   6          1HG       PRO   6  35.137  12.717 -34.145
   48   1HD   PRO   6          2HD       PRO   6  35.665  13.763 -31.385
   49   2HD   PRO   6          1HD       PRO   6  36.807  13.524 -32.726
   50    H    ALA   7           H        ALA   7  31.824  16.243 -33.228
   51    HA   ALA   7           HA       ALA   7  31.948  17.486 -30.570
   52   1HB   ALA   7          1HB       ALA   7  31.473  19.000 -32.435
   53   2HB   ALA   7          2HB       ALA   7  30.129  18.908 -31.298
   54   3HB   ALA   7          3HB       ALA   7  30.043  18.047 -32.834
   55    H    HIS   8           H        HIS   8  31.540  15.717 -29.394
   56    HA   HIS   8           HA       HIS   8  28.984  14.376 -29.622
   57   1HB   HIS   8          2HB       HIS   8  31.059  14.202 -27.419
   58   2HB   HIS   8          1HB       HIS   8  29.696  13.113 -27.654
   59    HD1  HIS   8           1HD      HIS   8  33.214  13.584 -28.570
   60    HD2  HIS   8           2HD      HIS   8  29.927  11.497 -30.041
   61    HE1  HIS   8           1HE      HIS   8  34.125  11.851 -30.164
   62    H    GLU   9           H        GLU   9  30.239  17.208 -28.497
   63    HA   GLU   9           HA       GLU   9  28.606  17.500 -26.125
   64   1HB   GLU   9          2HB       GLU   9  30.695  19.100 -27.458
   65   2HB   GLU   9          1HB       GLU   9  29.511  19.966 -26.481
   66   1HG   GLU   9          2HG       GLU   9  29.994  18.249 -24.678
   67   2HG   GLU   9          1HG       GLU   9  31.413  17.819 -25.635
   68    H    ALA  10           H        ALA  10  27.680  19.757 -25.969
   69    HA   ALA  10           HA       ALA  10  25.786  20.914 -26.214
   70   1HB   ALA  10          1HB       ALA  10  25.074  21.609 -28.411
   71   2HB   ALA  10          2HB       ALA  10  26.041  20.336 -29.160
   72   3HB   ALA  10          3HB       ALA  10  26.834  21.664 -28.314
   73    H    VAL  11           H        VAL  11  25.546  18.622 -25.260
   74    HA   VAL  11           HA       VAL  11  23.771  16.820 -26.511
   75    HB   VAL  11           HB       VAL  11  24.218  17.253 -23.582
   76   1HG1  VAL  11          1HG1      VAL  11  22.215  15.935 -24.037
   77   2HG1  VAL  11          2HG1      VAL  11  23.478  14.940 -23.311
   78   3HG1  VAL  11          3HG1      VAL  11  23.163  14.840 -25.043
   79   1HG2  VAL  11          1HG2      VAL  11  26.314  16.829 -24.723
   80   2HG2  VAL  11          2HG2      VAL  11  25.622  15.403 -25.493
   81   3HG2  VAL  11          3HG2      VAL  11  25.856  15.436 -23.747
   82    H    VAL  12           H        VAL  12  23.366  19.749 -24.781
   83    HA   VAL  12           HA       VAL  12  21.638  20.896 -23.922
   84    HB   VAL  12           HB       VAL  12  21.009  20.243 -26.724
   85   1HG1  VAL  12          1HG1      VAL  12  18.895  20.916 -25.687
   86   2HG1  VAL  12          2HG1      VAL  12  19.472  22.190 -26.761
   87   3HG1  VAL  12          3HG1      VAL  12  19.676  22.347 -25.015
   88   1HG2  VAL  12          1HG2      VAL  12  21.883  22.498 -27.145
   89   2HG2  VAL  12          2HG2      VAL  12  23.059  21.444 -26.362
   90   3HG2  VAL  12          3HG2      VAL  12  22.201  22.661 -25.419
   91    H    ARG  13           H        ARG  13  20.855  19.583 -22.346
   92    HA   ARG  13           HA       ARG  13  18.481  18.045 -22.901
   93   1HB   ARG  13          2HB       ARG  13  20.350  18.214 -20.592
   94   2HB   ARG  13          1HB       ARG  13  18.690  17.734 -20.307
   95   1HG   ARG  13          2HG       ARG  13  18.986  15.951 -22.026
   96   2HG   ARG  13          1HG       ARG  13  20.698  16.375 -22.078
   97   1HD   ARG  13          2HD       ARG  13  19.252  15.580 -19.561
   98   2HD   ARG  13          1HD       ARG  13  20.108  14.434 -20.590
   99    HE   ARG  13           HE       ARG  13  22.095  16.032 -20.140
  100   1HH1  ARG  13          1HH1      ARG  13  19.549  15.286 -17.858
  101   2HH1  ARG  13          2HH1      ARG  13  20.577  15.424 -16.464
  102   1HH2  ARG  13          1HH2      ARG  13  23.458  16.198 -18.319
  103   2HH2  ARG  13          2HH2      ARG  13  22.805  15.927 -16.729
  104    H    VAL  14           H        VAL  14  16.714  19.097 -22.961
  105    HA   VAL  14           HA       VAL  14  16.229  21.345 -21.156
  106    HB   VAL  14           HB       VAL  14  14.657  20.806 -23.639
  107   1HG1  VAL  14          1HG1      VAL  14  14.242  23.234 -23.548
  108   2HG1  VAL  14          2HG1      VAL  14  15.175  23.304 -22.051
  109   3HG1  VAL  14          3HG1      VAL  14  13.677  22.375 -22.114
  110   1HG2  VAL  14          1HG2      VAL  14  16.947  20.940 -24.407
  111   2HG2  VAL  14          2HG2      VAL  14  17.192  22.428 -23.494
  112   3HG2  VAL  14          3HG2      VAL  14  16.080  22.407 -24.863
  113    H    GLY  15           H        GLY  15  14.038  21.528 -20.442
  114   1HA   GLY  15          2HA       GLY  15  11.967  20.666 -19.779
  115   2HA   GLY  15          1HA       GLY  15  12.429  19.105 -20.453
  116    H    THR  16           H        THR  16  12.781  21.284 -17.737
  117    HA   THR  16           HA       THR  16  14.515  19.613 -16.275
  118    HB   THR  16           HB       THR  16  12.743  21.808 -15.215
  119    HG1  THR  16           1HG      THR  16  14.969  21.849 -16.848
  120   1HG2  THR  16          1HG2      THR  16  15.344  20.649 -14.237
  121   2HG2  THR  16          2HG2      THR  16  13.760  20.443 -13.488
  122   3HG2  THR  16          3HG2      THR  16  14.518  22.036 -13.531
  123    H    LYS  17           H        LYS  17  11.101  19.954 -16.509
  124    HA   LYS  17           HA       LYS  17  10.761  17.740 -14.669
  125   1HB   LYS  17          2HB       LYS  17   8.259  18.537 -14.812
  126   2HB   LYS  17          1HB       LYS  17   9.417  19.313 -13.750
  127   1HG   LYS  17          2HG       LYS  17   8.238  21.057 -14.758
  128   2HG   LYS  17          1HG       LYS  17   9.794  21.000 -15.587
  129   1HD   LYS  17          2HD       LYS  17   8.445  19.378 -17.183
  130   2HD   LYS  17          1HD       LYS  17   7.084  20.324 -16.572
  131   1HE   LYS  17          2HE       LYS  17   9.581  21.464 -17.780
  132   2HE   LYS  17          1HE       LYS  17   8.067  21.229 -18.658
  133   1HZ   LYS  17          1HZ       LYS  17   7.015  22.703 -16.952
  134   2HZ   LYS  17          2HZ       LYS  17   8.138  23.475 -17.958
  135   3HZ   LYS  17          3HZ       LYS  17   8.570  23.059 -16.372
  136    HA   PRO  18           HA       PRO  18  10.165  15.664 -18.606
  137   1HB   PRO  18          2HB       PRO  18  10.845  13.232 -17.815
  138   2HB   PRO  18          1HB       PRO  18  12.068  14.498 -18.017
  139   1HG   PRO  18          2HG       PRO  18  10.655  13.631 -15.532
  140   2HG   PRO  18          1HG       PRO  18  12.403  13.807 -15.791
  141   1HD   PRO  18          2HD       PRO  18  10.937  15.734 -14.605
  142   2HD   PRO  18          1HD       PRO  18  12.288  16.137 -15.685
  143    H    GLY  19           H        GLY  19   8.203  15.462 -19.130
  144   1HA   GLY  19          2HA       GLY  19   6.239  14.093 -17.425
  145   2HA   GLY  19          1HA       GLY  19   5.885  15.197 -18.740
  146    H    THR  20           H        THR  20   8.059  13.719 -20.144
  147    HA   THR  20           HA       THR  20   6.541  12.274 -21.943
  148    HB   THR  20           HB       THR  20   9.415  11.570 -21.421
  149    HG1  THR  20           1HG      THR  20   8.496  13.943 -22.736
  150   1HG2  THR  20          1HG2      THR  20   7.796  11.978 -23.940
  151   2HG2  THR  20          2HG2      THR  20   8.259  10.428 -23.239
  152   3HG2  THR  20          3HG2      THR  20   9.497  11.510 -23.875
  153    H    GLU  21           H        GLU  21   8.437  11.069 -19.204
  154    HA   GLU  21           HA       GLU  21   6.980   8.558 -19.290
  155   1HB   GLU  21          2HB       GLU  21   9.983   8.806 -19.027
  156   2HB   GLU  21          1HB       GLU  21   9.069   7.315 -18.861
  157   1HG   GLU  21          2HG       GLU  21   8.443   7.388 -21.179
  158   2HG   GLU  21          1HG       GLU  21   9.207   8.967 -21.369
  159    H    VAL  22           H        VAL  22   6.518   7.782 -17.295
  160    HA   VAL  22           HA       VAL  22   7.398   9.288 -14.969
  161    HB   VAL  22           HB       VAL  22   5.637   6.821 -15.062
  162   1HG1  VAL  22          1HG1      VAL  22   6.674   7.179 -12.890
  163   2HG1  VAL  22          2HG1      VAL  22   4.945   7.518 -12.815
  164   3HG1  VAL  22          3HG1      VAL  22   6.102   8.847 -12.876
  165   1HG2  VAL  22          1HG2      VAL  22   4.607   8.642 -16.305
  166   2HG2  VAL  22          2HG2      VAL  22   4.865   9.737 -14.947
  167   3HG2  VAL  22          3HG2      VAL  22   3.753   8.378 -14.783
  168    HA   PRO  23           HA       PRO  23  10.938   6.545 -14.910
  169   1HB   PRO  23          2HB       PRO  23  11.577   8.069 -12.466
  170   2HB   PRO  23          1HB       PRO  23  12.545   7.819 -13.922
  171   1HG   PRO  23          2HG       PRO  23  11.379  10.174 -13.399
  172   2HG   PRO  23          1HG       PRO  23  11.531   9.553 -15.055
  173   1HD   PRO  23          2HD       PRO  23   9.161   9.599 -13.247
  174   2HD   PRO  23          1HD       PRO  23   9.255   9.877 -14.994
  175    HA   PRO  24           HA       PRO  24   9.462   3.552 -11.867
  176   1HB   PRO  24          2HB       PRO  24  11.785   2.034 -12.089
  177   2HB   PRO  24          1HB       PRO  24  10.324   1.809 -13.055
  178   1HG   PRO  24          2HG       PRO  24  12.822   3.313 -13.719
  179   2HG   PRO  24          1HG       PRO  24  11.835   2.259 -14.753
  180   1HD   PRO  24          2HD       PRO  24  11.625   4.892 -14.977
  181   2HD   PRO  24          1HD       PRO  24  10.168   3.877 -15.005
  182    H    VAL  25           H        VAL  25   9.924   3.341  -9.747
  183    HA   VAL  25           HA       VAL  25  11.700   5.345  -8.716
  184    HB   VAL  25           HB       VAL  25   9.839   3.509  -7.163
  185   1HG1  VAL  25          1HG1      VAL  25  10.099   5.243  -5.419
  186   2HG1  VAL  25          2HG1      VAL  25  11.258   6.098  -6.438
  187   3HG1  VAL  25          3HG1      VAL  25  11.647   4.494  -5.814
  188   1HG2  VAL  25          1HG2      VAL  25   9.431   6.336  -8.163
  189   2HG2  VAL  25          2HG2      VAL  25   8.329   5.426  -7.130
  190   3HG2  VAL  25          3HG2      VAL  25   8.634   4.891  -8.783
  191    H    ILE  26           H        ILE  26  13.569   5.083  -7.773
  192    HA   ILE  26           HA       ILE  26  14.951   2.667  -8.405
  193    HB   ILE  26           HB       ILE  26  15.888   5.273  -7.219
  194   1HG1  ILE  26          2HG1      ILE  26  17.123   5.329  -9.476
  195   2HG1  ILE  26          1HG1      ILE  26  16.025   4.042  -9.962
  196   1HG2  ILE  26          1HG2      ILE  26  17.343   3.527  -6.391
  197   2HG2  ILE  26          2HG2      ILE  26  18.183   4.500  -7.599
  198   3HG2  ILE  26          3HG2      ILE  26  17.562   2.905  -8.026
  199   1HD1  ILE  26          1HD1      ILE  26  15.269   6.233 -10.714
  200   2HD1  ILE  26          2HD1      ILE  26  15.201   6.783  -9.040
  201   3HD1  ILE  26          3HD1      ILE  26  14.125   5.499  -9.590
  202    H    ASP  27           H        ASP  27  13.820   4.100  -5.450
  203    HA   ASP  27           HA       ASP  27  15.527   2.460  -3.805
  204   1HB   ASP  27          2HB       ASP  27  13.493   4.579  -3.155
  205   2HB   ASP  27          1HB       ASP  27  14.225   3.570  -1.913
  206    H    GLY  28           H        GLY  28  13.017   1.830  -5.551
  207   1HA   GLY  28          2HA       GLY  28  11.213   0.480  -3.870
  208   2HA   GLY  28          1HA       GLY  28  11.477   0.139  -5.578
  209    H    SER  29           H        SER  29  14.425  -0.057  -4.558
  210    HA   SER  29           HA       SER  29  14.492  -2.910  -4.316
  211   1HB   SER  29          2HB       SER  29  16.674  -0.982  -3.569
  212   2HB   SER  29          1HB       SER  29  16.852  -2.660  -4.079
  213    HG   SER  29           HG       SER  29  16.201  -2.080  -6.153
  214    H    ILE  30           H        ILE  30  14.884  -0.212  -2.147
  215    HA   ILE  30           HA       ILE  30  15.334  -1.728   0.230
  216    HB   ILE  30           HB       ILE  30  14.017   0.885   0.629
  217   1HG1  ILE  30          2HG1      ILE  30  15.230   1.410  -1.470
  218   2HG1  ILE  30          1HG1      ILE  30  15.892   2.270  -0.088
  219   1HG2  ILE  30          1HG2      ILE  30  16.625  -0.278   1.568
  220   2HG2  ILE  30          2HG2      ILE  30  15.084  -0.295   2.425
  221   3HG2  ILE  30          3HG2      ILE  30  15.913   1.235   2.133
  222   1HD1  ILE  30          1HD1      ILE  30  17.726   0.676   0.036
  223   2HD1  ILE  30          2HD1      ILE  30  17.644   1.455  -1.546
  224   3HD1  ILE  30          3HD1      ILE  30  17.062  -0.197  -1.345
  225    H    TRP  31           H        TRP  31  12.620  -0.346  -1.437
  226    HA   TRP  31           HA       TRP  31  10.707  -0.779   0.601
  227   1HB   TRP  31          2HB       TRP  31  10.406  -0.246  -2.364
  228   2HB   TRP  31          1HB       TRP  31   9.050  -0.347  -1.246
  229    HD1  TRP  31           HD       TRP  31  10.923   2.225  -2.829
  230    HE1  TRP  31           1HE      TRP  31  10.948   4.425  -1.458
  231    HE3  TRP  31           3HE      TRP  31   9.491   0.353   1.642
  232    HZ2  TRP  31           2HZ      TRP  31  10.453   5.205   1.175
  233    HZ3  TRP  31           3HZ      TRP  31   9.310   1.866   3.563
  234    HH2  TRP  31           HH       TRP  31   9.785   4.245   3.336
  235    H    ASP  32           H        ASP  32  11.842  -2.668  -2.135
  236    HA   ASP  32           HA       ASP  32   9.866  -4.698  -1.893
  237   1HB   ASP  32          2HB       ASP  32  10.902  -4.624  -3.998
  238   2HB   ASP  32          1HB       ASP  32  12.522  -4.492  -3.287
  239    H    ALA  33           H        ALA  33  13.174  -4.264  -0.681
  240    HA   ALA  33           HA       ALA  33  13.333  -6.819   0.485
  241   1HB   ALA  33          1HB       ALA  33  15.323  -5.520  -0.026
  242   2HB   ALA  33          2HB       ALA  33  15.281  -5.957   1.684
  243   3HB   ALA  33          3HB       ALA  33  14.860  -4.320   1.181
  244    H    ILE  34           H        ILE  34  12.198  -3.692   1.652
  245    HA   ILE  34           HA       ILE  34  11.661  -4.465   4.321
  246    HB   ILE  34           HB       ILE  34  10.306  -2.444   2.545
  247   1HG1  ILE  34          2HG1      ILE  34  12.272  -2.146   4.827
  248   2HG1  ILE  34          1HG1      ILE  34  12.649  -1.968   3.118
  249   1HG2  ILE  34          1HG2      ILE  34   9.930  -2.857   5.512
  250   2HG2  ILE  34          2HG2      ILE  34   8.729  -3.175   4.260
  251   3HG2  ILE  34          3HG2      ILE  34   9.269  -1.524   4.567
  252   1HD1  ILE  34          1HD1      ILE  34  12.442   0.186   4.211
  253   2HD1  ILE  34          2HD1      ILE  34  10.798  -0.212   4.710
  254   3HD1  ILE  34          3HD1      ILE  34  11.180  -0.026   2.997
  255    H    ALA  35           H        ALA  35   9.662  -4.516   1.386
  256    HA   ALA  35           HA       ALA  35   7.360  -5.675   2.456
  257   1HB   ALA  35          1HB       ALA  35   8.536  -6.070  -0.295
  258   2HB   ALA  35          2HB       ALA  35   7.479  -4.745   0.194
  259   3HB   ALA  35          3HB       ALA  35   6.871  -6.401   0.179
  260    H    GLY  36           H        GLY  36  10.354  -7.092   1.290
  261   1HA   GLY  36          2HA       GLY  36   9.555  -9.811   1.433
  262   2HA   GLY  36          1HA       GLY  36  11.213  -9.228   1.455
  263    H    CYS  37           H        CYS  37  10.671  -7.559   3.806
  264    HA   CYS  37           HA       CYS  37  11.343  -9.503   5.780
  265   1HB   CYS  37          2HB       CYS  37  12.501  -7.461   5.933
  266   2HB   CYS  37          1HB       CYS  37  11.024  -6.516   5.785
  267    H    GLU  38           H        GLU  38   8.712  -7.091   5.649
  268    HA   GLU  38           HA       GLU  38   7.553  -8.357   7.995
  269   1HB   GLU  38          2HB       GLU  38   7.874  -5.849   7.732
  270   2HB   GLU  38          1HB       GLU  38   6.566  -5.897   6.559
  271   1HG   GLU  38          2HG       GLU  38   5.693  -5.209   8.674
  272   2HG   GLU  38          1HG       GLU  38   5.087  -6.825   8.311
  273    H    ALA  39           H        ALA  39   6.948  -7.965   4.586
  274    HA   ALA  39           HA       ALA  39   4.247  -8.987   4.893
  275   1HB   ALA  39          1HB       ALA  39   4.498  -6.994   3.527
  276   2HB   ALA  39          2HB       ALA  39   3.888  -8.348   2.574
  277   3HB   ALA  39          3HB       ALA  39   5.581  -7.871   2.448
  278    H    GLY  40           H        GLY  40   7.304 -10.161   4.300
  279   1HA   GLY  40          2HA       GLY  40   7.959 -12.339   3.814
  280   2HA   GLY  40          1HA       GLY  40   6.267 -12.742   3.514
  281    H    GLY  41           H        GLY  41   7.405  -9.943   2.064
  282   1HA   GLY  41          2HA       GLY  41   7.841  -9.326  -0.060
  283   2HA   GLY  41          1HA       GLY  41   8.402 -10.970  -0.377
  284    H    ASN  42           H        ASN  42   5.318  -9.310   0.323
  285    HA   ASN  42           HA       ASN  42   4.218 -10.392  -2.122
  286   1HB   ASN  42          2HB       ASN  42   3.701 -12.106  -0.359
  287   2HB   ASN  42          1HB       ASN  42   2.804 -10.851   0.505
  288   1HD2  ASN  42          1HD2      ASN  42   0.874 -12.029   0.276
  289   2HD2  ASN  42          2HD2      ASN  42   0.032 -12.086  -1.231
  290    H    TRP  43           H        TRP  43   3.127  -8.900  -3.059
  291    HA   TRP  43           HA       TRP  43   2.622  -6.425  -1.570
  292   1HB   TRP  43          2HB       TRP  43   2.679  -6.936  -4.537
  293   2HB   TRP  43          1HB       TRP  43   2.600  -5.362  -3.755
  294    HD1  TRP  43           HD       TRP  43   5.010  -8.377  -3.996
  295    HE1  TRP  43           1HE      TRP  43   7.420  -7.492  -3.890
  296    HE3  TRP  43           3HE      TRP  43   3.998  -3.442  -3.210
  297    HZ2  TRP  43           2HZ      TRP  43   8.730  -4.999  -3.517
  298    HZ3  TRP  43           3HZ      TRP  43   5.860  -1.858  -3.006
  299    HH2  TRP  43           HH       TRP  43   8.195  -2.649  -3.168
  300    H    ALA  44           H        ALA  44   1.057  -9.108  -2.596
  301    HA   ALA  44           HA       ALA  44  -1.509  -7.717  -2.996
  302   1HB   ALA  44          1HB       ALA  44  -0.817  -9.122  -4.872
  303   2HB   ALA  44          2HB       ALA  44  -2.286  -9.737  -4.113
  304   3HB   ALA  44          3HB       ALA  44  -0.735 -10.518  -3.798
  305    H    ILE  45           H        ILE  45   0.091  -8.874  -0.510
  306    HA   ILE  45           HA       ILE  45  -1.691 -10.759   0.622
  307    HB   ILE  45           HB       ILE  45   0.849 -10.124   1.203
  308   1HG1  ILE  45          2HG1      ILE  45  -1.152 -11.160   3.216
  309   2HG1  ILE  45          1HG1      ILE  45  -0.399 -12.111   1.940
  310   1HG2  ILE  45          1HG2      ILE  45   0.987  -8.997   3.374
  311   2HG2  ILE  45          2HG2      ILE  45  -0.743  -8.658   3.305
  312   3HG2  ILE  45          3HG2      ILE  45   0.347  -7.929   2.126
  313   1HD1  ILE  45          1HD1      ILE  45   1.006 -10.812   4.263
  314   2HD1  ILE  45          2HD1      ILE  45   1.793 -11.709   2.962
  315   3HD1  ILE  45          3HD1      ILE  45   0.682 -12.534   4.053
  316    H    ASN  46           H        ASN  46  -3.269 -10.440   2.161
  317    HA   ASN  46           HA       ASN  46  -3.973  -7.840   3.129
  318   1HB   ASN  46          2HB       ASN  46  -4.683  -7.778   0.698
  319   2HB   ASN  46          1HB       ASN  46  -5.830  -9.059   1.073
  320   1HD2  ASN  46          1HD2      ASN  46  -6.202  -6.311   0.133
  321   2HD2  ASN  46          2HD2      ASN  46  -7.293  -5.579   1.268
  322    H    THR  47           H        THR  47  -4.140  -8.784   5.122
  323    HA   THR  47           HA       THR  47  -5.741 -11.141   5.509
  324    HB   THR  47           HB       THR  47  -5.276 -10.663   7.968
  325    HG1  THR  47           1HG      THR  47  -3.484  -9.183   8.263
  326   1HG2  THR  47          1HG2      THR  47  -4.001 -12.297   6.677
  327   2HG2  THR  47          2HG2      THR  47  -2.949 -11.436   7.800
  328   3HG2  THR  47          3HG2      THR  47  -2.938 -11.018   6.087
  329    H    GLY  48           H        GLY  48  -6.354  -7.833   5.310
  330   1HA   GLY  48          2HA       GLY  48  -8.482  -6.867   5.311
  331   2HA   GLY  48          1HA       GLY  48  -9.087  -8.255   6.209
  332    H    ASN  49           H        ASN  49  -6.176  -6.727   7.240
  333    HA   ASN  49           HA       ASN  49  -7.482  -6.098   9.742
  334   1HB   ASN  49          2HB       ASN  49  -5.301  -5.921  10.709
  335   2HB   ASN  49          1HB       ASN  49  -5.280  -7.325   9.647
  336   1HD2  ASN  49          1HD2      ASN  49  -4.073  -7.251   7.739
  337   2HD2  ASN  49          2HD2      ASN  49  -2.877  -6.028   7.465
  338    H    GLY  50           H        GLY  50  -7.329  -4.496   7.019
  339   1HA   GLY  50          2HA       GLY  50  -7.943  -2.235   6.756
  340   2HA   GLY  50          1HA       GLY  50  -7.252  -1.888   8.336
  341    H    TYR  51           H        TYR  51  -4.895  -3.635   7.275
  342    HA   TYR  51           HA       TYR  51  -3.666  -1.548   5.627
  343   1HB   TYR  51          2HB       TYR  51  -2.074  -3.642   7.089
  344   2HB   TYR  51          1HB       TYR  51  -1.512  -2.164   6.372
  345    HD1  TYR  51           1HD      TYR  51  -4.447  -1.415   8.233
  346    HD2  TYR  51           2HD      TYR  51  -0.289  -2.246   8.665
  347    HE1  TYR  51           1HE      TYR  51  -4.451  -0.310  10.433
  348    HE2  TYR  51           2HE      TYR  51  -0.291  -1.134  10.856
  349    HH   TYR  51           HH       TYR  51  -3.073  -0.390  12.549
  350    H    TYR  52           H        TYR  52  -2.050  -2.447   4.076
  351    HA   TYR  52           HA       TYR  52  -3.181  -4.868   2.867
  352   1HB   TYR  52          2HB       TYR  52  -2.474  -2.293   1.449
  353   2HB   TYR  52          1HB       TYR  52  -3.139  -3.742   0.693
  354    HD1  TYR  52           1HD      TYR  52  -3.875  -1.044   3.129
  355    HD2  TYR  52           2HD      TYR  52  -5.466  -4.146   0.704
  356    HE1  TYR  52           1HE      TYR  52  -6.137  -0.244   3.628
  357    HE2  TYR  52           2HE      TYR  52  -7.744  -3.370   1.194
  358    HH   TYR  52           HH       TYR  52  -8.435  -0.389   2.550
  359    H    GLY  53           H        GLY  53  -1.736  -5.546   0.935
  360   1HA   GLY  53          2HA       GLY  53   0.660  -6.364   2.201
  361   2HA   GLY  53          1HA       GLY  53   0.160  -6.766   0.570
  362    H    GLY  54           H        GLY  54   2.579  -6.604   0.445
  363   1HA   GLY  54          2HA       GLY  54   4.225  -5.513  -0.755
  364   2HA   GLY  54          1HA       GLY  54   3.216  -4.073  -0.805
  365    H    VAL  55           H        VAL  55   3.778  -2.412   0.436
  366    HA   VAL  55           HA       VAL  55   6.016  -2.788   2.283
  367    HB   VAL  55           HB       VAL  55   4.830  -0.103   1.752
  368   1HG1  VAL  55          1HG1      VAL  55   7.116   0.631   1.976
  369   2HG1  VAL  55          2HG1      VAL  55   7.679  -1.040   2.026
  370   3HG1  VAL  55          3HG1      VAL  55   6.690  -0.406   3.339
  371   1HG2  VAL  55          1HG2      VAL  55   6.187   0.131  -0.277
  372   2HG2  VAL  55          2HG2      VAL  55   4.936  -1.097  -0.467
  373   3HG2  VAL  55          3HG2      VAL  55   6.610  -1.578  -0.186
  374    H    GLN  56           H        GLN  56   3.049  -3.431   2.705
  375    HA   GLN  56           HA       GLN  56   1.732  -3.706   4.532
  376   1HB   GLN  56          2HB       GLN  56   4.036  -2.681   6.189
  377   2HB   GLN  56          1HB       GLN  56   2.731  -3.737   6.707
  378   1HG   GLN  56          2HG       GLN  56   4.242  -5.356   6.406
  379   2HG   GLN  56          1HG       GLN  56   3.797  -5.206   4.706
  380   1HE2  GLN  56          1HE2      GLN  56   5.797  -5.846   3.941
  381   2HE2  GLN  56          2HE2      GLN  56   7.212  -4.868   4.097
  382    H    PHE  57           H        PHE  57   1.156  -1.472   3.236
  383    HA   PHE  57           HA       PHE  57   1.070   0.846   4.946
  384   1HB   PHE  57          2HB       PHE  57  -0.158   0.096   2.330
  385   2HB   PHE  57          1HB       PHE  57  -0.591   1.594   3.143
  386    HD1  PHE  57           1HD      PHE  57   1.949  -0.143   1.234
  387    HD2  PHE  57           2HD      PHE  57   1.035   3.364   3.471
  388    HE1  PHE  57           1HE      PHE  57   3.886   0.987   0.237
  389    HE2  PHE  57           2HE      PHE  57   2.978   4.504   2.476
  390    HZ   PHE  57           HZ       PHE  57   4.400   3.320   0.846
  391    H    ASP  58           H        ASP  58  -0.531   1.398   6.338
  392    HA   ASP  58           HA       ASP  58  -3.017  -0.050   6.349
  393   1HB   ASP  58          2HB       ASP  58  -3.765   1.664   7.968
  394   2HB   ASP  58          1HB       ASP  58  -2.261   0.888   8.455
  395    H    GLN  59           H        GLN  59  -5.097   0.977   5.838
  396    HA   GLN  59           HA       GLN  59  -5.150   2.080   3.306
  397   1HB   GLN  59          2HB       GLN  59  -7.042   0.978   4.515
  398   2HB   GLN  59          1HB       GLN  59  -7.210   2.432   5.488
  399   1HG   GLN  59          2HG       GLN  59  -8.833   2.560   3.800
  400   2HG   GLN  59          1HG       GLN  59  -7.564   3.700   3.372
  401   1HE2  GLN  59          1HE2      GLN  59  -6.168   3.191   1.632
  402   2HE2  GLN  59          2HE2      GLN  59  -6.622   2.031   0.416
  403    H    GLY  60           H        GLY  60  -4.943   3.570   6.425
  404   1HA   GLY  60          2HA       GLY  60  -5.798   6.180   5.696
  405   2HA   GLY  60          1HA       GLY  60  -4.980   5.735   7.183
  406    H    THR  61           H        THR  61  -2.556   4.842   6.364
  407    HA   THR  61           HA       THR  61  -1.201   7.256   5.799
  408    HB   THR  61           HB       THR  61  -0.241   4.426   5.808
  409    HG1  THR  61           1HG      THR  61  -0.524   4.703   7.867
  410   1HG2  THR  61          1HG2      THR  61   1.326   5.810   4.545
  411   2HG2  THR  61          2HG2      THR  61   2.032   5.365   6.100
  412   3HG2  THR  61          3HG2      THR  61   1.370   6.984   5.862
  413    H    TRP  62           H        TRP  62  -1.974   4.407   3.903
  414    HA   TRP  62           HA       TRP  62  -0.624   5.013   1.543
  415   1HB   TRP  62          2HB       TRP  62  -1.688   2.859   1.988
  416   2HB   TRP  62          1HB       TRP  62  -3.271   3.634   2.012
  417    HD1  TRP  62           HD       TRP  62  -4.370   4.255  -0.316
  418    HE1  TRP  62           1HE      TRP  62  -3.870   3.499  -2.716
  419    HE3  TRP  62           3HE      TRP  62   0.259   2.231   0.428
  420    HZ2  TRP  62           2HZ      TRP  62  -1.768   2.201  -4.135
  421    HZ3  TRP  62           3HZ      TRP  62   1.451   1.259  -1.484
  422    HH2  TRP  62           HH       TRP  62   0.485   1.233  -3.713
  423    H    GLU  63           H        GLU  63  -3.896   5.781   2.633
  424    HA   GLU  63           HA       GLU  63  -4.612   7.253   0.336
  425   1HB   GLU  63          2HB       GLU  63  -6.269   6.257   1.816
  426   2HB   GLU  63          1HB       GLU  63  -5.751   7.290   3.141
  427   1HG   GLU  63          2HG       GLU  63  -6.487   9.257   1.871
  428   2HG   GLU  63          1HG       GLU  63  -7.029   8.199   0.569
  429    H    ALA  64           H        ALA  64  -3.082   8.071   3.381
  430    HA   ALA  64           HA       ALA  64  -3.403  10.870   3.301
  431   1HB   ALA  64          1HB       ALA  64  -2.720   9.640   5.318
  432   2HB   ALA  64          2HB       ALA  64  -1.615  10.964   4.942
  433   3HB   ALA  64          3HB       ALA  64  -1.159   9.300   4.570
  434    H    ASN  65           H        ASN  65  -0.835   8.756   2.083
  435    HA   ASN  65           HA       ASN  65   0.714  10.891   0.977
  436   1HB   ASN  65          2HB       ASN  65   0.735   7.994   0.121
  437   2HB   ASN  65          1HB       ASN  65   2.025   9.174  -0.072
  438   1HD2  ASN  65          1HD2      ASN  65   1.739  10.278   2.603
  439   2HD2  ASN  65          2HD2      ASN  65   2.392   9.081   3.677
  440    H    GLY  66           H        GLY  66  -2.099   9.226   0.060
  441   1HA   GLY  66          2HA       GLY  66  -3.539   9.816  -1.692
  442   2HA   GLY  66          1HA       GLY  66  -2.214  10.676  -2.467
  443    H    GLY  67           H        GLY  67  -2.560   7.317  -1.326
  444   1HA   GLY  67          2HA       GLY  67  -1.022   6.424  -3.592
  445   2HA   GLY  67          1HA       GLY  67  -1.645   5.427  -2.285
  446    H    LEU  68           H        LEU  68  -4.295   6.879  -2.948
  447    HA   LEU  68           HA       LEU  68  -5.489   4.733  -4.184
  448   1HB   LEU  68          2HB       LEU  68  -6.304   7.544  -3.758
  449   2HB   LEU  68          1HB       LEU  68  -7.396   6.398  -4.507
  450    HG   LEU  68           HG       LEU  68  -6.992   4.989  -2.382
  451   1HD1  LEU  68          1HD1      LEU  68  -6.100   7.690  -1.418
  452   2HD1  LEU  68          2HD1      LEU  68  -5.150   6.204  -1.460
  453   3HD1  LEU  68          3HD1      LEU  68  -6.532   6.334  -0.374
  454   1HD2  LEU  68          1HD2      LEU  68  -8.578   7.550  -2.277
  455   2HD2  LEU  68          2HD2      LEU  68  -8.804   6.161  -1.212
  456   3HD2  LEU  68          3HD2      LEU  68  -9.121   6.008  -2.941
  457    H    ARG  69           H        ARG  69  -4.083   7.601  -5.586
  458    HA   ARG  69           HA       ARG  69  -5.209   7.406  -8.167
  459   1HB   ARG  69          2HB       ARG  69  -3.204   8.728  -8.855
  460   2HB   ARG  69          1HB       ARG  69  -4.063   9.415  -7.480
  461   1HG   ARG  69          2HG       ARG  69  -2.446   8.521  -5.958
  462   2HG   ARG  69          1HG       ARG  69  -1.623   7.683  -7.270
  463   1HD   ARG  69          2HD       ARG  69  -1.943  10.674  -7.147
  464   2HD   ARG  69          1HD       ARG  69  -0.550   9.811  -6.489
  465    HE   ARG  69           HE       ARG  69  -0.841   8.976  -9.122
  466   1HH1  ARG  69          1HH1      ARG  69  -0.251  11.996  -7.444
  467   2HH1  ARG  69          2HH1      ARG  69   0.786  12.632  -8.685
  468   1HH2  ARG  69          1HH2      ARG  69   0.519   9.822 -10.771
  469   2HH2  ARG  69          2HH2      ARG  69   1.206  11.408 -10.576
  470    H    TYR  70           H        TYR  70  -2.560   5.853  -6.543
  471    HA   TYR  70           HA       TYR  70  -1.457   4.537  -8.845
  472   1HB   TYR  70          2HB       TYR  70  -1.252   4.093  -5.860
  473   2HB   TYR  70          1HB       TYR  70  -0.178   3.347  -7.058
  474    HD1  TYR  70           1HD      TYR  70  -0.877   6.161  -5.005
  475    HD2  TYR  70           2HD      TYR  70   1.349   4.921  -8.398
  476    HE1  TYR  70           1HE      TYR  70   0.576   8.117  -4.751
  477    HE2  TYR  70           2HE      TYR  70   2.819   6.879  -8.160
  478    HH   TYR  70           HH       TYR  70   2.863   8.817  -5.374
  479    H    ALA  71           H        ALA  71  -3.652   4.048  -6.274
  480    HA   ALA  71           HA       ALA  71  -5.543   2.423  -7.257
  481   1HB   ALA  71          1HB       ALA  71  -3.407   0.654  -6.040
  482   2HB   ALA  71          2HB       ALA  71  -3.853   0.682  -7.745
  483   3HB   ALA  71          3HB       ALA  71  -5.019   0.140  -6.538
  484    HA   PRO  72           HA       PRO  72  -6.713   3.870  -3.258
  485   1HB   PRO  72          2HB       PRO  72  -8.914   1.990  -3.330
  486   2HB   PRO  72          1HB       PRO  72  -8.930   3.743  -3.265
  487   1HG   PRO  72          2HG       PRO  72  -9.594   2.286  -5.484
  488   2HG   PRO  72          1HG       PRO  72  -9.011   3.957  -5.522
  489   1HD   PRO  72          2HD       PRO  72  -7.632   1.464  -6.263
  490   2HD   PRO  72          1HD       PRO  72  -7.313   3.135  -6.771
  491    H    ARG  73           H        ARG  73  -5.717   0.747  -3.909
  492    HA   ARG  73           HA       ARG  73  -5.211   0.311  -1.072
  493   1HB   ARG  73          2HB       ARG  73  -5.992  -1.987  -1.089
  494   2HB   ARG  73          1HB       ARG  73  -7.317  -0.938  -1.581
  495   1HG   ARG  73          2HG       ARG  73  -6.636  -1.434  -3.951
  496   2HG   ARG  73          1HG       ARG  73  -5.612  -2.704  -3.280
  497   1HD   ARG  73          2HD       ARG  73  -8.547  -2.555  -2.646
  498   2HD   ARG  73          1HD       ARG  73  -7.965  -3.327  -4.119
  499    HE   ARG  73           HE       ARG  73  -6.535  -4.436  -2.014
  500   1HH1  ARG  73          1HH1      ARG  73  -9.922  -4.191  -2.932
  501   2HH1  ARG  73          2HH1      ARG  73 -10.293  -5.827  -2.456
  502   1HH2  ARG  73          1HH2      ARG  73  -7.044  -6.579  -1.403
  503   2HH2  ARG  73          2HH2      ARG  73  -8.688  -7.152  -1.531
  504    H    ALA  74           H        ALA  74  -3.289  -0.543  -0.736
  505    HA   ALA  74           HA       ALA  74  -1.274  -0.428  -2.604
  506   1HB   ALA  74          1HB       ALA  74   0.158  -1.416  -0.948
  507   2HB   ALA  74          2HB       ALA  74  -1.229  -2.068  -0.079
  508   3HB   ALA  74          3HB       ALA  74  -0.973  -0.324  -0.151
  509    H    ASP  75           H        ASP  75  -3.332  -3.143  -1.799
  510    HA   ASP  75           HA       ASP  75  -1.557  -4.993  -3.146
  511   1HB   ASP  75          2HB       ASP  75  -3.162  -6.732  -2.477
  512   2HB   ASP  75          1HB       ASP  75  -2.584  -5.794  -1.108
  513    H    LEU  76           H        LEU  76  -3.533  -2.796  -4.272
  514    HA   LEU  76           HA       LEU  76  -4.307  -4.445  -6.586
  515   1HB   LEU  76          2HB       LEU  76  -6.139  -3.155  -5.558
  516   2HB   LEU  76          1HB       LEU  76  -5.227  -1.676  -5.793
  517    HG   LEU  76           HG       LEU  76  -5.358  -2.015  -8.244
  518   1HD1  LEU  76          1HD1      LEU  76  -6.903  -3.673  -9.144
  519   2HD1  LEU  76          2HD1      LEU  76  -7.184  -4.302  -7.520
  520   3HD1  LEU  76          3HD1      LEU  76  -5.587  -4.443  -8.255
  521   1HD2  LEU  76          1HD2      LEU  76  -8.008  -1.987  -6.804
  522   2HD2  LEU  76          2HD2      LEU  76  -7.727  -1.438  -8.458
  523   3HD2  LEU  76          3HD2      LEU  76  -6.972  -0.591  -7.107
  524    H    ALA  77           H        ALA  77  -2.554  -1.653  -5.457
  525    HA   ALA  77           HA       ALA  77  -1.446  -0.969  -8.009
  526   1HB   ALA  77          1HB       ALA  77  -0.660  -0.152  -5.211
  527   2HB   ALA  77          2HB       ALA  77  -1.757   0.726  -6.278
  528   3HB   ALA  77          3HB       ALA  77  -0.052   0.569  -6.701
  529    H    THR  78           H        THR  78   0.954  -1.028  -8.318
  530    HA   THR  78           HA       THR  78   1.906  -3.646  -7.423
  531    HB   THR  78           HB       THR  78   3.401  -3.611  -9.301
  532    HG1  THR  78           1HG      THR  78   2.451  -0.952  -9.816
  533   1HG2  THR  78          1HG2      THR  78   0.642  -2.609  -9.991
  534   2HG2  THR  78          2HG2      THR  78   1.154  -4.289  -9.827
  535   3HG2  THR  78          3HG2      THR  78   1.760  -3.308 -11.165
  536    H    ARG  79           H        ARG  79   4.541  -3.470  -7.649
  537    HA   ARG  79           HA       ARG  79   5.408  -2.534  -5.228
  538   1HB   ARG  79          2HB       ARG  79   7.162  -2.649  -7.679
  539   2HB   ARG  79          1HB       ARG  79   7.647  -2.859  -6.002
  540   1HG   ARG  79          2HG       ARG  79   6.521  -4.959  -5.874
  541   2HG   ARG  79          1HG       ARG  79   5.819  -4.732  -7.479
  542   1HD   ARG  79          2HD       ARG  79   7.582  -5.974  -8.123
  543   2HD   ARG  79          1HD       ARG  79   8.410  -4.421  -8.066
  544    HE   ARG  79           HE       ARG  79   8.666  -5.522  -5.542
  545   1HH1  ARG  79          1HH1      ARG  79   9.667  -6.117  -8.854
  546   2HH1  ARG  79          2HH1      ARG  79  11.003  -7.138  -8.403
  547   1HH2  ARG  79          1HH2      ARG  79  10.441  -6.934  -4.968
  548   2HH2  ARG  79          2HH2      ARG  79  11.429  -7.597  -6.240
  549    H    GLU  80           H        GLU  80   5.814  -0.957  -8.387
  550    HA   GLU  80           HA       GLU  80   7.336   1.177  -7.418
  551   1HB   GLU  80          2HB       GLU  80   6.800   2.229  -9.618
  552   2HB   GLU  80          1HB       GLU  80   7.437   0.594  -9.716
  553   1HG   GLU  80          2HG       GLU  80   5.045  -0.191  -9.904
  554   2HG   GLU  80          1HG       GLU  80   4.611   1.504 -10.128
  555    H    GLU  81           H        GLU  81   3.859   0.991  -8.083
  556    HA   GLU  81           HA       GLU  81   3.105   3.518  -7.269
  557   1HB   GLU  81          2HB       GLU  81   1.734   0.856  -7.089
  558   2HB   GLU  81          1HB       GLU  81   0.965   2.331  -6.529
  559   1HG   GLU  81          2HG       GLU  81   0.142   2.168  -8.617
  560   2HG   GLU  81          1HG       GLU  81   1.524   3.203  -8.907
  561    H    GLN  82           H        GLN  82   3.305   0.552  -5.263
  562    HA   GLN  82           HA       GLN  82   2.566   1.760  -2.833
  563   1HB   GLN  82          2HB       GLN  82   4.453  -0.559  -3.264
  564   2HB   GLN  82          1HB       GLN  82   3.734  -0.111  -1.729
  565   1HG   GLN  82          2HG       GLN  82   1.493  -0.433  -3.045
  566   2HG   GLN  82          1HG       GLN  82   2.511  -1.439  -4.083
  567   1HE2  GLN  82          1HE2      GLN  82   1.648  -3.394  -3.485
  568   2HE2  GLN  82          2HE2      GLN  82   1.793  -4.043  -1.880
  569    H    ILE  83           H        ILE  83   5.603   1.355  -4.439
  570    HA   ILE  83           HA       ILE  83   7.342   2.267  -2.460
  571    HB   ILE  83           HB       ILE  83   7.506   2.205  -5.460
  572   1HG1  ILE  83          2HG1      ILE  83   9.248   0.713  -3.529
  573   2HG1  ILE  83          1HG1      ILE  83   7.630   0.123  -3.878
  574   1HG2  ILE  83          1HG2      ILE  83   9.949   2.673  -5.139
  575   2HG2  ILE  83          2HG2      ILE  83   9.545   3.204  -3.505
  576   3HG2  ILE  83          3HG2      ILE  83   8.865   4.042  -4.896
  577   1HD1  ILE  83          1HD1      ILE  83   9.300  -0.971  -5.261
  578   2HD1  ILE  83          2HD1      ILE  83   9.808   0.592  -5.897
  579   3HD1  ILE  83          3HD1      ILE  83   8.190  -0.018  -6.245
  580    H    ALA  84           H        ALA  84   5.607   4.020  -5.031
  581    HA   ALA  84           HA       ALA  84   6.824   6.532  -4.520
  582   1HB   ALA  84          1HB       ALA  84   5.714   5.973  -6.636
  583   2HB   ALA  84          2HB       ALA  84   5.072   7.455  -5.927
  584   3HB   ALA  84          3HB       ALA  84   4.158   5.952  -5.808
  585    H    VAL  85           H        VAL  85   3.922   4.963  -3.317
  586    HA   VAL  85           HA       VAL  85   2.934   7.106  -1.770
  587    HB   VAL  85           HB       VAL  85   2.690   4.130  -1.339
  588   1HG1  VAL  85          1HG1      VAL  85   0.979   6.398  -0.319
  589   2HG1  VAL  85          2HG1      VAL  85   2.044   5.379   0.650
  590   3HG1  VAL  85          3HG1      VAL  85   0.622   4.683  -0.126
  591   1HG2  VAL  85          1HG2      VAL  85   1.942   4.808  -3.553
  592   2HG2  VAL  85          2HG2      VAL  85   0.893   6.031  -2.833
  593   3HG2  VAL  85          3HG2      VAL  85   0.576   4.318  -2.549
  594    H    ALA  86           H        ALA  86   4.960   4.298  -0.914
  595    HA   ALA  86           HA       ALA  86   5.636   5.017   1.684
  596   1HB   ALA  86          1HB       ALA  86   7.595   3.561   1.376
  597   2HB   ALA  86          2HB       ALA  86   7.281   3.525  -0.360
  598   3HB   ALA  86          3HB       ALA  86   6.118   2.819   0.762
  599    H    GLU  87           H        GLU  87   6.820   6.126  -1.388
  600    HA   GLU  87           HA       GLU  87   9.195   7.356  -0.601
  601   1HB   GLU  87          2HB       GLU  87   7.234   8.019  -2.797
  602   2HB   GLU  87          1HB       GLU  87   8.694   8.964  -2.552
  603   1HG   GLU  87          2HG       GLU  87   8.592   6.018  -3.153
  604   2HG   GLU  87          1HG       GLU  87   8.936   7.298  -4.315
  605    H    VAL  88           H        VAL  88   5.864   8.628  -0.630
  606    HA   VAL  88           HA       VAL  88   6.518  11.223   0.259
  607    HB   VAL  88           HB       VAL  88   3.970   9.652   0.709
  608   1HG1  VAL  88          1HG1      VAL  88   2.919  11.794   1.199
  609   2HG1  VAL  88          2HG1      VAL  88   4.466  12.617   1.002
  610   3HG1  VAL  88          3HG1      VAL  88   4.237  11.482   2.336
  611   1HG2  VAL  88          1HG2      VAL  88   4.448   9.989  -1.649
  612   2HG2  VAL  88          2HG2      VAL  88   4.707  11.711  -1.375
  613   3HG2  VAL  88          3HG2      VAL  88   3.103  11.014  -1.151
  614    H    THR  89           H        THR  89   5.541   8.316   2.034
  615    HA   THR  89           HA       THR  89   5.566   9.545   4.571
  616    HB   THR  89           HB       THR  89   5.878   6.592   3.974
  617    HG1  THR  89           1HG      THR  89   3.929   6.845   3.139
  618   1HG2  THR  89          1HG2      THR  89   6.123   7.681   6.364
  619   2HG2  THR  89          2HG2      THR  89   5.213   6.190   6.139
  620   3HG2  THR  89          3HG2      THR  89   4.366   7.731   6.279
  621    H    ARG  90           H        ARG  90   8.029   7.686   2.799
  622    HA   ARG  90           HA       ARG  90   9.879   7.611   4.973
  623   1HB   ARG  90          2HB       ARG  90  11.402   6.609   3.523
  624   2HB   ARG  90          1HB       ARG  90   9.857   6.120   2.848
  625   1HG   ARG  90          2HG       ARG  90  10.111   7.387   0.975
  626   2HG   ARG  90          1HG       ARG  90  11.128   8.585   1.783
  627   1HD   ARG  90          2HD       ARG  90  13.019   7.166   1.705
  628   2HD   ARG  90          1HD       ARG  90  12.040   5.770   1.255
  629    HE   ARG  90           HE       ARG  90  11.595   7.381  -0.809
  630   1HH1  ARG  90          1HH1      ARG  90  14.606   6.566   0.777
  631   2HH1  ARG  90          2HH1      ARG  90  15.534   6.628  -0.686
  632   1HH2  ARG  90          1HH2      ARG  90  12.787   7.501  -2.705
  633   2HH2  ARG  90          2HH2      ARG  90  14.499   7.148  -2.684
  634    H    LEU  91           H        LEU  91   9.160   9.769   2.407
  635    HA   LEU  91           HA       LEU  91  11.436  11.368   2.316
  636   1HB   LEU  91          2HB       LEU  91   9.586  11.456   0.709
  637   2HB   LEU  91          1HB       LEU  91   8.545  12.141   1.939
  638    HG   LEU  91           HG       LEU  91  10.079  14.106   2.037
  639   1HD1  LEU  91          1HD1      LEU  91  12.075  13.081   1.128
  640   2HD1  LEU  91          2HD1      LEU  91  11.584  14.434   0.106
  641   3HD1  LEU  91          3HD1      LEU  91  11.252  12.777  -0.401
  642   1HD2  LEU  91          1HD2      LEU  91   8.793  13.495  -0.621
  643   2HD2  LEU  91          2HD2      LEU  91   9.209  15.101  -0.026
  644   3HD2  LEU  91          3HD2      LEU  91   7.976  14.147   0.799
  645    H    ARG  92           H        ARG  92   8.929  11.175   4.656
  646    HA   ARG  92           HA       ARG  92   9.528  13.747   5.837
  647   1HB   ARG  92          2HB       ARG  92   7.563  11.751   6.881
  648   2HB   ARG  92          1HB       ARG  92   7.544  13.504   7.047
  649   1HG   ARG  92          2HG       ARG  92   6.806  13.831   4.874
  650   2HG   ARG  92          1HG       ARG  92   7.324  12.223   4.364
  651   1HD   ARG  92          2HD       ARG  92   4.906  13.029   5.909
  652   2HD   ARG  92          1HD       ARG  92   5.047  11.961   4.507
  653    HE   ARG  92           HE       ARG  92   6.412  10.627   6.403
  654   1HH1  ARG  92          1HH1      ARG  92   3.205  12.048   6.338
  655   2HH1  ARG  92          2HH1      ARG  92   2.542  10.924   7.481
  656   1HH2  ARG  92          1HH2      ARG  92   5.507   9.146   7.962
  657   2HH2  ARG  92          2HH2      ARG  92   3.828   9.294   8.394
  658    H    GLN  93           H        GLN  93   9.482  10.318   6.719
  659    HA   GLN  93           HA       GLN  93  10.794  11.074   9.215
  660   1HB   GLN  93          2HB       GLN  93   9.503   9.603  10.305
  661   2HB   GLN  93          1HB       GLN  93   8.512   9.689   8.862
  662   1HG   GLN  93          2HG       GLN  93  10.637   7.611   9.304
  663   2HG   GLN  93          1HG       GLN  93   8.947   7.401   9.757
  664   1HE2  GLN  93          1HE2      GLN  93   7.384   7.228   8.108
  665   2HE2  GLN  93          2HE2      GLN  93   7.862   6.820   6.489
  666    H    GLY  94           H        GLY  94  11.464   9.424   6.315
  667   1HA   GLY  94          2HA       GLY  94  13.748   8.883   5.764
  668   2HA   GLY  94          1HA       GLY  94  14.021   8.495   7.458
  669    H    TRP  95           H        TRP  95  13.634   6.526   8.181
  670    HA   TRP  95           HA       TRP  95  11.867   4.744   6.730
  671   1HB   TRP  95          2HB       TRP  95  14.633   3.814   7.573
  672   2HB   TRP  95          1HB       TRP  95  13.434   2.907   6.649
  673    HD1  TRP  95           HD       TRP  95  15.794   5.921   6.250
  674    HE1  TRP  95           1HE      TRP  95  16.304   6.226   3.761
  675    HE3  TRP  95           3HE      TRP  95  12.697   2.330   4.366
  676    HZ2  TRP  95           2HZ      TRP  95  15.518   5.071   1.302
  677    HZ3  TRP  95           3HZ      TRP  95  12.636   1.993   1.930
  678    HH2  TRP  95           HH       TRP  95  14.017   3.335   0.432
  679    H    GLY  96           H        GLY  96  12.159   6.424   9.173
  680   1HA   GLY  96          2HA       GLY  96  12.574   4.795  11.445
  681   2HA   GLY  96          1HA       GLY  96  11.750   6.347  11.428
  682    H    ALA  97           H        ALA  97   9.774   5.323   9.448
  683    HA   ALA  97           HA       ALA  97   7.954   4.137  11.351
  684   1HB   ALA  97          1HB       ALA  97   7.169   5.829   9.756
  685   2HB   ALA  97          2HB       ALA  97   6.296   4.308   9.579
  686   3HB   ALA  97          3HB       ALA  97   7.555   4.743   8.424
  687    H    TRP  98           H        TRP  98  10.209   3.082   9.067
  688    HA   TRP  98           HA       TRP  98   8.958   0.423   8.949
  689   1HB   TRP  98          2HB       TRP  98  11.041   1.750   7.206
  690   2HB   TRP  98          1HB       TRP  98  10.629   0.041   7.087
  691    HD1  TRP  98           HD       TRP  98   8.182  -0.577   6.178
  692    HE1  TRP  98           1HE      TRP  98   6.523   0.728   4.694
  693    HE3  TRP  98           3HE      TRP  98  10.198   4.145   6.639
  694    HZ2  TRP  98           2HZ      TRP  98   6.130   3.403   3.828
  695    HZ3  TRP  98           3HZ      TRP  98   9.114   5.985   5.451
  696    HH2  TRP  98           HH       TRP  98   7.127   5.626   4.083
  697    HA   PRO  99           HA       PRO  99  11.816  -0.330  12.290
  698   1HB   PRO  99          2HB       PRO  99  10.670  -3.055  11.966
  699   2HB   PRO  99          1HB       PRO  99  10.798  -2.053  13.416
  700   1HG   PRO  99          2HG       PRO  99   8.456  -2.319  12.243
  701   2HG   PRO  99          1HG       PRO  99   8.987  -0.715  12.799
  702   1HD   PRO  99          2HD       PRO  99   9.058  -1.857  10.019
  703   2HD   PRO  99          1HD       PRO  99   8.477  -0.265  10.560
  704    H    VAL 100           H        VAL 100  12.447  -3.324  12.336
  705    HA   VAL 100           HA       VAL 100  15.057  -3.172  11.416
  706    HB   VAL 100           HB       VAL 100  15.059  -5.663  11.482
  707   1HG1  VAL 100          1HG1      VAL 100  15.606  -4.356  13.455
  708   2HG1  VAL 100          2HG1      VAL 100  14.707  -5.801  13.918
  709   3HG1  VAL 100          3HG1      VAL 100  13.896  -4.234  13.869
  710   1HG2  VAL 100          1HG2      VAL 100  12.168  -5.303  12.235
  711   2HG2  VAL 100          2HG2      VAL 100  13.083  -6.798  12.412
  712   3HG2  VAL 100          3HG2      VAL 100  12.795  -6.130  10.807
  713    H    CYS 101           H        CYS 101  12.186  -3.998   9.743
  714    HA   CYS 101           HA       CYS 101  13.139  -5.314   7.505
  715   1HB   CYS 101          2HB       CYS 101  10.854  -3.335   7.682
  716   2HB   CYS 101          1HB       CYS 101  11.119  -4.471   6.359
  717    H    ALA 102           H        ALA 102  13.155  -1.854   8.235
  718    HA   ALA 102           HA       ALA 102  13.965  -1.049   5.623
  719   1HB   ALA 102          1HB       ALA 102  14.297   0.407   8.236
  720   2HB   ALA 102          2HB       ALA 102  12.883   0.494   7.186
  721   3HB   ALA 102          3HB       ALA 102  14.439   1.107   6.624
  722    H    ALA 103           H        ALA 103  15.709  -1.578   8.672
  723    HA   ALA 103           HA       ALA 103  18.284  -1.030   7.751
  724   1HB   ALA 103          1HB       ALA 103  17.729  -1.323  10.118
  725   2HB   ALA 103          2HB       ALA 103  19.071  -2.361   9.638
  726   3HB   ALA 103          3HB       ALA 103  17.457  -3.043   9.839
  727    H    ARG 104           H        ARG 104  16.442  -4.020   7.744
  728    HA   ARG 104           HA       ARG 104  18.426  -5.678   6.604
  729   1HB   ARG 104          2HB       ARG 104  15.416  -5.854   6.700
  730   2HB   ARG 104          1HB       ARG 104  16.426  -7.132   6.036
  731   1HG   ARG 104          2HG       ARG 104  17.411  -7.564   8.152
  732   2HG   ARG 104          1HG       ARG 104  16.713  -6.097   8.843
  733   1HD   ARG 104          2HD       ARG 104  15.539  -8.204   9.493
  734   2HD   ARG 104          1HD       ARG 104  14.509  -6.998   8.720
  735    HE   ARG 104           HE       ARG 104  15.358  -8.596   6.678
  736   1HH1  ARG 104          1HH1      ARG 104  13.662  -9.125   9.682
  737   2HH1  ARG 104          2HH1      ARG 104  12.753 -10.480   9.083
  738   1HH2  ARG 104          1HH2      ARG 104  14.228 -10.415   5.891
  739   2HH2  ARG 104          2HH2      ARG 104  13.104 -11.247   6.935
  740    H    ALA 105           H        ALA 105  16.432  -3.251   5.285
  741    HA   ALA 105           HA       ALA 105  16.532  -4.346   2.576
  742   1HB   ALA 105          1HB       ALA 105  14.408  -3.498   3.402
  743   2HB   ALA 105          2HB       ALA 105  14.979  -2.553   2.025
  744   3HB   ALA 105          3HB       ALA 105  15.135  -1.912   3.664
  745    H    GLY 106           H        GLY 106  18.127  -2.040   4.553
  746   1HA   GLY 106          2HA       GLY 106  20.158  -0.983   3.855
  747   2HA   GLY 106          1HA       GLY 106  19.554  -0.991   2.203
  748    H    ALA 107           H        ALA 107  18.321   0.154   5.314
  749    HA   ALA 107           HA       ALA 107  16.874   2.323   4.387
  750   1HB   ALA 107          1HB       ALA 107  16.860   3.100   6.695
  751   2HB   ALA 107          2HB       ALA 107  18.175   1.989   7.086
  752   3HB   ALA 107          3HB       ALA 107  16.596   1.357   6.615
  753    H    ARG 108           H        ARG 108  17.270   4.596   4.525
  754    HA   ARG 108           HA       ARG 108  20.109   5.294   4.250
  755   1HB   ARG 108          2HB       ARG 108  18.012   6.159   2.258
  756   2HB   ARG 108          1HB       ARG 108  19.756   6.359   2.139
  757   1HG   ARG 108          2HG       ARG 108  20.066   4.004   1.821
  758   2HG   ARG 108          1HG       ARG 108  18.358   3.686   2.137
  759   1HD   ARG 108          2HD       ARG 108  18.602   3.614  -0.211
  760   2HD   ARG 108          1HD       ARG 108  17.866   5.178   0.141
  761    HE   ARG 108           HE       ARG 108  20.510   5.757   0.085
  762   1HH1  ARG 108          1HH1      ARG 108  18.264   4.301  -2.174
  763   2HH1  ARG 108          2HH1      ARG 108  19.296   4.547  -3.557
  764   1HH2  ARG 108          1HH2      ARG 108  21.834   6.149  -1.740
  765   2HH2  ARG 108          2HH2      ARG 108  21.312   5.630  -3.316
  Start of MODEL   12
    1   1H    ASN   1          1HT       ASN   1  29.918 -24.872 -45.707
    2   2H    ASN   1          2HT       ASN   1  29.056 -25.918 -44.691
    3   3H    ASN   1          3HT       ASN   1  30.656 -25.498 -44.317
    4    HA   ASN   1           HA       ASN   1  28.392 -23.594 -44.421
    5   1HB   ASN   1          2HB       ASN   1  29.839 -24.782 -42.044
    6   2HB   ASN   1          1HB       ASN   1  28.630 -23.506 -41.965
    7   1HD2  ASN   1          1HD2      ASN   1  28.594 -26.082 -40.687
    8   2HD2  ASN   1          2HD2      ASN   1  27.182 -26.908 -41.272
    9    H    VAL   2           H        VAL   2  29.238 -21.736 -45.117
   10    HA   VAL   2           HA       VAL   2  31.943 -21.035 -44.214
   11    HB   VAL   2           HB       VAL   2  30.452 -20.001 -46.632
   12   1HG1  VAL   2          1HG1      VAL   2  31.909 -18.299 -45.683
   13   2HG1  VAL   2          2HG1      VAL   2  32.562 -18.891 -47.208
   14   3HG1  VAL   2          3HG1      VAL   2  33.259 -19.432 -45.681
   15   1HG2  VAL   2          1HG2      VAL   2  32.820 -21.862 -46.431
   16   2HG2  VAL   2          2HG2      VAL   2  32.153 -21.210 -47.929
   17   3HG2  VAL   2          3HG2      VAL   2  31.186 -22.299 -46.934
   18    H    VAL   3           H        VAL   3  28.839 -19.517 -45.070
   19    HA   VAL   3           HA       VAL   3  29.504 -17.199 -43.538
   20    HB   VAL   3           HB       VAL   3  26.919 -17.794 -44.970
   21   1HG1  VAL   3          1HG1      VAL   3  28.129 -15.199 -44.018
   22   2HG1  VAL   3          2HG1      VAL   3  26.719 -16.010 -43.339
   23   3HG1  VAL   3          3HG1      VAL   3  26.653 -15.347 -44.971
   24   1HG2  VAL   3          1HG2      VAL   3  27.813 -16.466 -46.822
   25   2HG2  VAL   3          2HG2      VAL   3  28.786 -17.910 -46.533
   26   3HG2  VAL   3          3HG2      VAL   3  29.358 -16.334 -45.980
   27    H    VAL   4           H        VAL   4  29.656 -18.362 -41.542
   28    HA   VAL   4           HA       VAL   4  27.025 -18.568 -40.229
   29    HB   VAL   4           HB       VAL   4  29.473 -20.098 -39.388
   30   1HG1  VAL   4          1HG1      VAL   4  27.885 -21.430 -38.082
   31   2HG1  VAL   4          2HG1      VAL   4  26.571 -20.395 -38.645
   32   3HG1  VAL   4          3HG1      VAL   4  27.850 -19.726 -37.630
   33   1HG2  VAL   4          1HG2      VAL   4  28.814 -20.885 -41.606
   34   2HG2  VAL   4          2HG2      VAL   4  27.164 -21.134 -41.029
   35   3HG2  VAL   4          3HG2      VAL   4  28.485 -22.103 -40.374
   36    H    THR   5           H        THR   5  26.882 -17.618 -38.232
   37    HA   THR   5           HA       THR   5  29.222 -16.056 -37.380
   38    HB   THR   5           HB       THR   5  27.577 -14.232 -36.737
   39    HG1  THR   5           1HG      THR   5  25.732 -15.775 -37.172
   40   1HG2  THR   5          1HG2      THR   5  27.982 -14.868 -39.662
   41   2HG2  THR   5          2HG2      THR   5  29.070 -13.950 -38.622
   42   3HG2  THR   5          3HG2      THR   5  27.482 -13.301 -39.031
   43    HA   PRO   6           HA       PRO   6  27.845 -18.008 -33.528
   44   1HB   PRO   6          2HB       PRO   6  30.613 -17.674 -32.724
   45   2HB   PRO   6          1HB       PRO   6  29.703 -19.171 -32.948
   46   1HG   PRO   6          2HG       PRO   6  31.712 -18.455 -34.585
   47   2HG   PRO   6          1HG       PRO   6  30.293 -19.357 -35.148
   48   1HD   PRO   6          2HD       PRO   6  30.823 -16.400 -35.322
   49   2HD   PRO   6          1HD       PRO   6  30.275 -17.507 -36.603
   50    H    ALA   7           H        ALA   7  27.314 -17.020 -31.790
   51    HA   ALA   7           HA       ALA   7  26.607 -15.261 -30.514
   52   1HB   ALA   7          1HB       ALA   7  28.347 -13.953 -29.474
   53   2HB   ALA   7          2HB       ALA   7  29.494 -14.445 -30.717
   54   3HB   ALA   7          3HB       ALA   7  28.854 -15.637 -29.589
   55    H    HIS   8           H        HIS   8  26.218 -14.996 -33.215
   56    HA   HIS   8           HA       HIS   8  26.646 -12.330 -34.073
   57   1HB   HIS   8          2HB       HIS   8  26.000 -14.162 -35.613
   58   2HB   HIS   8          1HB       HIS   8  24.430 -14.260 -34.824
   59    HD1  HIS   8           1HD      HIS   8  26.481 -11.686 -36.777
   60    HD2  HIS   8           2HD      HIS   8  22.538 -12.750 -35.971
   61    HE1  HIS   8           1HE      HIS   8  25.030 -10.200 -38.221
   62    H    GLU   9           H        GLU   9  24.738 -13.766 -31.684
   63    HA   GLU   9           HA       GLU   9  22.919 -11.491 -31.535
   64   1HB   GLU   9          2HB       GLU   9  21.750 -12.741 -29.808
   65   2HB   GLU   9          1HB       GLU   9  21.966 -13.748 -31.231
   66   1HG   GLU   9          2HG       GLU   9  23.864 -14.853 -30.144
   67   2HG   GLU   9          1HG       GLU   9  23.598 -13.859 -28.712
   68    H    ALA  10           H        ALA  10  23.231  -9.886 -30.150
   69    HA   ALA  10           HA       ALA  10  25.295 -10.213 -28.088
   70   1HB   ALA  10          1HB       ALA  10  25.032  -7.808 -29.895
   71   2HB   ALA  10          2HB       ALA  10  26.284  -9.043 -30.013
   72   3HB   ALA  10          3HB       ALA  10  26.199  -8.009 -28.588
   73    H    VAL  11           H        VAL  11  23.204 -10.622 -27.035
   74    HA   VAL  11           HA       VAL  11  21.399  -8.545 -26.492
   75    HB   VAL  11           HB       VAL  11  20.810 -10.870 -26.114
   76   1HG1  VAL  11          1HG1      VAL  11  22.825 -10.830 -23.876
   77   2HG1  VAL  11          2HG1      VAL  11  22.949 -11.736 -25.383
   78   3HG1  VAL  11          3HG1      VAL  11  21.691 -12.137 -24.215
   79   1HG2  VAL  11          1HG2      VAL  11  20.772  -9.275 -23.553
   80   2HG2  VAL  11          2HG2      VAL  11  19.750 -10.667 -23.912
   81   3HG2  VAL  11          3HG2      VAL  11  19.587  -9.187 -24.858
   82    H    VAL  12           H        VAL  12  24.372  -9.571 -24.997
   83    HA   VAL  12           HA       VAL  12  25.079  -9.060 -22.823
   84    HB   VAL  12           HB       VAL  12  26.011  -7.081 -24.832
   85   1HG1  VAL  12          1HG1      VAL  12  28.074  -6.947 -23.513
   86   2HG1  VAL  12          2HG1      VAL  12  27.383  -8.055 -22.327
   87   3HG1  VAL  12          3HG1      VAL  12  26.681  -6.452 -22.549
   88   1HG2  VAL  12          1HG2      VAL  12  27.801  -8.708 -25.259
   89   2HG2  VAL  12          2HG2      VAL  12  26.201  -9.355 -25.617
   90   3HG2  VAL  12          3HG2      VAL  12  27.026  -9.819 -24.131
   91    H    ARG  13           H        ARG  13  23.137  -8.450 -21.870
   92    HA   ARG  13           HA       ARG  13  23.217  -5.890 -20.632
   93   1HB   ARG  13          2HB       ARG  13  20.989  -6.616 -22.473
   94   2HB   ARG  13          1HB       ARG  13  20.713  -5.534 -21.126
   95   1HG   ARG  13          2HG       ARG  13  22.326  -3.974 -22.011
   96   2HG   ARG  13          1HG       ARG  13  22.726  -5.091 -23.316
   97   1HD   ARG  13          2HD       ARG  13  20.012  -3.863 -22.861
   98   2HD   ARG  13          1HD       ARG  13  21.205  -3.268 -24.013
   99    HE   ARG  13           HE       ARG  13  20.699  -6.001 -24.498
  100   1HH1  ARG  13          1HH1      ARG  13  19.209  -2.853 -24.792
  101   2HH1  ARG  13          2HH1      ARG  13  18.222  -3.292 -26.161
  102   1HH2  ARG  13          1HH2      ARG  13  19.368  -6.619 -26.284
  103   2HH2  ARG  13          2HH2      ARG  13  18.277  -5.449 -26.972
  104    H    VAL  14           H        VAL  14  22.372  -6.053 -18.595
  105    HA   VAL  14           HA       VAL  14  21.919  -8.683 -17.649
  106    HB   VAL  14           HB       VAL  14  21.274  -6.282 -16.031
  107   1HG1  VAL  14          1HG1      VAL  14  20.938  -8.465 -15.042
  108   2HG1  VAL  14          2HG1      VAL  14  22.234  -7.603 -14.213
  109   3HG1  VAL  14          3HG1      VAL  14  22.620  -8.883 -15.362
  110   1HG2  VAL  14          1HG2      VAL  14  23.661  -6.028 -15.425
  111   2HG2  VAL  14          2HG2      VAL  14  23.333  -5.626 -17.109
  112   3HG2  VAL  14          3HG2      VAL  14  24.073  -7.175 -16.700
  113    H    GLY  15           H        GLY  15  20.081  -9.423 -16.685
  114   1HA   GLY  15          2HA       GLY  15  17.646  -8.193 -17.676
  115   2HA   GLY  15          1HA       GLY  15  17.872  -9.930 -17.594
  116    H    THR  16           H        THR  16  18.269  -7.180 -15.472
  117    HA   THR  16           HA       THR  16  17.397  -8.526 -13.141
  118    HB   THR  16           HB       THR  16  17.400  -5.542 -13.497
  119    HG1  THR  16           1HG      THR  16  19.546  -5.505 -13.550
  120   1HG2  THR  16          1HG2      THR  16  16.625  -6.396 -11.370
  121   2HG2  THR  16          2HG2      THR  16  18.186  -5.599 -11.165
  122   3HG2  THR  16          3HG2      THR  16  18.088  -7.361 -11.199
  123    H    LYS  17           H        LYS  17  15.994  -6.506 -15.509
  124    HA   LYS  17           HA       LYS  17  13.545  -5.946 -14.299
  125   1HB   LYS  17          2HB       LYS  17  12.766  -5.349 -16.586
  126   2HB   LYS  17          1HB       LYS  17  14.251  -4.549 -16.101
  127   1HG   LYS  17          2HG       LYS  17  14.587  -7.067 -17.588
  128   2HG   LYS  17          1HG       LYS  17  13.882  -5.722 -18.486
  129   1HD   LYS  17          2HD       LYS  17  16.391  -5.465 -16.859
  130   2HD   LYS  17          1HD       LYS  17  16.405  -5.917 -18.568
  131   1HE   LYS  17          2HE       LYS  17  15.259  -3.382 -17.398
  132   2HE   LYS  17          1HE       LYS  17  16.781  -3.518 -18.277
  133   1HZ   LYS  17          1HZ       LYS  17  14.084  -4.091 -19.406
  134   2HZ   LYS  17          2HZ       LYS  17  15.556  -4.179 -20.248
  135   3HZ   LYS  17          3HZ       LYS  17  14.991  -2.685 -19.675
  136    HA   PRO  18           HA       PRO  18  11.504  -9.918 -14.925
  137   1HB   PRO  18          2HB       PRO  18   9.313  -8.468 -13.643
  138   2HB   PRO  18          1HB       PRO  18  10.145  -9.933 -13.109
  139   1HG   PRO  18          2HG       PRO  18  10.448  -7.586 -11.828
  140   2HG   PRO  18          1HG       PRO  18  11.776  -8.752 -11.978
  141   1HD   PRO  18          2HD       PRO  18  11.257  -6.262 -13.566
  142   2HD   PRO  18          1HD       PRO  18  12.792  -6.867 -12.901
  143    H    GLY  19           H        GLY  19   9.108 -10.227 -15.554
  144   1HA   GLY  19          2HA       GLY  19   8.716  -9.159 -18.152
  145   2HA   GLY  19          1HA       GLY  19   7.503 -10.013 -17.203
  146    H    THR  20           H        THR  20   7.804  -8.255 -15.027
  147    HA   THR  20           HA       THR  20   5.784  -6.387 -15.391
  148    HB   THR  20           HB       THR  20   8.014  -6.133 -13.385
  149    HG1  THR  20           1HG      THR  20   5.795  -7.937 -13.341
  150   1HG2  THR  20          1HG2      THR  20   5.052  -5.607 -13.228
  151   2HG2  THR  20          2HG2      THR  20   6.319  -4.389 -13.361
  152   3HG2  THR  20          3HG2      THR  20   6.208  -5.392 -11.915
  153    H    GLU  21           H        GLU  21   9.271  -6.061 -15.667
  154    HA   GLU  21           HA       GLU  21  10.656  -4.262 -15.797
  155   1HB   GLU  21          2HB       GLU  21   8.865  -4.224 -18.146
  156   2HB   GLU  21          1HB       GLU  21  10.100  -2.986 -17.965
  157   1HG   GLU  21          2HG       GLU  21  11.727  -4.928 -17.639
  158   2HG   GLU  21          1HG       GLU  21  10.438  -5.944 -18.287
  159    H    VAL  22           H        VAL  22   9.871  -3.275 -13.914
  160    HA   VAL  22           HA       VAL  22   8.442  -0.786 -14.234
  161    HB   VAL  22           HB       VAL  22   7.964  -2.025 -12.231
  162   1HG1  VAL  22          1HG1      VAL  22  10.913  -1.925 -11.625
  163   2HG1  VAL  22          2HG1      VAL  22   9.989  -3.356 -12.078
  164   3HG1  VAL  22          3HG1      VAL  22   9.663  -2.544 -10.547
  165   1HG2  VAL  22          1HG2      VAL  22   9.696   0.361 -11.610
  166   2HG2  VAL  22          2HG2      VAL  22   8.554  -0.381 -10.492
  167   3HG2  VAL  22          3HG2      VAL  22   7.970   0.380 -11.971
  168    HA   PRO  23           HA       PRO  23  12.252   1.559 -14.977
  169   1HB   PRO  23          2HB       PRO  23  10.399   3.710 -14.080
  170   2HB   PRO  23          1HB       PRO  23  11.450   3.652 -15.500
  171   1HG   PRO  23          2HG       PRO  23   8.805   3.313 -15.709
  172   2HG   PRO  23          1HG       PRO  23   9.939   2.411 -16.734
  173   1HD   PRO  23          2HD       PRO  23   8.365   1.515 -14.379
  174   2HD   PRO  23          1HD       PRO  23   8.840   0.614 -15.829
  175    HA   PRO  24           HA       PRO  24  13.606   1.158 -10.822
  176   1HB   PRO  24          2HB       PRO  24  15.783   2.880 -11.020
  177   2HB   PRO  24          1HB       PRO  24  15.785   1.164 -11.435
  178   1HG   PRO  24          2HG       PRO  24  15.426   3.545 -13.209
  179   2HG   PRO  24          1HG       PRO  24  16.355   2.059 -13.498
  180   1HD   PRO  24          2HD       PRO  24  13.981   2.356 -14.629
  181   2HD   PRO  24          1HD       PRO  24  14.429   0.799 -13.903
  182    H    VAL  25           H        VAL  25  13.277   2.113  -8.974
  183    HA   VAL  25           HA       VAL  25  12.750   5.006  -8.876
  184    HB   VAL  25           HB       VAL  25  11.598   2.928  -7.006
  185   1HG1  VAL  25          1HG1      VAL  25  10.091   4.734  -6.330
  186   2HG1  VAL  25          2HG1      VAL  25  10.907   5.833  -7.444
  187   3HG1  VAL  25          3HG1      VAL  25  11.779   5.170  -6.063
  188   1HG2  VAL  25          1HG2      VAL  25  10.707   2.558  -9.239
  189   2HG2  VAL  25          2HG2      VAL  25  10.274   4.261  -9.368
  190   3HG2  VAL  25          3HG2      VAL  25   9.471   3.234  -8.181
  191    H    ILE  26           H        ILE  26  13.404   6.039  -6.846
  192    HA   ILE  26           HA       ILE  26  16.133   5.594  -6.568
  193    HB   ILE  26           HB       ILE  26  14.276   7.233  -4.847
  194   1HG1  ILE  26          2HG1      ILE  26  15.566   9.124  -5.997
  195   2HG1  ILE  26          1HG1      ILE  26  16.164   7.901  -7.109
  196   1HG2  ILE  26          1HG2      ILE  26  17.284   7.134  -4.789
  197   2HG2  ILE  26          2HG2      ILE  26  16.188   6.618  -3.507
  198   3HG2  ILE  26          3HG2      ILE  26  16.288   8.323  -3.951
  199   1HD1  ILE  26          1HD1      ILE  26  14.232   9.218  -7.939
  200   2HD1  ILE  26          2HD1      ILE  26  13.246   8.485  -6.673
  201   3HD1  ILE  26          3HD1      ILE  26  13.970   7.476  -7.927
  202    H    ASP  27           H        ASP  27  13.485   4.649  -4.503
  203    HA   ASP  27           HA       ASP  27  15.366   3.206  -2.782
  204   1HB   ASP  27          2HB       ASP  27  12.894   4.726  -1.961
  205   2HB   ASP  27          1HB       ASP  27  13.741   3.595  -0.912
  206    H    GLY  28           H        GLY  28  13.371   2.685  -5.087
  207   1HA   GLY  28          2HA       GLY  28  11.278   1.083  -4.139
  208   2HA   GLY  28          1HA       GLY  28  11.959   1.010  -5.758
  209    H    SER  29           H        SER  29  14.589   0.574  -4.194
  210    HA   SER  29           HA       SER  29  14.548  -2.305  -4.396
  211   1HB   SER  29          2HB       SER  29  16.717  -0.656  -3.146
  212   2HB   SER  29          1HB       SER  29  16.863  -2.204  -3.973
  213    HG   SER  29           HG       SER  29  17.559  -0.340  -5.216
  214    H    ILE  30           H        ILE  30  14.707   0.099  -1.905
  215    HA   ILE  30           HA       ILE  30  15.040  -1.649   0.311
  216    HB   ILE  30           HB       ILE  30  13.570   0.857   0.877
  217   1HG1  ILE  30          2HG1      ILE  30  14.932   1.642  -1.038
  218   2HG1  ILE  30          1HG1      ILE  30  15.452   2.360   0.481
  219   1HG2  ILE  30          1HG2      ILE  30  16.131  -0.323   1.919
  220   2HG2  ILE  30          2HG2      ILE  30  14.525  -0.481   2.627
  221   3HG2  ILE  30          3HG2      ILE  30  15.312   1.095   2.576
  222   1HD1  ILE  30          1HD1      ILE  30  17.324   0.794   0.589
  223   2HD1  ILE  30          2HD1      ILE  30  17.355   1.762  -0.887
  224   3HD1  ILE  30          3HD1      ILE  30  16.809   0.085  -0.942
  225    H    TRP  31           H        TRP  31  12.383  -0.246  -1.435
  226    HA   TRP  31           HA       TRP  31  10.335  -0.950   0.394
  227   1HB   TRP  31          2HB       TRP  31  10.169  -0.362  -2.570
  228   2HB   TRP  31          1HB       TRP  31   8.795  -0.439  -1.470
  229    HD1  TRP  31           HD       TRP  31  10.684   2.084  -3.071
  230    HE1  TRP  31           1HE      TRP  31  10.771   4.296  -1.737
  231    HE3  TRP  31           3HE      TRP  31   9.215   0.308   1.424
  232    HZ2  TRP  31           2HZ      TRP  31  10.288   5.125   0.881
  233    HZ3  TRP  31           3HZ      TRP  31   9.055   1.856   3.325
  234    HH2  TRP  31           HH       TRP  31   9.583   4.219   3.055
  235    H    ASP  32           H        ASP  32  11.827  -2.580  -2.320
  236    HA   ASP  32           HA       ASP  32   9.961  -4.712  -2.436
  237   1HB   ASP  32          2HB       ASP  32  11.208  -4.328  -4.399
  238   2HB   ASP  32          1HB       ASP  32  12.741  -4.280  -3.516
  239    H    ALA  33           H        ALA  33  13.127  -4.241  -0.841
  240    HA   ALA  33           HA       ALA  33  13.195  -6.866   0.189
  241   1HB   ALA  33          1HB       ALA  33  14.633  -4.398   1.144
  242   2HB   ALA  33          2HB       ALA  33  15.218  -5.553  -0.052
  243   3HB   ALA  33          3HB       ALA  33  15.004  -6.054   1.624
  244    H    ILE  34           H        ILE  34  11.919  -3.811   1.379
  245    HA   ILE  34           HA       ILE  34  11.220  -4.638   3.984
  246    HB   ILE  34           HB       ILE  34   9.999  -2.601   2.139
  247   1HG1  ILE  34          2HG1      ILE  34  11.733  -2.367   4.607
  248   2HG1  ILE  34          1HG1      ILE  34  12.259  -2.114   2.947
  249   1HG2  ILE  34          1HG2      ILE  34   9.307  -3.118   5.028
  250   2HG2  ILE  34          2HG2      ILE  34   8.242  -3.320   3.637
  251   3HG2  ILE  34          3HG2      ILE  34   8.794  -1.711   4.099
  252   1HD1  ILE  34          1HD1      ILE  34  11.928  -0.009   4.107
  253   2HD1  ILE  34          2HD1      ILE  34  10.249  -0.440   4.432
  254   3HD1  ILE  34          3HD1      ILE  34  10.787  -0.182   2.773
  255    H    ALA  35           H        ALA  35   9.438  -4.768   0.918
  256    HA   ALA  35           HA       ALA  35   7.095  -5.964   1.900
  257   1HB   ALA  35          1HB       ALA  35   8.362  -6.254  -0.819
  258   2HB   ALA  35          2HB       ALA  35   7.234  -4.991  -0.328
  259   3HB   ALA  35          3HB       ALA  35   6.700  -6.670  -0.405
  260    H    GLY  36           H        GLY  36  10.192  -7.256   0.944
  261   1HA   GLY  36          2HA       GLY  36   9.405 -10.014   1.004
  262   2HA   GLY  36          1HA       GLY  36  11.054  -9.402   1.001
  263    H    CYS  37           H        CYS  37  10.080  -7.719   3.397
  264    HA   CYS  37           HA       CYS  37  11.091  -9.556   5.359
  265   1HB   CYS  37          2HB       CYS  37  11.961  -7.375   5.520
  266   2HB   CYS  37          1HB       CYS  37  10.371  -6.638   5.378
  267    H    GLU  38           H        GLU  38   8.131  -7.553   5.190
  268    HA   GLU  38           HA       GLU  38   7.079  -9.058   7.454
  269   1HB   GLU  38          2HB       GLU  38   6.913  -6.608   7.473
  270   2HB   GLU  38          1HB       GLU  38   5.957  -6.657   6.000
  271   1HG   GLU  38          2HG       GLU  38   4.522  -6.301   7.894
  272   2HG   GLU  38          1HG       GLU  38   4.202  -7.887   7.195
  273    H    ALA  39           H        ALA  39   6.563  -8.633   4.036
  274    HA   ALA  39           HA       ALA  39   4.073 -10.121   4.198
  275   1HB   ALA  39          1HB       ALA  39   5.218  -8.632   1.854
  276   2HB   ALA  39          2HB       ALA  39   4.033  -7.989   2.991
  277   3HB   ALA  39          3HB       ALA  39   3.610  -9.349   1.952
  278    H    GLY  40           H        GLY  40   7.312 -10.669   3.572
  279   1HA   GLY  40          2HA       GLY  40   8.389 -12.599   2.865
  280   2HA   GLY  40          1HA       GLY  40   6.806 -13.335   2.606
  281    H    GLY  41           H        GLY  41   7.260 -10.272   1.309
  282   1HA   GLY  41          2HA       GLY  41   7.522  -9.486  -0.803
  283   2HA   GLY  41          1HA       GLY  41   8.106 -11.071  -1.316
  284    H    ASN  42           H        ASN  42   5.116  -9.566  -0.129
  285    HA   ASN  42           HA       ASN  42   3.670 -10.689  -2.383
  286   1HB   ASN  42          2HB       ASN  42   3.440 -12.339  -0.519
  287   2HB   ASN  42          1HB       ASN  42   2.746 -11.062   0.476
  288   1HD2  ASN  42          1HD2      ASN  42   2.026 -11.285  -2.950
  289   2HD2  ASN  42          2HD2      ASN  42   0.393 -11.821  -2.756
  290    H    TRP  43           H        TRP  43   3.253  -8.756  -3.215
  291    HA   TRP  43           HA       TRP  43   2.635  -6.481  -1.566
  292   1HB   TRP  43          2HB       TRP  43   2.581  -6.777  -4.574
  293   2HB   TRP  43          1HB       TRP  43   2.537  -5.261  -3.685
  294    HD1  TRP  43           HD       TRP  43   4.952  -8.312  -3.815
  295    HE1  TRP  43           1HE      TRP  43   7.374  -7.411  -3.870
  296    HE3  TRP  43           3HE      TRP  43   3.946  -3.315  -3.612
  297    HZ2  TRP  43           2HZ      TRP  43   8.678  -4.890  -3.819
  298    HZ3  TRP  43           3HZ      TRP  43   5.811  -1.720  -3.632
  299    HH2  TRP  43           HH       TRP  43   8.137  -2.514  -3.752
  300    H    ALA  44           H        ALA  44   0.911  -9.037  -2.569
  301    HA   ALA  44           HA       ALA  44  -1.608  -7.531  -2.806
  302   1HB   ALA  44          1HB       ALA  44  -1.058  -8.869  -4.780
  303   2HB   ALA  44          2HB       ALA  44  -2.530  -9.440  -3.994
  304   3HB   ALA  44          3HB       ALA  44  -1.016 -10.319  -3.778
  305    H    ILE  45           H        ILE  45  -0.015  -8.744  -0.401
  306    HA   ILE  45           HA       ILE  45  -1.809 -10.653   0.710
  307    HB   ILE  45           HB       ILE  45   0.780 -10.125   1.220
  308   1HG1  ILE  45          2HG1      ILE  45  -1.170 -11.217   3.250
  309   2HG1  ILE  45          1HG1      ILE  45  -0.535 -12.108   1.870
  310   1HG2  ILE  45          1HG2      ILE  45   1.022  -9.147   3.449
  311   2HG2  ILE  45          2HG2      ILE  45  -0.698  -8.759   3.465
  312   3HG2  ILE  45          3HG2      ILE  45   0.369  -7.982   2.297
  313   1HD1  ILE  45          1HD1      ILE  45   1.044 -11.046   4.200
  314   2HD1  ILE  45          2HD1      ILE  45   1.736 -11.843   2.788
  315   3HD1  ILE  45          3HD1      ILE  45   0.655 -12.734   3.863
  316    H    ASN  46           H        ASN  46  -3.284 -10.346   2.348
  317    HA   ASN  46           HA       ASN  46  -3.798  -7.661   3.336
  318   1HB   ASN  46          2HB       ASN  46  -5.141  -8.001   1.192
  319   2HB   ASN  46          1HB       ASN  46  -6.042  -9.240   2.065
  320   1HD2  ASN  46          1HD2      ASN  46  -5.384  -5.853   1.755
  321   2HD2  ASN  46          2HD2      ASN  46  -6.673  -5.307   2.766
  322    H    THR  47           H        THR  47  -3.144  -8.503   5.300
  323    HA   THR  47           HA       THR  47  -4.273 -10.822   6.458
  324    HB   THR  47           HB       THR  47  -3.345  -9.835   8.613
  325    HG1  THR  47           1HG      THR  47  -2.297  -7.909   8.503
  326   1HG2  THR  47          1HG2      THR  47  -1.446  -9.996   6.265
  327   2HG2  THR  47          2HG2      THR  47  -2.043 -11.374   7.191
  328   3HG2  THR  47          3HG2      THR  47  -1.014 -10.169   7.968
  329    H    GLY  48           H        GLY  48  -5.192  -7.486   6.293
  330   1HA   GLY  48          2HA       GLY  48  -7.457  -6.798   6.545
  331   2HA   GLY  48          1HA       GLY  48  -7.701  -8.132   7.667
  332    H    ASN  49           H        ASN  49  -4.804  -6.340   7.976
  333    HA   ASN  49           HA       ASN  49  -5.717  -5.453  10.604
  334   1HB   ASN  49          2HB       ASN  49  -3.393  -5.171  11.168
  335   2HB   ASN  49          1HB       ASN  49  -3.585  -6.729  10.374
  336   1HD2  ASN  49          1HD2      ASN  49  -1.190  -5.190  10.669
  337   2HD2  ASN  49          2HD2      ASN  49  -0.623  -4.837   9.071
  338    H    GLY  50           H        GLY  50  -6.056  -4.126   7.770
  339   1HA   GLY  50          2HA       GLY  50  -6.697  -1.905   7.368
  340   2HA   GLY  50          1HA       GLY  50  -5.819  -1.416   8.812
  341    H    TYR  51           H        TYR  51  -3.653  -3.291   7.553
  342    HA   TYR  51           HA       TYR  51  -2.506  -1.252   5.787
  343   1HB   TYR  51          2HB       TYR  51  -0.937  -3.350   7.313
  344   2HB   TYR  51          1HB       TYR  51  -0.302  -1.986   6.425
  345    HD1  TYR  51           1HD      TYR  51  -3.097  -0.802   8.212
  346    HD2  TYR  51           2HD      TYR  51   0.949  -2.025   8.749
  347    HE1  TYR  51           1HE      TYR  51  -2.979   0.477  10.319
  348    HE2  TYR  51           2HE      TYR  51   1.071  -0.747  10.840
  349    HH   TYR  51           HH       TYR  51  -1.624   0.436  12.447
  350    H    TYR  52           H        TYR  52  -1.014  -2.352   4.101
  351    HA   TYR  52           HA       TYR  52  -2.533  -4.685   3.165
  352   1HB   TYR  52          2HB       TYR  52  -1.776  -2.294   1.497
  353   2HB   TYR  52          1HB       TYR  52  -2.673  -3.703   0.939
  354    HD1  TYR  52           1HD      TYR  52  -2.787  -0.811   3.233
  355    HD2  TYR  52           2HD      TYR  52  -5.020  -3.826   1.254
  356    HE1  TYR  52           1HE      TYR  52  -4.858   0.297   3.907
  357    HE2  TYR  52           2HE      TYR  52  -7.116  -2.729   1.930
  358    HH   TYR  52           HH       TYR  52  -7.753  -1.072   3.991
  359    H    GLY  53           H        GLY  53  -1.527  -5.625   1.142
  360   1HA   GLY  53          2HA       GLY  53   0.896  -6.759   1.923
  361   2HA   GLY  53          1HA       GLY  53   0.155  -6.926   0.342
  362    H    GLY  54           H        GLY  54   2.880  -6.864   0.740
  363   1HA   GLY  54          2HA       GLY  54   4.569  -5.901  -0.563
  364   2HA   GLY  54          1HA       GLY  54   3.553  -4.483  -0.792
  365    H    VAL  55           H        VAL  55   3.926  -2.727   0.431
  366    HA   VAL  55           HA       VAL  55   6.246  -2.885   2.182
  367    HB   VAL  55           HB       VAL  55   4.772  -0.363   1.438
  368   1HG1  VAL  55          1HG1      VAL  55   7.661  -0.891   2.111
  369   2HG1  VAL  55          2HG1      VAL  55   6.460  -0.218   3.210
  370   3HG1  VAL  55          3HG1      VAL  55   6.938   0.681   1.771
  371   1HG2  VAL  55          1HG2      VAL  55   5.256  -1.557  -0.629
  372   2HG2  VAL  55          2HG2      VAL  55   6.938  -1.747  -0.137
  373   3HG2  VAL  55          3HG2      VAL  55   6.292  -0.141  -0.465
  374    H    GLN  56           H        GLN  56   3.186  -3.501   2.671
  375    HA   GLN  56           HA       GLN  56   1.961  -3.875   4.518
  376   1HB   GLN  56          2HB       GLN  56   3.134  -4.575   6.474
  377   2HB   GLN  56          1HB       GLN  56   4.066  -5.068   5.069
  378   1HG   GLN  56          2HG       GLN  56   4.936  -2.483   5.959
  379   2HG   GLN  56          1HG       GLN  56   4.942  -3.618   7.306
  380   1HE2  GLN  56          1HE2      GLN  56   5.440  -4.663   4.015
  381   2HE2  GLN  56          2HE2      GLN  56   7.121  -5.025   4.184
  382    H    PHE  57           H        PHE  57   2.046  -1.022   3.854
  383    HA   PHE  57           HA       PHE  57   1.722  -0.040   6.598
  384   1HB   PHE  57          2HB       PHE  57   2.130   2.221   5.854
  385   2HB   PHE  57          1HB       PHE  57   3.496   1.178   5.525
  386    HD1  PHE  57           1HD      PHE  57   3.402   0.126   3.023
  387    HD2  PHE  57           2HD      PHE  57   1.605   3.777   4.286
  388    HE1  PHE  57           1HE      PHE  57   3.536   0.982   0.724
  389    HE2  PHE  57           2HE      PHE  57   1.727   4.630   1.981
  390    HZ   PHE  57           HZ       PHE  57   2.703   3.238   0.198
  391    H    ASP  58           H        ASP  58   0.201   2.017   6.598
  392    HA   ASP  58           HA       ASP  58  -2.266   0.566   6.275
  393   1HB   ASP  58          2HB       ASP  58  -3.206   2.115   7.835
  394   2HB   ASP  58          1HB       ASP  58  -1.624   1.613   8.420
  395    H    GLN  59           H        GLN  59  -4.246   1.657   5.840
  396    HA   GLN  59           HA       GLN  59  -4.379   2.703   3.254
  397   1HB   GLN  59          2HB       GLN  59  -6.178   1.427   4.112
  398   2HB   GLN  59          1HB       GLN  59  -6.316   2.438   5.536
  399   1HG   GLN  59          2HG       GLN  59  -8.152   2.805   3.996
  400   2HG   GLN  59          1HG       GLN  59  -7.174   4.256   4.180
  401   1HE2  GLN  59          1HE2      GLN  59  -6.051   1.602   2.292
  402   2HE2  GLN  59          2HE2      GLN  59  -6.256   2.326   0.730
  403    H    GLY  60           H        GLY  60  -4.508   4.231   6.411
  404   1HA   GLY  60          2HA       GLY  60  -5.497   6.741   5.545
  405   2HA   GLY  60          1HA       GLY  60  -4.674   6.425   7.066
  406    H    THR  61           H        THR  61  -2.225   5.645   6.337
  407    HA   THR  61           HA       THR  61  -0.900   7.998   5.549
  408    HB   THR  61           HB       THR  61   0.065   5.173   5.646
  409    HG1  THR  61           1HG      THR  61  -0.189   5.560   7.712
  410   1HG2  THR  61          1HG2      THR  61   1.552   6.505   4.263
  411   2HG2  THR  61          2HG2      THR  61   2.323   6.143   5.808
  412   3HG2  THR  61          3HG2      THR  61   1.636   7.741   5.518
  413    H    TRP  62           H        TRP  62  -1.683   5.037   3.824
  414    HA   TRP  62           HA       TRP  62  -0.448   5.529   1.381
  415   1HB   TRP  62          2HB       TRP  62  -1.477   3.398   2.015
  416   2HB   TRP  62          1HB       TRP  62  -3.060   4.165   2.039
  417    HD1  TRP  62           HD       TRP  62  -4.259   4.601  -0.264
  418    HE1  TRP  62           1HE      TRP  62  -3.876   3.646  -2.613
  419    HE3  TRP  62           3HE      TRP  62   0.392   2.641   0.427
  420    HZ2  TRP  62           2HZ      TRP  62  -1.834   2.235  -4.032
  421    HZ3  TRP  62           3HZ      TRP  62   1.505   1.514  -1.446
  422    HH2  TRP  62           HH       TRP  62   0.432   1.309  -3.629
  423    H    GLU  63           H        GLU  63  -3.683   6.304   2.520
  424    HA   GLU  63           HA       GLU  63  -4.545   7.586   0.161
  425   1HB   GLU  63          2HB       GLU  63  -6.145   6.640   1.659
  426   2HB   GLU  63          1HB       GLU  63  -5.545   7.580   3.011
  427   1HG   GLU  63          2HG       GLU  63  -6.530   9.150   0.733
  428   2HG   GLU  63          1HG       GLU  63  -7.746   8.179   1.563
  429    H    ALA  64           H        ALA  64  -2.936   8.662   3.075
  430    HA   ALA  64           HA       ALA  64  -3.347  11.446   2.739
  431   1HB   ALA  64          1HB       ALA  64  -1.572  11.730   4.380
  432   2HB   ALA  64          2HB       ALA  64  -1.108  10.039   4.194
  433   3HB   ALA  64          3HB       ALA  64  -2.681  10.453   4.880
  434    H    ASN  65           H        ASN  65  -0.729   9.262   1.738
  435    HA   ASN  65           HA       ASN  65   0.677  11.391   0.401
  436   1HB   ASN  65          2HB       ASN  65   1.132   8.405   0.198
  437   2HB   ASN  65          1HB       ASN  65   2.258   9.678  -0.263
  438   1HD2  ASN  65          1HD2      ASN  65   1.547  11.294   2.114
  439   2HD2  ASN  65          2HD2      ASN  65   2.340  10.521   3.444
  440    H    GLY  66           H        GLY  66  -2.058   9.683  -0.274
  441   1HA   GLY  66          2HA       GLY  66  -3.435   9.985  -2.112
  442   2HA   GLY  66          1HA       GLY  66  -2.098  10.758  -2.956
  443    H    GLY  67           H        GLY  67  -2.539   7.513  -1.544
  444   1HA   GLY  67          2HA       GLY  67  -1.114   6.360  -3.764
  445   2HA   GLY  67          1HA       GLY  67  -1.752   5.507  -2.367
  446    H    LEU  68           H        LEU  68  -4.381   7.018  -3.084
  447    HA   LEU  68           HA       LEU  68  -5.605   4.721  -4.041
  448   1HB   LEU  68          2HB       LEU  68  -6.558   7.543  -3.849
  449   2HB   LEU  68          1HB       LEU  68  -7.599   6.238  -4.378
  450    HG   LEU  68           HG       LEU  68  -6.931   5.144  -2.116
  451   1HD1  LEU  68          1HD1      LEU  68  -5.199   6.682  -1.492
  452   2HD1  LEU  68          2HD1      LEU  68  -6.537   6.804  -0.350
  453   3HD1  LEU  68          3HD1      LEU  68  -6.322   8.039  -1.591
  454   1HD2  LEU  68          1HD2      LEU  68  -8.782   7.516  -2.280
  455   2HD2  LEU  68          2HD2      LEU  68  -8.802   6.288  -1.012
  456   3HD2  LEU  68          3HD2      LEU  68  -9.184   5.843  -2.677
  457    H    ARG  69           H        ARG  69  -4.354   7.489  -5.726
  458    HA   ARG  69           HA       ARG  69  -5.576   7.025  -8.234
  459   1HB   ARG  69          2HB       ARG  69  -3.813   8.467  -9.114
  460   2HB   ARG  69          1HB       ARG  69  -4.481   9.140  -7.629
  461   1HG   ARG  69          2HG       ARG  69  -2.600   8.215  -6.376
  462   2HG   ARG  69          1HG       ARG  69  -1.923   7.583  -7.874
  463   1HD   ARG  69          2HD       ARG  69  -2.389  10.486  -7.203
  464   2HD   ARG  69          1HD       ARG  69  -0.835   9.652  -7.250
  465    HE   ARG  69           HE       ARG  69  -2.012   9.323  -9.752
  466   1HH1  ARG  69          1HH1      ARG  69  -0.890  11.965  -7.753
  467   2HH1  ARG  69          2HH1      ARG  69  -0.398  12.951  -9.098
  468   1HH2  ARG  69          1HH2      ARG  69  -1.381  10.594 -11.525
  469   2HH2  ARG  69          2HH2      ARG  69  -0.675  12.156 -11.258
  470    H    TYR  70           H        TYR  70  -2.815   5.691  -6.589
  471    HA   TYR  70           HA       TYR  70  -1.765   4.272  -8.874
  472   1HB   TYR  70          2HB       TYR  70  -1.346   3.971  -5.890
  473   2HB   TYR  70          1HB       TYR  70  -0.350   3.196  -7.126
  474    HD1  TYR  70           1HD      TYR  70  -1.166   6.261  -5.375
  475    HD2  TYR  70           2HD      TYR  70   1.285   4.547  -8.387
  476    HE1  TYR  70           1HE      TYR  70   0.280   8.239  -5.314
  477    HE2  TYR  70           2HE      TYR  70   2.745   6.524  -8.335
  478    HH   TYR  70           HH       TYR  70   2.530   8.892  -5.868
  479    H    ALA  71           H        ALA  71  -3.843   3.915  -6.193
  480    HA   ALA  71           HA       ALA  71  -5.708   2.157  -6.964
  481   1HB   ALA  71          1HB       ALA  71  -5.047  -0.047  -6.094
  482   2HB   ALA  71          2HB       ALA  71  -3.426   0.566  -5.764
  483   3HB   ALA  71          3HB       ALA  71  -3.999   0.440  -7.427
  484    HA   PRO  72           HA       PRO  72  -6.752   3.863  -3.026
  485   1HB   PRO  72          2HB       PRO  72  -8.820   1.835  -2.866
  486   2HB   PRO  72          1HB       PRO  72  -8.949   3.586  -2.869
  487   1HG   PRO  72          2HG       PRO  72  -9.638   2.002  -4.988
  488   2HG   PRO  72          1HG       PRO  72  -9.155   3.699  -5.125
  489   1HD   PRO  72          2HD       PRO  72  -7.687   1.260  -5.859
  490   2HD   PRO  72          1HD       PRO  72  -7.471   2.929  -6.421
  491    H    ARG  73           H        ARG  73  -5.636   0.742  -3.495
  492    HA   ARG  73           HA       ARG  73  -4.977   0.507  -0.672
  493   1HB   ARG  73          2HB       ARG  73  -5.760  -1.773  -0.478
  494   2HB   ARG  73          1HB       ARG  73  -7.104  -0.758  -0.988
  495   1HG   ARG  73          2HG       ARG  73  -6.457  -1.470  -3.367
  496   2HG   ARG  73          1HG       ARG  73  -5.534  -2.744  -2.563
  497   1HD   ARG  73          2HD       ARG  73  -8.476  -2.238  -2.122
  498   2HD   ARG  73          1HD       ARG  73  -7.837  -3.413  -3.271
  499    HE   ARG  73           HE       ARG  73  -6.642  -4.095  -0.931
  500   1HH1  ARG  73          1HH1      ARG  73  -9.973  -3.614  -1.927
  501   2HH1  ARG  73          2HH1      ARG  73 -10.610  -4.779  -0.804
  502   1HH2  ARG  73          1HH2      ARG  73  -7.475  -5.630   0.531
  503   2HH2  ARG  73          2HH2      ARG  73  -9.179  -5.941   0.586
  504    H    ALA  74           H        ALA  74  -3.030  -0.422  -0.360
  505    HA   ALA  74           HA       ALA  74  -1.178  -0.404  -2.438
  506   1HB   ALA  74          1HB       ALA  74  -0.873  -0.158   0.141
  507   2HB   ALA  74          2HB       ALA  74   0.430  -0.785  -0.865
  508   3HB   ALA  74          3HB       ALA  74  -0.571  -1.895   0.062
  509    H    ASP  75           H        ASP  75  -3.185  -3.016  -1.320
  510    HA   ASP  75           HA       ASP  75  -1.450  -5.015  -2.476
  511   1HB   ASP  75          2HB       ASP  75  -3.011  -6.667  -1.723
  512   2HB   ASP  75          1HB       ASP  75  -2.766  -5.511  -0.422
  513    H    LEU  76           H        LEU  76  -3.716  -2.893  -3.609
  514    HA   LEU  76           HA       LEU  76  -4.368  -4.548  -5.935
  515   1HB   LEU  76          2HB       LEU  76  -6.178  -3.234  -4.906
  516   2HB   LEU  76          1HB       LEU  76  -5.265  -1.764  -5.183
  517    HG   LEU  76           HG       LEU  76  -5.414  -2.193  -7.633
  518   1HD1  LEU  76          1HD1      LEU  76  -5.763  -4.602  -7.556
  519   2HD1  LEU  76          2HD1      LEU  76  -7.065  -3.801  -8.436
  520   3HD1  LEU  76          3HD1      LEU  76  -7.331  -4.359  -6.785
  521   1HD2  LEU  76          1HD2      LEU  76  -6.928  -0.645  -6.541
  522   2HD2  LEU  76          2HD2      LEU  76  -8.018  -1.969  -6.131
  523   3HD2  LEU  76          3HD2      LEU  76  -7.767  -1.525  -7.820
  524    H    ALA  77           H        ALA  77  -2.537  -1.781  -4.889
  525    HA   ALA  77           HA       ALA  77  -1.603  -1.045  -7.489
  526   1HB   ALA  77          1HB       ALA  77  -0.568  -0.312  -4.748
  527   2HB   ALA  77          2HB       ALA  77  -1.776   0.589  -5.665
  528   3HB   ALA  77          3HB       ALA  77  -0.123   0.466  -6.266
  529    H    THR  78           H        THR  78   0.618  -1.230  -8.145
  530    HA   THR  78           HA       THR  78   1.687  -3.822  -7.343
  531    HB   THR  78           HB       THR  78   2.979  -3.642  -9.466
  532    HG1  THR  78           1HG      THR  78   3.107  -1.692 -10.284
  533   1HG2  THR  78          1HG2      THR  78   0.888  -4.815  -9.491
  534   2HG2  THR  78          2HG2      THR  78   0.967  -3.824 -10.947
  535   3HG2  THR  78          3HG2      THR  78  -0.013  -3.303  -9.575
  536    H    ARG  79           H        ARG  79   4.281  -3.667  -7.996
  537    HA   ARG  79           HA       ARG  79   5.513  -2.643  -5.767
  538   1HB   ARG  79          2HB       ARG  79   6.714  -3.130  -8.494
  539   2HB   ARG  79          1HB       ARG  79   7.636  -2.889  -7.015
  540   1HG   ARG  79          2HG       ARG  79   6.561  -4.889  -6.061
  541   2HG   ARG  79          1HG       ARG  79   5.738  -5.146  -7.601
  542   1HD   ARG  79          2HD       ARG  79   7.508  -6.241  -8.348
  543   2HD   ARG  79          1HD       ARG  79   8.478  -4.781  -8.162
  544    HE   ARG  79           HE       ARG  79   8.766  -5.610  -5.763
  545   1HH1  ARG  79          1HH1      ARG  79   8.300  -7.713  -8.538
  546   2HH1  ARG  79          2HH1      ARG  79   9.233  -9.013  -7.882
  547   1HH2  ARG  79          1HH2      ARG  79  10.063  -7.356  -4.912
  548   2HH2  ARG  79          2HH2      ARG  79  10.250  -8.810  -5.856
  549    H    GLU  80           H        GLU  80   5.442  -1.213  -9.025
  550    HA   GLU  80           HA       GLU  80   6.968   1.047  -8.326
  551   1HB   GLU  80          2HB       GLU  80   6.002   2.033 -10.434
  552   2HB   GLU  80          1HB       GLU  80   6.821   0.492 -10.605
  553   1HG   GLU  80          2HG       GLU  80   3.904   0.399 -10.184
  554   2HG   GLU  80          1HG       GLU  80   4.478   1.021 -11.735
  555    H    GLU  81           H        GLU  81   3.467   0.611  -8.572
  556    HA   GLU  81           HA       GLU  81   2.678   3.205  -7.893
  557   1HB   GLU  81          2HB       GLU  81   1.490   0.501  -7.811
  558   2HB   GLU  81          1HB       GLU  81   0.696   1.739  -6.854
  559   1HG   GLU  81          2HG       GLU  81  -0.171   1.370  -9.163
  560   2HG   GLU  81          1HG       GLU  81   0.213   3.033  -8.726
  561    H    GLN  82           H        GLN  82   3.069   0.378  -5.807
  562    HA   GLN  82           HA       GLN  82   2.292   1.745  -3.454
  563   1HB   GLN  82          2HB       GLN  82   1.930  -0.583  -3.533
  564   2HB   GLN  82          1HB       GLN  82   3.594  -0.908  -4.001
  565   1HG   GLN  82          2HG       GLN  82   4.398  -0.537  -1.868
  566   2HG   GLN  82          1HG       GLN  82   2.956   0.349  -1.378
  567   1HE2  GLN  82          1HE2      GLN  82   2.681  -2.601  -3.197
  568   2HE2  GLN  82          2HE2      GLN  82   2.074  -3.562  -1.881
  569    H    ILE  83           H        ILE  83   5.354   1.007  -4.968
  570    HA   ILE  83           HA       ILE  83   7.068   1.894  -2.936
  571    HB   ILE  83           HB       ILE  83   7.331   1.707  -5.922
  572   1HG1  ILE  83          2HG1      ILE  83   9.027   0.502  -3.739
  573   2HG1  ILE  83          1HG1      ILE  83   7.555  -0.265  -4.320
  574   1HG2  ILE  83          1HG2      ILE  83   9.362   2.946  -4.072
  575   2HG2  ILE  83          2HG2      ILE  83   8.538   3.729  -5.421
  576   3HG2  ILE  83          3HG2      ILE  83   9.692   2.428  -5.724
  577   1HD1  ILE  83          1HD1      ILE  83   9.527  -1.217  -5.365
  578   2HD1  ILE  83          2HD1      ILE  83   9.989   0.373  -5.971
  579   3HD1  ILE  83          3HD1      ILE  83   8.517  -0.402  -6.559
  580    H    ALA  84           H        ALA  84   5.337   3.659  -5.493
  581    HA   ALA  84           HA       ALA  84   6.717   6.109  -5.137
  582   1HB   ALA  84          1HB       ALA  84   5.472   5.574  -7.167
  583   2HB   ALA  84          2HB       ALA  84   4.911   7.089  -6.457
  584   3HB   ALA  84          3HB       ALA  84   3.964   5.615  -6.256
  585    H    VAL  85           H        VAL  85   3.744   4.820  -3.768
  586    HA   VAL  85           HA       VAL  85   3.009   7.127  -2.306
  587    HB   VAL  85           HB       VAL  85   2.384   4.238  -1.725
  588   1HG1  VAL  85          1HG1      VAL  85   0.387   5.142  -0.592
  589   2HG1  VAL  85          2HG1      VAL  85   0.978   6.778  -0.885
  590   3HG1  VAL  85          3HG1      VAL  85   1.882   5.687   0.168
  591   1HG2  VAL  85          1HG2      VAL  85   0.905   6.244  -3.415
  592   2HG2  VAL  85          2HG2      VAL  85   0.316   4.639  -2.983
  593   3HG2  VAL  85          3HG2      VAL  85   1.756   4.809  -3.988
  594    H    ALA  86           H        ALA  86   4.649   4.114  -1.268
  595    HA   ALA  86           HA       ALA  86   5.320   4.879   1.316
  596   1HB   ALA  86          1HB       ALA  86   6.856   3.092  -0.569
  597   2HB   ALA  86          2HB       ALA  86   5.545   2.592   0.500
  598   3HB   ALA  86          3HB       ALA  86   7.067   3.167   1.181
  599    H    GLU  87           H        GLU  87   6.714   5.690  -1.747
  600    HA   GLU  87           HA       GLU  87   9.215   6.664  -0.933
  601   1HB   GLU  87          2HB       GLU  87   7.405   7.363  -3.227
  602   2HB   GLU  87          1HB       GLU  87   8.880   8.276  -2.957
  603   1HG   GLU  87          2HG       GLU  87   8.861   5.291  -3.253
  604   2HG   GLU  87          1HG       GLU  87   8.965   6.384  -4.632
  605    H    VAL  88           H        VAL  88   6.065   8.317  -1.200
  606    HA   VAL  88           HA       VAL  88   6.961  10.829  -0.289
  607    HB   VAL  88           HB       VAL  88   4.209   9.605   0.120
  608   1HG1  VAL  88          1HG1      VAL  88   5.102  12.487   0.211
  609   2HG1  VAL  88          2HG1      VAL  88   4.660  11.500   1.606
  610   3HG1  VAL  88          3HG1      VAL  88   3.447  11.901   0.386
  611   1HG2  VAL  88          1HG2      VAL  88   4.834   9.689  -2.241
  612   2HG2  VAL  88          2HG2      VAL  88   5.258  11.393  -2.080
  613   3HG2  VAL  88          3HG2      VAL  88   3.584  10.879  -1.881
  614    H    THR  89           H        THR  89   5.698   8.012   1.420
  615    HA   THR  89           HA       THR  89   5.465   9.153   3.956
  616    HB   THR  89           HB       THR  89   6.262   6.298   3.720
  617    HG1  THR  89           1HG      THR  89   3.847   7.394   2.652
  618   1HG2  THR  89          1HG2      THR  89   3.929   7.631   5.069
  619   2HG2  THR  89          2HG2      THR  89   5.500   7.384   5.824
  620   3HG2  THR  89          3HG2      THR  89   4.529   5.994   5.338
  621    H    ARG  90           H        ARG  90   8.150   7.326   2.509
  622    HA   ARG  90           HA       ARG  90   9.682   7.100   4.838
  623   1HB   ARG  90          2HB       ARG  90  11.251   6.052   3.561
  624   2HB   ARG  90          1HB       ARG  90   9.876   5.934   2.482
  625   1HG   ARG  90          2HG       ARG  90  11.484   6.602   1.017
  626   2HG   ARG  90          1HG       ARG  90  10.862   8.177   1.516
  627   1HD   ARG  90          2HD       ARG  90  12.725   8.675   2.751
  628   2HD   ARG  90          1HD       ARG  90  13.082   6.983   3.094
  629    HE   ARG  90           HE       ARG  90  13.472   7.324   0.378
  630   1HH1  ARG  90          1HH1      ARG  90  14.830   8.673   3.330
  631   2HH1  ARG  90          2HH1      ARG  90  16.417   8.853   2.646
  632   1HH2  ARG  90          1HH2      ARG  90  15.550   7.537  -0.486
  633   2HH2  ARG  90          2HH2      ARG  90  16.832   8.220   0.491
  634    H    LEU  91           H        LEU  91   9.418   9.664   2.540
  635    HA   LEU  91           HA       LEU  91  11.903  10.950   3.106
  636   1HB   LEU  91          2HB       LEU  91   9.415  12.367   2.176
  637   2HB   LEU  91          1HB       LEU  91  11.083  12.814   1.880
  638    HG   LEU  91           HG       LEU  91   9.682  10.419   0.726
  639   1HD1  LEU  91          1HD1      LEU  91   8.848  12.505  -0.206
  640   2HD1  LEU  91          2HD1      LEU  91   9.828  11.644  -1.394
  641   3HD1  LEU  91          3HD1      LEU  91  10.500  13.032  -0.538
  642   1HD2  LEU  91          1HD2      LEU  91  12.434  11.541   0.198
  643   2HD2  LEU  91          2HD2      LEU  91  11.685  10.195  -0.665
  644   3HD2  LEU  91          3HD2      LEU  91  12.073  10.040   1.051
  645    H    ARG  92           H        ARG  92   8.873  10.817   4.655
  646    HA   ARG  92           HA       ARG  92   9.182  13.354   6.014
  647   1HB   ARG  92          2HB       ARG  92   7.008  11.365   6.518
  648   2HB   ARG  92          1HB       ARG  92   6.962  13.114   6.698
  649   1HG   ARG  92          2HG       ARG  92   6.845  13.453   4.375
  650   2HG   ARG  92          1HG       ARG  92   7.297  11.779   4.034
  651   1HD   ARG  92          2HD       ARG  92   4.703  12.881   5.002
  652   2HD   ARG  92          1HD       ARG  92   5.025  11.734   3.700
  653    HE   ARG  92           HE       ARG  92   5.837  10.464   5.973
  654   1HH1  ARG  92          1HH1      ARG  92   2.847  11.902   4.842
  655   2HH1  ARG  92          2HH1      ARG  92   1.832  10.861   5.803
  656   1HH2  ARG  92          1HH2      ARG  92   4.487   9.073   7.237
  657   2HH2  ARG  92          2HH2      ARG  92   2.758   9.249   7.139
  658    H    GLN  93           H        GLN  93   8.878   9.923   6.787
  659    HA   GLN  93           HA       GLN  93   9.467  10.618   9.545
  660   1HB   GLN  93          2HB       GLN  93   8.181   8.907  10.252
  661   2HB   GLN  93          1HB       GLN  93   7.458   9.161   8.671
  662   1HG   GLN  93          2HG       GLN  93   9.551   7.083   9.262
  663   2HG   GLN  93          1HG       GLN  93   7.814   6.790   9.293
  664   1HE2  GLN  93          1HE2      GLN  93   6.659   6.839   7.355
  665   2HE2  GLN  93          2HE2      GLN  93   7.460   6.645   5.830
  666    H    GLY  94           H        GLY  94  10.937   8.861   6.906
  667   1HA   GLY  94          2HA       GLY  94  13.241   8.483   6.726
  668   2HA   GLY  94          1HA       GLY  94  13.420   8.897   8.426
  669    H    TRP  95           H        TRP  95  11.419   6.503   6.790
  670    HA   TRP  95           HA       TRP  95  11.137   4.276   7.044
  671   1HB   TRP  95          2HB       TRP  95  13.973   4.000   7.998
  672   2HB   TRP  95          1HB       TRP  95  13.019   2.885   7.019
  673    HD1  TRP  95           HD       TRP  95  14.982   6.159   6.719
  674    HE1  TRP  95           1HE      TRP  95  15.629   6.506   4.263
  675    HE3  TRP  95           3HE      TRP  95  12.346   2.303   4.670
  676    HZ2  TRP  95           2HZ      TRP  95  15.075   5.297   1.764
  677    HZ3  TRP  95           3HZ      TRP  95  12.444   1.974   2.236
  678    HH2  TRP  95           HH       TRP  95  13.779   3.441   0.814
  679    H    GLY  96           H        GLY  96  11.038   6.244   9.342
  680   1HA   GLY  96          2HA       GLY  96  11.383   4.628  11.686
  681   2HA   GLY  96          1HA       GLY  96  10.548   6.170  11.600
  682    H    ALA  97           H        ALA  97   8.926   4.940   9.323
  683    HA   ALA  97           HA       ALA  97   6.821   3.844  10.969
  684   1HB   ALA  97          1HB       ALA  97   6.968   4.243   7.980
  685   2HB   ALA  97          2HB       ALA  97   6.235   5.350   9.142
  686   3HB   ALA  97          3HB       ALA  97   5.531   3.754   8.876
  687    H    TRP  98           H        TRP  98   9.215   2.758   8.694
  688    HA   TRP  98           HA       TRP  98   8.305  -0.017   8.994
  689   1HB   TRP  98          2HB       TRP  98  10.305   1.203   7.069
  690   2HB   TRP  98          1HB       TRP  98   9.739  -0.464   7.049
  691    HD1  TRP  98           HD       TRP  98   7.215  -0.888   6.248
  692    HE1  TRP  98           1HE      TRP  98   5.686   0.440   4.671
  693    HE3  TRP  98           3HE      TRP  98   9.674   3.647   6.320
  694    HZ2  TRP  98           2HZ      TRP  98   5.545   3.042   3.562
  695    HZ3  TRP  98           3HZ      TRP  98   8.762   5.479   4.960
  696    HH2  TRP  98           HH       TRP  98   6.743   5.179   3.626
  697    HA   PRO  99           HA       PRO  99  11.718   0.176  11.911
  698   1HB   PRO  99          2HB       PRO  99  10.611  -2.267  13.063
  699   2HB   PRO  99          1HB       PRO  99  10.787  -0.666  13.771
  700   1HG   PRO  99          2HG       PRO  99   8.373  -1.611  13.112
  701   2HG   PRO  99          1HG       PRO  99   8.813   0.099  12.892
  702   1HD   PRO  99          2HD       PRO  99   8.839  -2.103  10.830
  703   2HD   PRO  99          1HD       PRO  99   8.055  -0.503  10.739
  704    H    VAL 100           H        VAL 100  11.186  -3.312  11.860
  705    HA   VAL 100           HA       VAL 100  13.997  -3.713  11.632
  706    HB   VAL 100           HB       VAL 100  12.271  -5.149  12.858
  707   1HG1  VAL 100          1HG1      VAL 100  11.935  -6.320  10.118
  708   2HG1  VAL 100          2HG1      VAL 100  10.692  -5.558  11.109
  709   3HG1  VAL 100          3HG1      VAL 100  11.404  -7.091  11.611
  710   1HG2  VAL 100          1HG2      VAL 100  13.611  -7.197  12.570
  711   2HG2  VAL 100          2HG2      VAL 100  14.609  -5.754  12.750
  712   3HG2  VAL 100          3HG2      VAL 100  14.372  -6.469  11.156
  713    H    CYS 101           H        CYS 101  11.349  -3.675   9.503
  714    HA   CYS 101           HA       CYS 101  12.498  -5.270   7.441
  715   1HB   CYS 101          2HB       CYS 101  10.112  -3.421   7.414
  716   2HB   CYS 101          1HB       CYS 101  10.565  -4.479   6.078
  717    H    ALA 102           H        ALA 102  12.258  -1.774   7.986
  718    HA   ALA 102           HA       ALA 102  13.365  -1.092   5.451
  719   1HB   ALA 102          1HB       ALA 102  12.050   0.506   6.742
  720   2HB   ALA 102          2HB       ALA 102  13.653   1.139   6.366
  721   3HB   ALA 102          3HB       ALA 102  13.301   0.533   7.986
  722    H    ALA 103           H        ALA 103  14.712  -1.517   8.695
  723    HA   ALA 103           HA       ALA 103  17.346  -0.777   8.128
  724   1HB   ALA 103          1HB       ALA 103  17.968  -2.100  10.096
  725   2HB   ALA 103          2HB       ALA 103  16.363  -2.835  10.102
  726   3HB   ALA 103          3HB       ALA 103  16.543  -1.107  10.402
  727    H    ARG 104           H        ARG 104  15.755  -3.914   7.926
  728    HA   ARG 104           HA       ARG 104  18.040  -5.329   6.998
  729   1HB   ARG 104          2HB       ARG 104  15.166  -5.888   7.429
  730   2HB   ARG 104          1HB       ARG 104  15.988  -6.909   6.256
  731   1HG   ARG 104          2HG       ARG 104  16.024  -7.972   8.401
  732   2HG   ARG 104          1HG       ARG 104  17.658  -7.495   7.965
  733   1HD   ARG 104          2HD       ARG 104  15.920  -5.800   9.739
  734   2HD   ARG 104          1HD       ARG 104  16.901  -7.115  10.378
  735    HE   ARG 104           HE       ARG 104  18.072  -4.840   8.907
  736   1HH1  ARG 104          1HH1      ARG 104  18.087  -7.095  11.576
  737   2HH1  ARG 104          2HH1      ARG 104  19.480  -6.399  12.333
  738   1HH2  ARG 104          1HH2      ARG 104  19.940  -3.917   9.889
  739   2HH2  ARG 104          2HH2      ARG 104  20.542  -4.598  11.374
  740    H    ALA 105           H        ALA 105  15.781  -3.293   5.444
  741    HA   ALA 105           HA       ALA 105  16.248  -4.413   2.783
  742   1HB   ALA 105          1HB       ALA 105  14.616  -2.040   3.663
  743   2HB   ALA 105          2HB       ALA 105  14.008  -3.676   3.404
  744   3HB   ALA 105          3HB       ALA 105  14.643  -2.746   2.047
  745    H    GLY 106           H        GLY 106  17.441  -1.917   4.841
  746   1HA   GLY 106          2HA       GLY 106  19.576  -0.889   4.270
  747   2HA   GLY 106          1HA       GLY 106  19.024  -0.818   2.603
  748    H    ALA 107           H        ALA 107  17.956   0.265   5.808
  749    HA   ALA 107           HA       ALA 107  16.371   2.401   4.890
  750   1HB   ALA 107          1HB       ALA 107  16.069   1.351   7.087
  751   2HB   ALA 107          2HB       ALA 107  16.279   3.096   7.217
  752   3HB   ALA 107          3HB       ALA 107  17.616   2.016   7.612
  753    H    ARG 108           H        ARG 108  16.759   4.695   5.097
  754    HA   ARG 108           HA       ARG 108  19.614   5.353   4.871
  755   1HB   ARG 108          2HB       ARG 108  17.479   6.231   2.918
  756   2HB   ARG 108          1HB       ARG 108  19.196   6.609   2.833
  757   1HG   ARG 108          2HG       ARG 108  19.741   4.303   2.426
  758   2HG   ARG 108          1HG       ARG 108  18.061   3.815   2.676
  759   1HD   ARG 108          2HD       ARG 108  18.475   3.887   0.319
  760   2HD   ARG 108          1HD       ARG 108  17.443   5.259   0.728
  761    HE   ARG 108           HE       ARG 108  20.292   5.807   0.665
  762   1HH1  ARG 108          1HH1      ARG 108  17.267   5.801  -1.114
  763   2HH1  ARG 108          2HH1      ARG 108  17.830   6.952  -2.295
  764   1HH2  ARG 108          1HH2      ARG 108  21.018   7.331  -0.882
  765   2HH2  ARG 108          2HH2      ARG 108  19.947   7.825  -2.168
  Start of MODEL   13
    1   1H    ASN   1          1HT       ASN   1   8.655  -1.926 -61.702
    2   2H    ASN   1          2HT       ASN   1   8.575  -1.503 -63.343
    3   3H    ASN   1          3HT       ASN   1  10.057  -1.459 -62.520
    4    HA   ASN   1           HA       ASN   1   8.456  -3.904 -62.952
    5   1HB   ASN   1          2HB       ASN   1  10.866  -2.842 -64.434
    6   2HB   ASN   1          1HB       ASN   1  10.341  -4.522 -64.524
    7   1HD2  ASN   1          1HD2      ASN   1   8.450  -5.031 -65.634
    8   2HD2  ASN   1          2HD2      ASN   1   7.681  -3.900 -66.696
    9    H    VAL   2           H        VAL   2   9.195  -5.640 -61.935
   10    HA   VAL   2           HA       VAL   2  10.056  -6.819 -60.231
   11    HB   VAL   2           HB       VAL   2  12.423  -5.512 -61.454
   12   1HG1  VAL   2          1HG1      VAL   2  13.068  -5.906 -59.121
   13   2HG1  VAL   2          2HG1      VAL   2  13.896  -7.043 -60.184
   14   3HG1  VAL   2          3HG1      VAL   2  12.503  -7.572 -59.240
   15   1HG2  VAL   2          1HG2      VAL   2  11.419  -8.342 -61.441
   16   2HG2  VAL   2          2HG2      VAL   2  12.870  -7.779 -62.273
   17   3HG2  VAL   2          3HG2      VAL   2  11.284  -7.180 -62.762
   18    H    VAL   3           H        VAL   3   8.954  -5.857 -58.610
   19    HA   VAL   3           HA       VAL   3   9.514  -3.366 -57.499
   20    HB   VAL   3           HB       VAL   3   7.983  -5.678 -56.314
   21   1HG1  VAL   3          1HG1      VAL   3   8.007  -2.771 -55.508
   22   2HG1  VAL   3          2HG1      VAL   3   8.668  -4.114 -54.576
   23   3HG1  VAL   3          3HG1      VAL   3   6.931  -4.010 -54.862
   24   1HG2  VAL   3          1HG2      VAL   3   6.009  -4.481 -57.110
   25   2HG2  VAL   3          2HG2      VAL   3   7.091  -4.884 -58.445
   26   3HG2  VAL   3          3HG2      VAL   3   7.042  -3.237 -57.815
   27    H    VAL   4           H        VAL   4  11.217  -2.784 -56.348
   28    HA   VAL   4           HA       VAL   4  12.225  -4.630 -54.278
   29    HB   VAL   4           HB       VAL   4  13.447  -1.984 -55.029
   30   1HG1  VAL   4          1HG1      VAL   4  14.552  -4.421 -53.654
   31   2HG1  VAL   4          2HG1      VAL   4  14.152  -2.875 -52.905
   32   3HG1  VAL   4          3HG1      VAL   4  15.480  -2.979 -54.060
   33   1HG2  VAL   4          1HG2      VAL   4  14.107  -4.678 -56.215
   34   2HG2  VAL   4          2HG2      VAL   4  15.049  -3.205 -56.448
   35   3HG2  VAL   4          3HG2      VAL   4  13.400  -3.303 -57.065
   36    H    THR   5           H        THR   5  12.150  -3.959 -52.131
   37    HA   THR   5           HA       THR   5   9.955  -2.105 -51.687
   38    HB   THR   5           HB       THR   5   9.600  -4.173 -50.622
   39    HG1  THR   5           1HG      THR   5  10.367  -2.127 -48.811
   40   1HG2  THR   5          1HG2      THR   5  11.120  -5.157 -48.974
   41   2HG2  THR   5          2HG2      THR   5  12.271  -3.850 -49.247
   42   3HG2  THR   5          3HG2      THR   5  11.911  -4.993 -50.541
   43    HA   PRO   6           HA       PRO   6  12.752   0.915 -49.905
   44   1HB   PRO   6          2HB       PRO   6  10.690   2.848 -50.166
   45   2HB   PRO   6          1HB       PRO   6  12.096   2.646 -51.211
   46   1HG   PRO   6          2HG       PRO   6   9.457   2.220 -51.958
   47   2HG   PRO   6          1HG       PRO   6  10.881   1.609 -52.814
   48   1HD   PRO   6          2HD       PRO   6   9.086   0.208 -50.881
   49   2HD   PRO   6          1HD       PRO   6   9.874  -0.421 -52.345
   50    H    ALA   7           H        ALA   7  12.464   2.351 -48.099
   51    HA   ALA   7           HA       ALA   7  12.133   2.570 -45.862
   52   1HB   ALA   7          1HB       ALA   7  10.077   3.593 -46.763
   53   2HB   ALA   7          2HB       ALA   7   9.854   2.901 -45.155
   54   3HB   ALA   7          3HB       ALA   7   9.257   2.044 -46.577
   55    H    HIS   8           H        HIS   8  12.399  -0.212 -47.047
   56    HA   HIS   8           HA       HIS   8  11.417  -1.880 -44.922
   57   1HB   HIS   8          2HB       HIS   8  11.846  -2.759 -47.212
   58   2HB   HIS   8          1HB       HIS   8  13.555  -2.400 -47.005
   59    HD1  HIS   8           1HD      HIS   8  14.894  -4.406 -46.358
   60    HD2  HIS   8           2HD      HIS   8  10.956  -4.648 -45.039
   61    HE1  HIS   8           1HE      HIS   8  14.669  -6.636 -45.190
   62    H    GLU   9           H        GLU   9  13.649   0.478 -45.168
   63    HA   GLU   9           HA       GLU   9  15.976  -0.613 -44.000
   64   1HB   GLU   9          2HB       GLU   9  16.627   1.731 -43.604
   65   2HB   GLU   9          1HB       GLU   9  16.061   1.456 -45.244
   66   1HG   GLU   9          2HG       GLU   9  13.869   2.383 -44.616
   67   2HG   GLU   9          1HG       GLU   9  14.504   2.729 -43.008
   68    H    ALA  10           H        ALA  10  16.769  -0.524 -41.934
   69    HA   ALA  10           HA       ALA  10  14.719  -0.314 -39.855
   70   1HB   ALA  10          1HB       ALA  10  16.137  -1.792 -38.508
   71   2HB   ALA  10          2HB       ALA  10  17.335  -1.823 -39.801
   72   3HB   ALA  10          3HB       ALA  10  15.742  -2.533 -40.059
   73    H    VAL  11           H        VAL  11  15.231   1.968 -40.345
   74    HA   VAL  11           HA       VAL  11  17.526   3.286 -39.496
   75    HB   VAL  11           HB       VAL  11  15.788   4.393 -40.784
   76   1HG1  VAL  11          1HG1      VAL  11  13.833   3.347 -39.798
   77   2HG1  VAL  11          2HG1      VAL  11  13.681   5.105 -39.774
   78   3HG1  VAL  11          3HG1      VAL  11  14.096   4.236 -38.296
   79   1HG2  VAL  11          1HG2      VAL  11  17.287   5.809 -39.502
   80   2HG2  VAL  11          2HG2      VAL  11  16.213   5.714 -38.105
   81   3HG2  VAL  11          3HG2      VAL  11  15.678   6.528 -39.577
   82    H    VAL  12           H        VAL  12  14.985   1.862 -37.642
   83    HA   VAL  12           HA       VAL  12  14.332   1.900 -35.500
   84    HB   VAL  12           HB       VAL  12  17.242   1.465 -35.559
   85   1HG1  VAL  12          1HG1      VAL  12  17.130   0.523 -33.272
   86   2HG1  VAL  12          2HG1      VAL  12  15.453   1.060 -33.159
   87   3HG1  VAL  12          3HG1      VAL  12  16.752   2.246 -33.284
   88   1HG2  VAL  12          1HG2      VAL  12  15.918  -0.194 -36.665
   89   2HG2  VAL  12          2HG2      VAL  12  14.898  -0.375 -35.237
   90   3HG2  VAL  12          3HG2      VAL  12  16.586  -0.886 -35.186
   91    H    ARG  13           H        ARG  13  13.541   3.872 -35.161
   92    HA   ARG  13           HA       ARG  13  15.216   6.000 -34.190
   93   1HB   ARG  13          2HB       ARG  13  13.234   7.386 -34.224
   94   2HB   ARG  13          1HB       ARG  13  13.391   6.548 -35.759
   95   1HG   ARG  13          2HG       ARG  13  11.723   4.885 -34.932
   96   2HG   ARG  13          1HG       ARG  13  11.492   5.915 -33.518
   97   1HD   ARG  13          2HD       ARG  13   9.778   6.521 -35.004
   98   2HD   ARG  13          1HD       ARG  13  10.992   7.789 -35.157
   99    HE   ARG  13           HE       ARG  13  10.819   5.557 -37.078
  100   1HH1  ARG  13          1HH1      ARG  13  11.104   8.981 -36.389
  101   2HH1  ARG  13          2HH1      ARG  13  11.104   9.445 -38.066
  102   1HH2  ARG  13          1HH2      ARG  13  10.861   6.145 -39.260
  103   2HH2  ARG  13          2HH2      ARG  13  10.988   7.822 -39.711
  104    H    VAL  14           H        VAL  14  15.721   6.056 -32.197
  105    HA   VAL  14           HA       VAL  14  14.487   4.351 -30.265
  106    HB   VAL  14           HB       VAL  14  16.613   6.368 -29.648
  107   1HG1  VAL  14          1HG1      VAL  14  15.969   3.649 -28.530
  108   2HG1  VAL  14          2HG1      VAL  14  15.733   5.209 -27.741
  109   3HG1  VAL  14          3HG1      VAL  14  17.365   4.621 -28.065
  110   1HG2  VAL  14          1HG2      VAL  14  18.316   4.724 -30.285
  111   2HG2  VAL  14          2HG2      VAL  14  17.345   5.228 -31.670
  112   3HG2  VAL  14          3HG2      VAL  14  17.051   3.665 -30.907
  113    H    GLY  15           H        GLY  15  13.942   5.120 -28.191
  114   1HA   GLY  15          2HA       GLY  15  13.419   7.465 -27.136
  115   2HA   GLY  15          1HA       GLY  15  12.143   7.368 -28.343
  116    H    THR  16           H        THR  16  13.449   5.987 -25.427
  117    HA   THR  16           HA       THR  16  11.576   3.932 -25.067
  118    HB   THR  16           HB       THR  16  13.045   5.413 -22.892
  119    HG1  THR  16           1HG      THR  16  14.864   4.394 -23.480
  120   1HG2  THR  16          1HG2      THR  16  12.187   2.537 -23.167
  121   2HG2  THR  16          2HG2      THR  16  11.410   3.754 -22.157
  122   3HG2  THR  16          3HG2      THR  16  13.054   3.229 -21.797
  123    H    LYS  17           H        LYS  17  11.712   7.253 -24.198
  124    HA   LYS  17           HA       LYS  17  10.285   8.709 -23.161
  125   1HB   LYS  17          2HB       LYS  17   8.596   7.304 -25.204
  126   2HB   LYS  17          1HB       LYS  17   8.143   8.826 -24.448
  127   1HG   LYS  17          2HG       LYS  17  10.542   8.310 -26.197
  128   2HG   LYS  17          1HG       LYS  17   9.091   9.213 -26.636
  129   1HD   LYS  17          2HD       LYS  17   9.599  10.897 -24.965
  130   2HD   LYS  17          1HD       LYS  17  11.006   9.972 -24.433
  131   1HE   LYS  17          2HE       LYS  17  11.707  11.786 -25.876
  132   2HE   LYS  17          1HE       LYS  17  12.003  10.238 -26.665
  133   1HZ   LYS  17          1HZ       LYS  17  11.056  11.799 -28.217
  134   2HZ   LYS  17          2HZ       LYS  17   9.733  12.081 -27.203
  135   3HZ   LYS  17          3HZ       LYS  17   9.938  10.560 -27.930
  136    HA   PRO  18           HA       PRO  18   8.282   5.776 -20.166
  137   1HB   PRO  18          2HB       PRO  18   9.307   7.813 -18.287
  138   2HB   PRO  18          1HB       PRO  18   9.447   6.052 -18.224
  139   1HG   PRO  18          2HG       PRO  18  11.554   7.557 -18.818
  140   2HG   PRO  18          1HG       PRO  18  11.270   6.017 -19.653
  141   1HD   PRO  18          2HD       PRO  18  10.677   8.806 -20.589
  142   2HD   PRO  18          1HD       PRO  18  11.441   7.470 -21.477
  143    H    GLY  19           H        GLY  19   6.678   6.255 -18.614
  144   1HA   GLY  19          2HA       GLY  19   5.140   8.125 -17.826
  145   2HA   GLY  19          1HA       GLY  19   5.010   8.495 -19.544
  146    H    THR  20           H        THR  20   4.680   6.274 -20.816
  147    HA   THR  20           HA       THR  20   2.241   5.065 -20.048
  148    HB   THR  20           HB       THR  20   4.363   4.001 -21.933
  149    HG1  THR  20           1HG      THR  20   2.791   6.175 -22.128
  150   1HG2  THR  20          1HG2      THR  20   2.717   2.330 -21.304
  151   2HG2  THR  20          2HG2      THR  20   2.482   2.824 -22.982
  152   3HG2  THR  20          3HG2      THR  20   1.410   3.435 -21.721
  153    H    GLU  21           H        GLU  21   5.581   4.439 -19.455
  154    HA   GLU  21           HA       GLU  21   4.917   2.266 -17.649
  155   1HB   GLU  21          2HB       GLU  21   7.400   2.517 -19.361
  156   2HB   GLU  21          1HB       GLU  21   7.105   1.254 -18.174
  157   1HG   GLU  21          2HG       GLU  21   5.300   0.366 -19.468
  158   2HG   GLU  21          1HG       GLU  21   5.372   1.727 -20.587
  159    H    VAL  22           H        VAL  22   5.842   2.437 -15.682
  160    HA   VAL  22           HA       VAL  22   6.807   5.056 -14.962
  161    HB   VAL  22           HB       VAL  22   6.336   2.608 -13.252
  162   1HG1  VAL  22          1HG1      VAL  22   6.817   5.473 -12.440
  163   2HG1  VAL  22          2HG1      VAL  22   7.913   4.115 -12.183
  164   3HG1  VAL  22          3HG1      VAL  22   6.358   4.162 -11.353
  165   1HG2  VAL  22          1HG2      VAL  22   4.619   5.045 -13.710
  166   2HG2  VAL  22          2HG2      VAL  22   4.267   3.731 -12.587
  167   3HG2  VAL  22          3HG2      VAL  22   4.305   3.422 -14.324
  168    HA   PRO  23           HA       PRO  23  11.151   4.187 -15.426
  169   1HB   PRO  23          2HB       PRO  23  11.284   6.339 -13.368
  170   2HB   PRO  23          1HB       PRO  23  12.140   6.202 -14.909
  171   1HG   PRO  23          2HG       PRO  23  10.084   7.871 -14.640
  172   2HG   PRO  23          1HG       PRO  23  10.321   6.949 -16.137
  173   1HD   PRO  23          2HD       PRO  23   8.375   6.528 -13.928
  174   2HD   PRO  23          1HD       PRO  23   8.180   6.267 -15.670
  175    HA   PRO  24           HA       PRO  24  11.896   1.369 -12.133
  176   1HB   PRO  24          2HB       PRO  24  14.677   1.495 -12.233
  177   2HB   PRO  24          1HB       PRO  24  13.657   0.429 -13.204
  178   1HG   PRO  24          2HG       PRO  24  14.836   3.085 -13.914
  179   2HG   PRO  24          1HG       PRO  24  14.682   1.621 -14.910
  180   1HD   PRO  24          2HD       PRO  24  12.992   3.628 -15.259
  181   2HD   PRO  24          1HD       PRO  24  12.397   1.954 -15.244
  182    H    VAL  25           H        VAL  25  12.115   1.484 -10.055
  183    HA   VAL  25           HA       VAL  25  13.063   3.939  -8.812
  184    HB   VAL  25           HB       VAL  25  10.856   3.070  -8.152
  185   1HG1  VAL  25          1HG1      VAL  25  12.386   0.655  -7.272
  186   2HG1  VAL  25          2HG1      VAL  25  11.095   0.745  -8.470
  187   3HG1  VAL  25          3HG1      VAL  25  10.737   1.019  -6.765
  188   1HG2  VAL  25          1HG2      VAL  25  12.921   2.967  -5.974
  189   2HG2  VAL  25          2HG2      VAL  25  11.186   3.122  -5.717
  190   3HG2  VAL  25          3HG2      VAL  25  12.072   4.397  -6.553
  191    H    ILE  26           H        ILE  26  14.933   4.053  -7.742
  192    HA   ILE  26           HA       ILE  26  16.653   1.739  -7.632
  193    HB   ILE  26           HB       ILE  26  17.152   4.553  -6.653
  194   1HG1  ILE  26          2HG1      ILE  26  16.789   4.523  -9.054
  195   2HG1  ILE  26          1HG1      ILE  26  18.502   4.769  -8.731
  196   1HG2  ILE  26          1HG2      ILE  26  18.596   2.936  -5.542
  197   2HG2  ILE  26          2HG2      ILE  26  19.522   3.934  -6.664
  198   3HG2  ILE  26          3HG2      ILE  26  19.087   2.283  -7.106
  199   1HD1  ILE  26          1HD1      ILE  26  18.174   3.235 -10.575
  200   2HD1  ILE  26          2HD1      ILE  26  17.207   2.178  -9.545
  201   3HD1  ILE  26          3HD1      ILE  26  18.924   2.409  -9.209
  202    H    ASP  27           H        ASP  27  14.663   3.572  -5.476
  203    HA   ASP  27           HA       ASP  27  15.808   2.408  -3.098
  204   1HB   ASP  27          2HB       ASP  27  13.484   4.275  -3.504
  205   2HB   ASP  27          1HB       ASP  27  13.962   3.650  -1.933
  206    H    GLY  28           H        GLY  28  13.834   1.441  -5.411
  207   1HA   GLY  28          2HA       GLY  28  11.693   0.259  -3.940
  208   2HA   GLY  28          1HA       GLY  28  12.132  -0.106  -5.603
  209    H    SER  29           H        SER  29  14.931  -0.374  -4.210
  210    HA   SER  29           HA       SER  29  14.790  -3.235  -3.863
  211   1HB   SER  29          2HB       SER  29  17.040  -1.324  -3.269
  212   2HB   SER  29          1HB       SER  29  17.170  -3.078  -3.363
  213    HG   SER  29           HG       SER  29  16.398  -2.846  -5.586
  214    H    ILE  30           H        ILE  30  15.077  -0.400  -1.897
  215    HA   ILE  30           HA       ILE  30  15.241  -1.748   0.622
  216    HB   ILE  30           HB       ILE  30  14.037   0.955   0.639
  217   1HG1  ILE  30          2HG1      ILE  30  16.730   0.439  -0.638
  218   2HG1  ILE  30          1HG1      ILE  30  15.401   1.425  -1.245
  219   1HG2  ILE  30          1HG2      ILE  30  16.450  -0.229   1.990
  220   2HG2  ILE  30          2HG2      ILE  30  14.819  -0.140   2.653
  221   3HG2  ILE  30          3HG2      ILE  30  15.730   1.339   2.350
  222   1HD1  ILE  30          1HD1      ILE  30  15.809   3.052   0.526
  223   2HD1  ILE  30          2HD1      ILE  30  17.222   2.813  -0.502
  224   3HD1  ILE  30          3HD1      ILE  30  17.161   2.076   1.099
  225    H    TRP  31           H        TRP  31  12.788  -0.468  -1.467
  226    HA   TRP  31           HA       TRP  31  10.633  -0.752   0.360
  227   1HB   TRP  31          2HB       TRP  31  10.702  -0.273  -2.648
  228   2HB   TRP  31          1HB       TRP  31   9.211  -0.396  -1.712
  229    HD1  TRP  31           HD       TRP  31  11.276   2.198  -3.032
  230    HE1  TRP  31           1HE      TRP  31  11.079   4.387  -1.662
  231    HE3  TRP  31           3HE      TRP  31   9.175   0.294   1.166
  232    HZ2  TRP  31           2HZ      TRP  31  10.164   5.152   0.885
  233    HZ3  TRP  31           3HZ      TRP  31   8.673   1.795   3.045
  234    HH2  TRP  31           HH       TRP  31   9.163   4.178   2.902
  235    H    ASP  32           H        ASP  32  12.005  -2.731  -2.195
  236    HA   ASP  32           HA       ASP  32   9.981  -4.739  -1.948
  237   1HB   ASP  32          2HB       ASP  32  11.052  -4.415  -4.072
  238   2HB   ASP  32          1HB       ASP  32  12.644  -4.705  -3.362
  239    H    ALA  33           H        ALA  33  13.171  -4.157  -0.545
  240    HA   ALA  33           HA       ALA  33  13.415  -6.753   0.564
  241   1HB   ALA  33          1HB       ALA  33  14.697  -4.183   1.467
  242   2HB   ALA  33          2HB       ALA  33  15.355  -5.307   0.278
  243   3HB   ALA  33          3HB       ALA  33  15.176  -5.807   1.960
  244    H    ILE  34           H        ILE  34  11.981  -3.723   1.654
  245    HA   ILE  34           HA       ILE  34  11.182  -4.589   4.231
  246    HB   ILE  34           HB       ILE  34   9.943  -2.604   2.332
  247   1HG1  ILE  34          2HG1      ILE  34  11.588  -2.239   4.851
  248   2HG1  ILE  34          1HG1      ILE  34  12.180  -2.032   3.206
  249   1HG2  ILE  34          1HG2      ILE  34   8.626  -1.784   4.249
  250   2HG2  ILE  34          2HG2      ILE  34   9.225  -3.130   5.218
  251   3HG2  ILE  34          3HG2      ILE  34   8.204  -3.442   3.814
  252   1HD1  ILE  34          1HD1      ILE  34  10.049  -0.383   4.543
  253   2HD1  ILE  34          2HD1      ILE  34  10.635  -0.170   2.894
  254   3HD1  ILE  34          3HD1      ILE  34  11.721   0.102   4.257
  255    H    ALA  35           H        ALA  35   9.559  -4.663   1.080
  256    HA   ALA  35           HA       ALA  35   7.218  -5.975   1.839
  257   1HB   ALA  35          1HB       ALA  35   8.733  -6.175  -0.756
  258   2HB   ALA  35          2HB       ALA  35   7.511  -4.969  -0.351
  259   3HB   ALA  35          3HB       ALA  35   7.059  -6.667  -0.503
  260    H    GLY  36           H        GLY  36  10.388  -7.199   0.981
  261   1HA   GLY  36          2HA       GLY  36   9.603  -9.969   1.087
  262   2HA   GLY  36          1HA       GLY  36  11.247  -9.355   0.975
  263    H    CYS  37           H        CYS  37  10.102  -7.671   3.409
  264    HA   CYS  37           HA       CYS  37  11.230  -9.471   5.380
  265   1HB   CYS  37          2HB       CYS  37  12.184  -7.308   5.436
  266   2HB   CYS  37          1HB       CYS  37  10.612  -6.527   5.341
  267    H    GLU  38           H        GLU  38   8.381  -7.294   5.280
  268    HA   GLU  38           HA       GLU  38   7.243  -8.922   7.417
  269   1HB   GLU  38          2HB       GLU  38   6.681  -6.176   6.406
  270   2HB   GLU  38          1HB       GLU  38   5.390  -7.056   7.218
  271   1HG   GLU  38          2HG       GLU  38   6.924  -7.418   9.134
  272   2HG   GLU  38          1HG       GLU  38   8.098  -6.382   8.330
  273    H    ALA  39           H        ALA  39   6.725  -8.127   4.062
  274    HA   ALA  39           HA       ALA  39   4.141  -9.412   4.088
  275   1HB   ALA  39          1HB       ALA  39   3.917  -8.695   1.786
  276   2HB   ALA  39          2HB       ALA  39   5.595  -8.150   1.787
  277   3HB   ALA  39          3HB       ALA  39   4.408  -7.351   2.816
  278    H    GLY  40           H        GLY  40   7.334 -10.332   3.629
  279   1HA   GLY  40          2HA       GLY  40   8.192 -12.438   3.170
  280   2HA   GLY  40          1HA       GLY  40   6.548 -13.000   2.872
  281    H    GLY  41           H        GLY  41   7.349 -10.157   1.332
  282   1HA   GLY  41          2HA       GLY  41   7.858  -9.590  -0.799
  283   2HA   GLY  41          1HA       GLY  41   8.348 -11.255  -1.123
  284    H    ASN  42           H        ASN  42   5.360  -9.510  -0.276
  285    HA   ASN  42           HA       ASN  42   4.030 -10.614  -2.596
  286   1HB   ASN  42          2HB       ASN  42   3.720 -12.291  -0.741
  287   2HB   ASN  42          1HB       ASN  42   2.911 -11.028   0.183
  288   1HD2  ASN  42          1HD2      ASN  42   2.497 -11.323  -3.293
  289   2HD2  ASN  42          2HD2      ASN  42   0.853 -11.872  -3.227
  290    H    TRP  43           H        TRP  43   3.350  -8.798  -3.468
  291    HA   TRP  43           HA       TRP  43   2.822  -6.488  -1.811
  292   1HB   TRP  43          2HB       TRP  43   2.773  -6.858  -4.806
  293   2HB   TRP  43          1HB       TRP  43   2.641  -5.314  -3.970
  294    HD1  TRP  43           HD       TRP  43   5.185  -8.244  -4.144
  295    HE1  TRP  43           1HE      TRP  43   7.560  -7.231  -4.069
  296    HE3  TRP  43           3HE      TRP  43   3.948  -3.323  -3.625
  297    HZ2  TRP  43           2HZ      TRP  43   8.745  -4.679  -3.808
  298    HZ3  TRP  43           3HZ      TRP  43   5.735  -1.649  -3.486
  299    HH2  TRP  43           HH       TRP  43   8.101  -2.342  -3.600
  300    H    ALA  44           H        ALA  44   1.095  -9.039  -3.085
  301    HA   ALA  44           HA       ALA  44  -1.427  -7.523  -3.106
  302   1HB   ALA  44          1HB       ALA  44  -0.860 -10.259  -4.240
  303   2HB   ALA  44          2HB       ALA  44  -0.921  -8.758  -5.164
  304   3HB   ALA  44          3HB       ALA  44  -2.375  -9.369  -4.376
  305    H    ILE  45           H        ILE  45   0.254  -8.875  -0.852
  306    HA   ILE  45           HA       ILE  45  -1.563 -10.750   0.267
  307    HB   ILE  45           HB       ILE  45   1.014 -10.551   0.629
  308   1HG1  ILE  45          2HG1      ILE  45  -0.847 -11.085   2.944
  309   2HG1  ILE  45          1HG1      ILE  45  -0.465 -12.218   1.653
  310   1HG2  ILE  45          1HG2      ILE  45   0.008  -8.695   2.780
  311   2HG2  ILE  45          2HG2      ILE  45   1.086  -8.278   1.448
  312   3HG2  ILE  45          3HG2      ILE  45   1.629  -9.387   2.706
  313   1HD1  ILE  45          1HD1      ILE  45   1.888 -12.201   2.363
  314   2HD1  ILE  45          2HD1      ILE  45   0.802 -12.755   3.638
  315   3HD1  ILE  45          3HD1      ILE  45   1.462 -11.119   3.689
  316    H    ASN  46           H        ASN  46  -2.944 -10.384   2.017
  317    HA   ASN  46           HA       ASN  46  -3.276  -7.733   3.120
  318   1HB   ASN  46          2HB       ASN  46  -4.446  -7.708   0.852
  319   2HB   ASN  46          1HB       ASN  46  -5.567  -8.890   1.516
  320   1HD2  ASN  46          1HD2      ASN  46  -5.927  -6.130   0.551
  321   2HD2  ASN  46          2HD2      ASN  46  -6.714  -5.301   1.851
  322    H    THR  47           H        THR  47  -3.158  -8.475   5.116
  323    HA   THR  47           HA       THR  47  -4.430 -10.856   5.999
  324    HB   THR  47           HB       THR  47  -3.855  -9.881   8.305
  325    HG1  THR  47           1HG      THR  47  -2.102  -8.157   7.843
  326   1HG2  THR  47          1HG2      THR  47  -2.428 -11.519   7.157
  327   2HG2  THR  47          2HG2      THR  47  -1.462 -10.332   8.034
  328   3HG2  THR  47          3HG2      THR  47  -1.631 -10.210   6.282
  329    H    GLY  48           H        GLY  48  -5.328  -7.540   5.711
  330   1HA   GLY  48          2HA       GLY  48  -7.576  -6.824   5.640
  331   2HA   GLY  48          1HA       GLY  48  -8.016  -8.199   6.649
  332    H    ASN  49           H        ASN  49  -5.206  -6.422   7.537
  333    HA   ASN  49           HA       ASN  49  -6.601  -5.764  10.011
  334   1HB   ASN  49          2HB       ASN  49  -4.532  -5.696  11.084
  335   2HB   ASN  49          1HB       ASN  49  -4.305  -6.941   9.867
  336   1HD2  ASN  49          1HD2      ASN  49  -3.278  -3.934  11.069
  337   2HD2  ASN  49          2HD2      ASN  49  -2.014  -3.649   9.921
  338    H    GLY  50           H        GLY  50  -6.507  -4.212   7.284
  339   1HA   GLY  50          2HA       GLY  50  -7.191  -1.959   7.012
  340   2HA   GLY  50          1HA       GLY  50  -6.467  -1.579   8.569
  341    H    TYR  51           H        TYR  51  -4.148  -3.319   7.433
  342    HA   TYR  51           HA       TYR  51  -2.929  -1.231   5.779
  343   1HB   TYR  51          2HB       TYR  51  -1.401  -3.288   7.398
  344   2HB   TYR  51          1HB       TYR  51  -0.743  -1.937   6.519
  345    HD1  TYR  51           1HD      TYR  51  -3.720  -1.247   8.532
  346    HD2  TYR  51           2HD      TYR  51   0.536  -1.416   8.540
  347    HE1  TYR  51           1HE      TYR  51  -3.668   0.055  10.624
  348    HE2  TYR  51           2HE      TYR  51   0.594  -0.099  10.613
  349    HH   TYR  51           HH       TYR  51  -0.847   1.508  11.811
  350    H    TYR  52           H        TYR  52  -1.360  -2.213   4.161
  351    HA   TYR  52           HA       TYR  52  -2.676  -4.622   3.108
  352   1HB   TYR  52          2HB       TYR  52  -1.894  -2.162   1.556
  353   2HB   TYR  52          1HB       TYR  52  -2.648  -3.605   0.883
  354    HD1  TYR  52           1HD      TYR  52  -3.167  -0.764   3.190
  355    HD2  TYR  52           2HD      TYR  52  -5.005  -3.893   0.986
  356    HE1  TYR  52           1HE      TYR  52  -5.354   0.213   3.653
  357    HE2  TYR  52           2HE      TYR  52  -7.221  -2.932   1.459
  358    HH   TYR  52           HH       TYR  52  -7.653   0.185   2.650
  359    H    GLY  53           H        GLY  53  -1.388  -5.455   1.126
  360   1HA   GLY  53          2HA       GLY  53   1.034  -6.370   2.270
  361   2HA   GLY  53          1HA       GLY  53   0.414  -6.784   0.685
  362    H    GLY  54           H        GLY  54   2.759  -6.764   0.300
  363   1HA   GLY  54          2HA       GLY  54   4.439  -5.824  -0.954
  364   2HA   GLY  54          1HA       GLY  54   3.456  -4.371  -1.101
  365    H    VAL  55           H        VAL  55   4.024  -2.633   0.025
  366    HA   VAL  55           HA       VAL  55   6.362  -2.810   1.736
  367    HB   VAL  55           HB       VAL  55   5.949  -0.270   1.933
  368   1HG1  VAL  55          1HG1      VAL  55   7.086   0.116  -0.206
  369   2HG1  VAL  55          2HG1      VAL  55   6.681  -1.525  -0.710
  370   3HG1  VAL  55          3HG1      VAL  55   7.764  -1.263   0.658
  371   1HG2  VAL  55          1HG2      VAL  55   4.277  -0.837  -0.507
  372   2HG2  VAL  55          2HG2      VAL  55   4.696   0.744   0.145
  373   3HG2  VAL  55          3HG2      VAL  55   3.643  -0.335   1.061
  374    H    GLN  56           H        GLN  56   3.143  -3.150   2.123
  375    HA   GLN  56           HA       GLN  56   1.925  -3.680   3.937
  376   1HB   GLN  56          2HB       GLN  56   4.031  -5.009   4.295
  377   2HB   GLN  56          1HB       GLN  56   4.534  -3.768   5.431
  378   1HG   GLN  56          2HG       GLN  56   3.599  -5.549   6.679
  379   2HG   GLN  56          1HG       GLN  56   2.454  -4.209   6.724
  380   1HE2  GLN  56          1HE2      GLN  56   2.885  -6.294   3.955
  381   2HE2  GLN  56          2HE2      GLN  56   1.342  -7.060   4.047
  382    H    PHE  57           H        PHE  57   1.676  -0.968   3.640
  383    HA   PHE  57           HA       PHE  57   1.542  -0.312   6.479
  384   1HB   PHE  57          2HB       PHE  57   1.866   2.041   6.107
  385   2HB   PHE  57          1HB       PHE  57   3.269   1.107   5.633
  386    HD1  PHE  57           1HD      PHE  57   2.979   0.401   2.925
  387    HD2  PHE  57           2HD      PHE  57   1.579   3.919   4.868
  388    HE1  PHE  57           1HE      PHE  57   3.121   1.634   0.801
  389    HE2  PHE  57           2HE      PHE  57   1.710   5.152   2.740
  390    HZ   PHE  57           HZ       PHE  57   2.502   4.012   0.693
  391    H    ASP  58           H        ASP  58   0.015   1.775   6.743
  392    HA   ASP  58           HA       ASP  58  -2.431   0.321   6.434
  393   1HB   ASP  58          2HB       ASP  58  -3.385   1.933   7.981
  394   2HB   ASP  58          1HB       ASP  58  -1.851   1.312   8.573
  395    H    GLN  59           H        GLN  59  -4.467   1.275   5.969
  396    HA   GLN  59           HA       GLN  59  -4.698   2.387   3.448
  397   1HB   GLN  59          2HB       GLN  59  -6.500   1.157   4.506
  398   2HB   GLN  59          1HB       GLN  59  -6.590   2.330   5.801
  399   1HG   GLN  59          2HG       GLN  59  -8.402   2.792   4.416
  400   2HG   GLN  59          1HG       GLN  59  -7.209   4.029   4.058
  401   1HE2  GLN  59          1HE2      GLN  59  -5.601   2.153   2.397
  402   2HE2  GLN  59          2HE2      GLN  59  -6.476   1.996   0.907
  403    H    GLY  60           H        GLY  60  -4.620   3.908   6.622
  404   1HA   GLY  60          2HA       GLY  60  -5.718   6.397   5.781
  405   2HA   GLY  60          1HA       GLY  60  -4.898   6.089   7.305
  406    H    THR  61           H        THR  61  -2.430   5.395   6.605
  407    HA   THR  61           HA       THR  61  -1.174   7.809   5.910
  408    HB   THR  61           HB       THR  61  -0.045   5.045   5.894
  409    HG1  THR  61           1HG      THR  61  -0.450   5.153   7.958
  410   1HG2  THR  61          1HG2      THR  61   1.294   7.722   6.240
  411   2HG2  THR  61          2HG2      THR  61   1.414   6.686   4.818
  412   3HG2  THR  61          3HG2      THR  61   2.092   6.153   6.357
  413    H    TRP  62           H        TRP  62  -1.760   4.845   4.082
  414    HA   TRP  62           HA       TRP  62  -0.516   5.470   1.671
  415   1HB   TRP  62          2HB       TRP  62  -1.435   3.270   2.170
  416   2HB   TRP  62          1HB       TRP  62  -3.052   3.950   2.285
  417    HD1  TRP  62           HD       TRP  62  -4.360   4.416   0.046
  418    HE1  TRP  62           1HE      TRP  62  -4.034   3.560  -2.353
  419    HE3  TRP  62           3HE      TRP  62   0.429   2.672   0.464
  420    HZ2  TRP  62           2HZ      TRP  62  -1.998   2.302  -3.897
  421    HZ3  TRP  62           3HZ      TRP  62   1.500   1.664  -1.503
  422    HH2  TRP  62           HH       TRP  62   0.337   1.472  -3.633
  423    H    GLU  63           H        GLU  63  -3.782   6.082   2.812
  424    HA   GLU  63           HA       GLU  63  -4.720   7.401   0.515
  425   1HB   GLU  63          2HB       GLU  63  -6.227   6.415   2.092
  426   2HB   GLU  63          1HB       GLU  63  -5.613   7.413   3.396
  427   1HG   GLU  63          2HG       GLU  63  -6.540   9.397   2.281
  428   2HG   GLU  63          1HG       GLU  63  -7.200   8.354   1.018
  429    H    ALA  64           H        ALA  64  -3.141   8.491   3.450
  430    HA   ALA  64           HA       ALA  64  -3.629  11.265   3.132
  431   1HB   ALA  64          1HB       ALA  64  -2.989  10.280   5.278
  432   2HB   ALA  64          2HB       ALA  64  -1.888  11.577   4.814
  433   3HB   ALA  64          3HB       ALA  64  -1.395   9.894   4.627
  434    H    ASN  65           H        ASN  65  -0.912   9.177   2.171
  435    HA   ASN  65           HA       ASN  65   0.527  11.337   0.972
  436   1HB   ASN  65          2HB       ASN  65   0.878   8.358   0.563
  437   2HB   ASN  65          1HB       ASN  65   2.038   9.614   0.144
  438   1HD2  ASN  65          1HD2      ASN  65   1.373  11.103   2.640
  439   2HD2  ASN  65          2HD2      ASN  65   2.200  10.248   3.901
  440    H    GLY  66           H        GLY  66  -2.136   9.458   0.074
  441   1HA   GLY  66          2HA       GLY  66  -3.522  10.018  -1.743
  442   2HA   GLY  66          1HA       GLY  66  -2.143  10.767  -2.537
  443    H    GLY  67           H        GLY  67  -2.644   7.487  -1.224
  444   1HA   GLY  67          2HA       GLY  67  -1.215   6.412  -3.484
  445   2HA   GLY  67          1HA       GLY  67  -1.839   5.514  -2.108
  446    H    LEU  68           H        LEU  68  -4.486   6.973  -2.711
  447    HA   LEU  68           HA       LEU  68  -5.659   4.722  -3.840
  448   1HB   LEU  68          2HB       LEU  68  -6.640   7.469  -3.319
  449   2HB   LEU  68          1HB       LEU  68  -7.698   6.226  -3.950
  450    HG   LEU  68           HG       LEU  68  -6.943   4.884  -1.862
  451   1HD1  LEU  68          1HD1      LEU  68  -6.451   6.317   0.072
  452   2HD1  LEU  68          2HD1      LEU  68  -6.268   7.685  -1.026
  453   3HD1  LEU  68          3HD1      LEU  68  -5.169   6.310  -1.137
  454   1HD2  LEU  68          1HD2      LEU  68  -8.746   5.866  -0.539
  455   2HD2  LEU  68          2HD2      LEU  68  -9.215   5.678  -2.229
  456   3HD2  LEU  68          3HD2      LEU  68  -8.766   7.267  -1.609
  457    H    ARG  69           H        ARG  69  -4.421   7.604  -5.289
  458    HA   ARG  69           HA       ARG  69  -5.796   7.481  -7.749
  459   1HB   ARG  69          2HB       ARG  69  -3.963   8.853  -8.614
  460   2HB   ARG  69          1HB       ARG  69  -4.498   9.444  -7.044
  461   1HG   ARG  69          2HG       ARG  69  -2.623   8.459  -5.955
  462   2HG   ARG  69          1HG       ARG  69  -2.140   7.626  -7.429
  463   1HD   ARG  69          2HD       ARG  69  -0.704   9.498  -7.178
  464   2HD   ARG  69          1HD       ARG  69  -1.826   9.882  -8.483
  465    HE   ARG  69           HE       ARG  69  -2.459  10.840  -5.794
  466   1HH1  ARG  69          1HH1      ARG  69  -1.406  11.528  -9.063
  467   2HH1  ARG  69          2HH1      ARG  69  -1.605  13.247  -8.898
  468   1HH2  ARG  69          1HH2      ARG  69  -2.710  13.087  -5.561
  469   2HH2  ARG  69          2HH2      ARG  69  -2.309  14.141  -6.890
  470    H    TYR  70           H        TYR  70  -3.065   5.846  -6.379
  471    HA   TYR  70           HA       TYR  70  -2.214   4.527  -8.801
  472   1HB   TYR  70          2HB       TYR  70  -1.682   4.068  -5.860
  473   2HB   TYR  70          1HB       TYR  70  -0.760   3.320  -7.179
  474    HD1  TYR  70           1HD      TYR  70  -1.191   6.118  -5.038
  475    HD2  TYR  70           2HD      TYR  70   0.643   4.875  -8.659
  476    HE1  TYR  70           1HE      TYR  70   0.295   8.058  -4.938
  477    HE2  TYR  70           2HE      TYR  70   2.148   6.820  -8.573
  478    HH   TYR  70           HH       TYR  70   2.119   9.109  -7.563
  479    H    ALA  71           H        ALA  71  -4.091   4.067  -5.968
  480    HA   ALA  71           HA       ALA  71  -6.000   2.309  -6.755
  481   1HB   ALA  71          1HB       ALA  71  -4.244   0.660  -7.289
  482   2HB   ALA  71          2HB       ALA  71  -5.257   0.108  -5.954
  483   3HB   ALA  71          3HB       ALA  71  -3.650   0.764  -5.631
  484    HA   PRO  72           HA       PRO  72  -6.935   3.863  -2.704
  485   1HB   PRO  72          2HB       PRO  72  -9.115   1.960  -2.659
  486   2HB   PRO  72          1HB       PRO  72  -9.145   3.713  -2.596
  487   1HG   PRO  72          2HG       PRO  72  -9.916   2.254  -4.770
  488   2HG   PRO  72          1HG       PRO  72  -9.335   3.924  -4.844
  489   1HD   PRO  72          2HD       PRO  72  -7.992   1.423  -5.639
  490   2HD   PRO  72          1HD       PRO  72  -7.713   3.089  -6.186
  491    H    ARG  73           H        ARG  73  -5.935   0.787  -3.412
  492    HA   ARG  73           HA       ARG  73  -5.300   0.308  -0.611
  493   1HB   ARG  73          2HB       ARG  73  -6.016  -2.009  -0.665
  494   2HB   ARG  73          1HB       ARG  73  -7.387  -0.994  -1.099
  495   1HG   ARG  73          2HG       ARG  73  -6.764  -1.425  -3.502
  496   2HG   ARG  73          1HG       ARG  73  -5.663  -2.661  -2.886
  497   1HD   ARG  73          2HD       ARG  73  -8.579  -2.659  -2.142
  498   2HD   ARG  73          1HD       ARG  73  -8.028  -3.358  -3.661
  499    HE   ARG  73           HE       ARG  73  -6.459  -4.460  -1.657
  500   1HH1  ARG  73          1HH1      ARG  73  -9.887  -4.375  -2.440
  501   2HH1  ARG  73          2HH1      ARG  73 -10.161  -6.021  -1.960
  502   1HH2  ARG  73          1HH2      ARG  73  -6.817  -6.625  -1.080
  503   2HH2  ARG  73          2HH2      ARG  73  -8.417  -7.303  -1.190
  504    H    ALA  74           H        ALA  74  -3.286  -0.443  -0.408
  505    HA   ALA  74           HA       ALA  74  -1.459  -0.154  -2.463
  506   1HB   ALA  74          1HB       ALA  74  -0.874  -1.837  -0.062
  507   2HB   ALA  74          2HB       ALA  74  -1.077  -0.092   0.066
  508   3HB   ALA  74          3HB       ALA  74   0.200  -0.760  -0.950
  509    H    ASP  75           H        ASP  75  -3.259  -2.988  -1.502
  510    HA   ASP  75           HA       ASP  75  -1.428  -4.755  -2.857
  511   1HB   ASP  75          2HB       ASP  75  -2.982  -6.553  -2.195
  512   2HB   ASP  75          1HB       ASP  75  -2.423  -5.596  -0.829
  513    H    LEU  76           H        LEU  76  -3.849  -2.764  -3.839
  514    HA   LEU  76           HA       LEU  76  -4.463  -4.386  -6.201
  515   1HB   LEU  76          2HB       LEU  76  -6.308  -3.144  -5.177
  516   2HB   LEU  76          1HB       LEU  76  -5.414  -1.646  -5.348
  517    HG   LEU  76           HG       LEU  76  -5.515  -1.924  -7.819
  518   1HD1  LEU  76          1HD1      LEU  76  -7.388  -4.186  -7.150
  519   2HD1  LEU  76          2HD1      LEU  76  -5.796  -4.338  -7.893
  520   3HD1  LEU  76          3HD1      LEU  76  -7.097  -3.521  -8.758
  521   1HD2  LEU  76          1HD2      LEU  76  -8.154  -1.857  -6.364
  522   2HD2  LEU  76          2HD2      LEU  76  -7.879  -1.299  -8.014
  523   3HD2  LEU  76          3HD2      LEU  76  -7.088  -0.485  -6.664
  524    H    ALA  77           H        ALA  77  -2.652  -1.691  -5.054
  525    HA   ALA  77           HA       ALA  77  -1.600  -0.886  -7.591
  526   1HB   ALA  77          1HB       ALA  77  -0.740  -0.284  -4.761
  527   2HB   ALA  77          2HB       ALA  77  -1.824   0.694  -5.751
  528   3HB   ALA  77          3HB       ALA  77  -0.130   0.518  -6.207
  529    H    THR  78           H        THR  78   0.611  -1.161  -8.221
  530    HA   THR  78           HA       THR  78   1.740  -3.685  -7.238
  531    HB   THR  78           HB       THR  78   3.002  -3.792  -9.301
  532    HG1  THR  78           1HG      THR  78   1.881  -1.204  -9.821
  533   1HG2  THR  78          1HG2      THR  78   1.119  -3.836 -10.926
  534   2HG2  THR  78          2HG2      THR  78   0.115  -3.027  -9.719
  535   3HG2  THR  78          3HG2      THR  78   0.748  -4.641  -9.401
  536    H    ARG  79           H        ARG  79   4.360  -3.460  -7.874
  537    HA   ARG  79           HA       ARG  79   5.540  -2.331  -5.670
  538   1HB   ARG  79          2HB       ARG  79   6.656  -2.783  -8.430
  539   2HB   ARG  79          1HB       ARG  79   7.647  -2.225  -7.092
  540   1HG   ARG  79          2HG       ARG  79   6.904  -4.289  -5.855
  541   2HG   ARG  79          1HG       ARG  79   6.239  -4.847  -7.393
  542   1HD   ARG  79          2HD       ARG  79   8.292  -5.122  -8.342
  543   2HD   ARG  79          1HD       ARG  79   9.036  -3.867  -7.359
  544    HE   ARG  79           HE       ARG  79   8.858  -5.530  -5.482
  545   1HH1  ARG  79          1HH1      ARG  79   9.119  -6.449  -8.847
  546   2HH1  ARG  79          2HH1      ARG  79   9.889  -7.971  -8.530
  547   1HH2  ARG  79          1HH2      ARG  79   9.893  -7.561  -5.039
  548   2HH2  ARG  79          2HH2      ARG  79  10.305  -8.619  -6.368
  549    H    GLU  80           H        GLU  80   5.363  -0.949  -8.894
  550    HA   GLU  80           HA       GLU  80   6.762   1.385  -8.319
  551   1HB   GLU  80          2HB       GLU  80   5.694   2.219 -10.456
  552   2HB   GLU  80          1HB       GLU  80   6.612   0.725 -10.555
  553   1HG   GLU  80          2HG       GLU  80   4.243  -0.351 -10.161
  554   2HG   GLU  80          1HG       GLU  80   3.701   1.183 -10.839
  555    H    GLU  81           H        GLU  81   3.209   0.829  -8.262
  556    HA   GLU  81           HA       GLU  81   2.557   3.456  -7.478
  557   1HB   GLU  81          2HB       GLU  81   1.192   0.823  -7.026
  558   2HB   GLU  81          1HB       GLU  81   0.507   2.354  -6.514
  559   1HG   GLU  81          2HG       GLU  81  -0.520   1.840  -8.514
  560   2HG   GLU  81          1HG       GLU  81   0.656   3.078  -8.921
  561    H    GLN  82           H        GLN  82   3.036   0.504  -5.523
  562    HA   GLN  82           HA       GLN  82   2.405   1.674  -3.048
  563   1HB   GLN  82          2HB       GLN  82   4.240  -0.647  -3.640
  564   2HB   GLN  82          1HB       GLN  82   3.683  -0.199  -2.036
  565   1HG   GLN  82          2HG       GLN  82   1.326  -0.505  -2.981
  566   2HG   GLN  82          1HG       GLN  82   2.122  -1.353  -4.309
  567   1HE2  GLN  82          1HE2      GLN  82   1.311  -3.364  -3.806
  568   2HE2  GLN  82          2HE2      GLN  82   1.745  -4.223  -2.364
  569    H    ILE  83           H        ILE  83   5.459   1.235  -4.704
  570    HA   ILE  83           HA       ILE  83   7.145   2.269  -2.726
  571    HB   ILE  83           HB       ILE  83   7.375   1.940  -5.695
  572   1HG1  ILE  83          2HG1      ILE  83   9.252   0.924  -3.586
  573   2HG1  ILE  83          1HG1      ILE  83   7.710   0.126  -3.835
  574   1HG2  ILE  83          1HG2      ILE  83   9.669   2.781  -5.638
  575   2HG2  ILE  83          2HG2      ILE  83   9.447   3.277  -3.960
  576   3HG2  ILE  83          3HG2      ILE  83   8.508   4.048  -5.239
  577   1HD1  ILE  83          1HD1      ILE  83   8.318  -0.275  -6.173
  578   2HD1  ILE  83          2HD1      ILE  83   9.468  -0.994  -5.046
  579   3HD1  ILE  83          3HD1      ILE  83   9.874   0.502  -5.884
  580    H    ALA  84           H        ALA  84   5.319   3.883  -5.317
  581    HA   ALA  84           HA       ALA  84   6.549   6.415  -5.034
  582   1HB   ALA  84          1HB       ALA  84   5.240   5.780  -6.999
  583   2HB   ALA  84          2HB       ALA  84   4.642   7.278  -6.285
  584   3HB   ALA  84          3HB       ALA  84   3.773   5.766  -6.021
  585    H    VAL  85           H        VAL  85   3.675   5.011  -3.550
  586    HA   VAL  85           HA       VAL  85   2.892   7.324  -2.106
  587    HB   VAL  85           HB       VAL  85   2.337   4.430  -1.475
  588   1HG1  VAL  85          1HG1      VAL  85   1.796   5.939   0.365
  589   2HG1  VAL  85          2HG1      VAL  85   0.326   5.292  -0.363
  590   3HG1  VAL  85          3HG1      VAL  85   0.838   6.941  -0.723
  591   1HG2  VAL  85          1HG2      VAL  85   0.280   4.711  -2.764
  592   2HG2  VAL  85          2HG2      VAL  85   1.715   4.945  -3.762
  593   3HG2  VAL  85          3HG2      VAL  85   0.787   6.340  -3.211
  594    H    ALA  86           H        ALA  86   4.608   4.352  -1.170
  595    HA   ALA  86           HA       ALA  86   5.326   5.047   1.417
  596   1HB   ALA  86          1HB       ALA  86   5.588   2.804   0.464
  597   2HB   ALA  86          2HB       ALA  86   7.086   3.385   1.194
  598   3HB   ALA  86          3HB       ALA  86   6.896   3.399  -0.560
  599    H    GLU  87           H        GLU  87   6.607   6.031  -1.645
  600    HA   GLU  87           HA       GLU  87   9.095   7.077  -0.826
  601   1HB   GLU  87          2HB       GLU  87   7.270   7.686  -3.130
  602   2HB   GLU  87          1HB       GLU  87   8.664   8.715  -2.832
  603   1HG   GLU  87          2HG       GLU  87   8.769   5.742  -3.277
  604   2HG   GLU  87          1HG       GLU  87   9.071   6.966  -4.509
  605    H    VAL  88           H        VAL  88   5.868   8.548  -0.980
  606    HA   VAL  88           HA       VAL  88   6.634  11.075   0.025
  607    HB   VAL  88           HB       VAL  88   3.988   9.658   0.487
  608   1HG1  VAL  88          1HG1      VAL  88   3.096  11.891   0.865
  609   2HG1  VAL  88          2HG1      VAL  88   4.697  12.591   0.623
  610   3HG1  VAL  88          3HG1      VAL  88   4.395  11.540   2.012
  611   1HG2  VAL  88          1HG2      VAL  88   4.496   9.846  -1.891
  612   2HG2  VAL  88          2HG2      VAL  88   4.831  11.566  -1.697
  613   3HG2  VAL  88          3HG2      VAL  88   3.198  10.953  -1.443
  614    H    THR  89           H        THR  89   5.565   8.110   1.619
  615    HA   THR  89           HA       THR  89   5.447   9.155   4.222
  616    HB   THR  89           HB       THR  89   6.137   6.319   4.066
  617    HG1  THR  89           1HG      THR  89   3.765   7.201   2.740
  618   1HG2  THR  89          1HG2      THR  89   4.167   6.106   5.401
  619   2HG2  THR  89          2HG2      THR  89   3.607   7.706   4.918
  620   3HG2  THR  89          3HG2      THR  89   5.027   7.549   5.947
  621    H    ARG  90           H        ARG  90   8.044   7.376   2.548
  622    HA   ARG  90           HA       ARG  90   9.707   7.096   4.824
  623   1HB   ARG  90          2HB       ARG  90  11.457   6.433   3.320
  624   2HB   ARG  90          1HB       ARG  90   9.952   5.779   2.694
  625   1HG   ARG  90          2HG       ARG  90  10.066   6.977   0.804
  626   2HG   ARG  90          1HG       ARG  90  10.701   8.408   1.621
  627   1HD   ARG  90          2HD       ARG  90  12.899   7.505   1.664
  628   2HD   ARG  90          1HD       ARG  90  12.328   5.926   1.129
  629    HE   ARG  90           HE       ARG  90  11.703   7.138  -1.000
  630   1HH1  ARG  90          1HH1      ARG  90  14.319   8.248   1.060
  631   2HH1  ARG  90          2HH1      ARG  90  15.269   8.859  -0.266
  632   1HH2  ARG  90          1HH2      ARG  90  12.928   7.922  -2.728
  633   2HH2  ARG  90          2HH2      ARG  90  14.477   8.653  -2.435
  634    H    LEU  91           H        LEU  91   9.137   9.564   2.551
  635    HA   LEU  91           HA       LEU  91  11.563  10.996   2.768
  636   1HB   LEU  91          2HB       LEU  91  10.119  11.229   0.859
  637   2HB   LEU  91          1HB       LEU  91   8.800  11.787   1.868
  638    HG   LEU  91           HG       LEU  91  10.092  13.817   2.396
  639   1HD1  LEU  91          1HD1      LEU  91  12.329  12.940   2.087
  640   2HD1  LEU  91          2HD1      LEU  91  12.076  14.325   1.024
  641   3HD1  LEU  91          3HD1      LEU  91  12.018  12.685   0.371
  642   1HD2  LEU  91          1HD2      LEU  91   9.810  14.860   0.197
  643   2HD2  LEU  91          2HD2      LEU  91   8.450  13.810   0.600
  644   3HD2  LEU  91          3HD2      LEU  91   9.680  13.261  -0.537
  645    H    ARG  92           H        ARG  92   8.612  11.024   4.603
  646    HA   ARG  92           HA       ARG  92   9.145  13.577   5.833
  647   1HB   ARG  92          2HB       ARG  92   7.061  11.649   6.763
  648   2HB   ARG  92          1HB       ARG  92   7.033  13.406   6.795
  649   1HG   ARG  92          2HG       ARG  92   6.387  13.576   4.608
  650   2HG   ARG  92          1HG       ARG  92   7.081  12.009   4.169
  651   1HD   ARG  92          2HD       ARG  92   4.505  12.624   5.549
  652   2HD   ARG  92          1HD       ARG  92   4.815  11.560   4.172
  653    HE   ARG  92           HE       ARG  92   6.171  10.332   6.122
  654   1HH1  ARG  92          1HH1      ARG  92   2.904  11.581   5.955
  655   2HH1  ARG  92          2HH1      ARG  92   2.277  10.492   7.164
  656   1HH2  ARG  92          1HH2      ARG  92   5.350   8.905   7.761
  657   2HH2  ARG  92          2HH2      ARG  92   3.673   8.992   8.204
  658    H    GLN  93           H        GLN  93   9.083  10.173   6.693
  659    HA   GLN  93           HA       GLN  93   9.795  10.909   9.421
  660   1HB   GLN  93          2HB       GLN  93   8.902   8.793  10.103
  661   2HB   GLN  93          1HB       GLN  93   7.756   9.571   9.015
  662   1HG   GLN  93          2HG       GLN  93   9.152   8.129   7.244
  663   2HG   GLN  93          1HG       GLN  93   9.321   7.106   8.670
  664   1HE2  GLN  93          1HE2      GLN  93   7.878   6.630   6.210
  665   2HE2  GLN  93          2HE2      GLN  93   6.247   6.312   6.684
  666    H    GLY  94           H        GLY  94  11.016   9.033   6.703
  667   1HA   GLY  94          2HA       GLY  94  13.335   8.741   6.366
  668   2HA   GLY  94          1HA       GLY  94  13.595   8.983   8.089
  669    H    TRP  95           H        TRP  95  11.309   6.818   6.527
  670    HA   TRP  95           HA       TRP  95  11.044   4.591   6.481
  671   1HB   TRP  95          2HB       TRP  95  13.905   4.310   7.425
  672   2HB   TRP  95          1HB       TRP  95  12.915   3.080   6.641
  673    HD1  TRP  95           HD       TRP  95  14.758   6.352   5.832
  674    HE1  TRP  95           1HE      TRP  95  15.262   6.389   3.322
  675    HE3  TRP  95           3HE      TRP  95  12.181   2.166   4.459
  676    HZ2  TRP  95           2HZ      TRP  95  14.634   4.823   1.028
  677    HZ3  TRP  95           3HZ      TRP  95  12.172   1.510   2.091
  678    HH2  TRP  95           HH       TRP  95  13.371   2.813   0.417
  679    H    GLY  96           H        GLY  96  11.302   6.458   9.006
  680   1HA   GLY  96          2HA       GLY  96  11.653   4.893  11.272
  681   2HA   GLY  96          1HA       GLY  96  10.659   6.337  11.199
  682    H    ALA  97           H        ALA  97   8.703   5.318   9.346
  683    HA   ALA  97           HA       ALA  97   7.005   3.956  11.165
  684   1HB   ALA  97          1HB       ALA  97   6.637   4.327   8.197
  685   2HB   ALA  97          2HB       ALA  97   6.127   5.465   9.445
  686   3HB   ALA  97          3HB       ALA  97   5.391   3.865   9.356
  687    H    TRP  98           H        TRP  98   9.285   2.927   8.796
  688    HA   TRP  98           HA       TRP  98   8.313   0.159   8.982
  689   1HB   TRP  98          2HB       TRP  98  10.390   1.468   7.204
  690   2HB   TRP  98          1HB       TRP  98  10.005  -0.250   7.176
  691    HD1  TRP  98           HD       TRP  98   7.618  -0.958   6.180
  692    HE1  TRP  98           1HE      TRP  98   6.051   0.201   4.509
  693    HE3  TRP  98           3HE      TRP  98   9.512   3.827   6.448
  694    HZ2  TRP  98           2HZ      TRP  98   5.658   2.793   3.432
  695    HZ3  TRP  98           3HZ      TRP  98   8.470   5.559   5.062
  696    HH2  TRP  98           HH       TRP  98   6.586   5.054   3.597
  697    HA   PRO  99           HA       PRO  99  11.340   0.209  12.263
  698   1HB   PRO  99          2HB       PRO  99  10.198  -2.385  13.023
  699   2HB   PRO  99          1HB       PRO  99  10.264  -0.872  13.920
  700   1HG   PRO  99          2HG       PRO  99   7.960  -1.744  12.904
  701   2HG   PRO  99          1HG       PRO  99   8.392  -0.020  12.898
  702   1HD   PRO  99          2HD       PRO  99   8.645  -2.009  10.652
  703   2HD   PRO  99          1HD       PRO  99   7.892  -0.392  10.633
  704    H    VAL 100           H        VAL 100  10.987  -3.266  11.815
  705    HA   VAL 100           HA       VAL 100  13.830  -3.536  11.952
  706    HB   VAL 100           HB       VAL 100  11.738  -5.649  11.379
  707   1HG1  VAL 100          1HG1      VAL 100  14.583  -5.913  12.342
  708   2HG1  VAL 100          2HG1      VAL 100  13.971  -6.366  10.751
  709   3HG1  VAL 100          3HG1      VAL 100  13.423  -7.232  12.185
  710   1HG2  VAL 100          1HG2      VAL 100  11.301  -4.517  13.491
  711   2HG2  VAL 100          2HG2      VAL 100  12.960  -4.818  14.008
  712   3HG2  VAL 100          3HG2      VAL 100  11.853  -6.170  13.763
  713    H    CYS 101           H        CYS 101  11.444  -3.395   9.485
  714    HA   CYS 101           HA       CYS 101  12.921  -4.978   7.595
  715   1HB   CYS 101          2HB       CYS 101  10.466  -3.268   7.203
  716   2HB   CYS 101          1HB       CYS 101  11.111  -4.418   6.031
  717    H    ALA 102           H        ALA 102  12.688  -1.577   8.328
  718    HA   ALA 102           HA       ALA 102  13.657  -0.656   5.817
  719   1HB   ALA 102          1HB       ALA 102  14.055   1.468   6.948
  720   2HB   ALA 102          2HB       ALA 102  13.772   0.696   8.508
  721   3HB   ALA 102          3HB       ALA 102  12.460   0.825   7.337
  722    H    ALA 103           H        ALA 103  15.231  -1.328   8.935
  723    HA   ALA 103           HA       ALA 103  17.825  -0.593   8.065
  724   1HB   ALA 103          1HB       ALA 103  17.216  -0.692  10.432
  725   2HB   ALA 103          2HB       ALA 103  18.623  -1.697  10.085
  726   3HB   ALA 103          3HB       ALA 103  17.041  -2.442  10.314
  727    H    ARG 104           H        ARG 104  15.989  -3.555   7.957
  728    HA   ARG 104           HA       ARG 104  18.128  -5.246   7.106
  729   1HB   ARG 104          2HB       ARG 104  15.175  -5.446   7.349
  730   2HB   ARG 104          1HB       ARG 104  15.967  -6.573   6.264
  731   1HG   ARG 104          2HG       ARG 104  15.536  -7.338   8.640
  732   2HG   ARG 104          1HG       ARG 104  17.151  -7.596   7.995
  733   1HD   ARG 104          2HD       ARG 104  16.535  -5.136   9.590
  734   2HD   ARG 104          1HD       ARG 104  16.852  -6.668  10.407
  735    HE   ARG 104           HE       ARG 104  18.912  -6.367   8.608
  736   1HH1  ARG 104          1HH1      ARG 104  17.663  -4.559  11.351
  737   2HH1  ARG 104          2HH1      ARG 104  19.201  -3.851  11.737
  738   1HH2  ARG 104          1HH2      ARG 104  20.935  -5.465   9.145
  739   2HH2  ARG 104          2HH2      ARG 104  21.063  -4.349  10.471
  740    H    ALA 105           H        ALA 105  16.098  -2.959   5.564
  741    HA   ALA 105           HA       ALA 105  16.455  -4.114   2.898
  742   1HB   ALA 105          1HB       ALA 105  14.860  -1.727   3.802
  743   2HB   ALA 105          2HB       ALA 105  14.237  -3.362   3.581
  744   3HB   ALA 105          3HB       ALA 105  14.839  -2.452   2.196
  745    H    GLY 106           H        GLY 106  17.719  -1.591   4.905
  746   1HA   GLY 106          2HA       GLY 106  19.817  -0.540   4.268
  747   2HA   GLY 106          1HA       GLY 106  19.251  -0.552   2.603
  748    H    ALA 107           H        ALA 107  18.051   0.616   5.725
  749    HA   ALA 107           HA       ALA 107  16.428   2.642   4.709
  750   1HB   ALA 107          1HB       ALA 107  16.132   1.659   6.933
  751   2HB   ALA 107          2HB       ALA 107  16.244   3.418   7.002
  752   3HB   ALA 107          3HB       ALA 107  17.627   2.427   7.465
  753    H    ARG 108           H        ARG 108  16.650   4.910   4.810
  754    HA   ARG 108           HA       ARG 108  19.424   5.850   4.740
  755   1HB   ARG 108          2HB       ARG 108  17.342   6.505   2.655
  756   2HB   ARG 108          1HB       ARG 108  19.024   7.016   2.661
  757   1HG   ARG 108          2HG       ARG 108  19.770   4.764   2.308
  758   2HG   ARG 108          1HG       ARG 108  18.123   4.140   2.476
  759   1HD   ARG 108          2HD       ARG 108  18.698   4.279   0.126
  760   2HD   ARG 108          1HD       ARG 108  17.468   5.494   0.496
  761    HE   ARG 108           HE       ARG 108  20.181   6.465   0.648
  762   1HH1  ARG 108          1HH1      ARG 108  17.409   5.977  -1.459
  763   2HH1  ARG 108          2HH1      ARG 108  17.943   7.162  -2.612
  764   1HH2  ARG 108          1HH2      ARG 108  20.844   8.043  -0.860
  765   2HH2  ARG 108          2HH2      ARG 108  19.866   8.348  -2.267
  Start of MODEL   14
    1   1H    ASN   1          1HT       ASN   1   9.386  18.787 -51.417
    2   2H    ASN   1          2HT       ASN   1   9.033  17.130 -51.449
    3   3H    ASN   1          3HT       ASN   1   9.115  17.956 -49.967
    4    HA   ASN   1           HA       ASN   1   7.153  18.529 -52.106
    5   1HB   ASN   1          2HB       ASN   1   6.849  16.957 -49.541
    6   2HB   ASN   1          1HB       ASN   1   5.501  17.503 -50.532
    7   1HD2  ASN   1          1HD2      ASN   1   6.273  14.809 -49.820
    8   2HD2  ASN   1          2HD2      ASN   1   6.560  13.972 -51.313
    9    H    VAL   2           H        VAL   2   6.337  20.484 -51.919
   10    HA   VAL   2           HA       VAL   2   6.942  22.053 -49.536
   11    HB   VAL   2           HB       VAL   2   7.480  22.893 -51.827
   12   1HG1  VAL   2          1HG1      VAL   2   5.697  23.796 -53.228
   13   2HG1  VAL   2          2HG1      VAL   2   4.495  23.131 -52.123
   14   3HG1  VAL   2          3HG1      VAL   2   5.558  22.052 -53.025
   15   1HG2  VAL   2          1HG2      VAL   2   7.319  24.454 -49.989
   16   2HG2  VAL   2          2HG2      VAL   2   5.576  24.593 -50.225
   17   3HG2  VAL   2          3HG2      VAL   2   6.684  25.187 -51.462
   18    H    VAL   3           H        VAL   3   5.008  20.018 -49.318
   19    HA   VAL   3           HA       VAL   3   2.382  20.889 -49.639
   20    HB   VAL   3           HB       VAL   3   2.863  18.546 -49.524
   21   1HG1  VAL   3          1HG1      VAL   3   4.805  18.621 -48.056
   22   2HG1  VAL   3          2HG1      VAL   3   3.621  17.449 -47.479
   23   3HG1  VAL   3          3HG1      VAL   3   3.766  19.016 -46.688
   24   1HG2  VAL   3          1HG2      VAL   3   1.200  17.804 -47.913
   25   2HG2  VAL   3          2HG2      VAL   3   0.657  19.266 -48.737
   26   3HG2  VAL   3          3HG2      VAL   3   1.281  19.362 -47.091
   27    H    VAL   4           H        VAL   4   1.329  22.411 -48.558
   28    HA   VAL   4           HA       VAL   4   1.977  22.837 -45.721
   29    HB   VAL   4           HB       VAL   4   0.135  24.528 -47.405
   30   1HG1  VAL   4          1HG1      VAL   4   1.579  25.076 -44.820
   31   2HG1  VAL   4          2HG1      VAL   4  -0.150  24.782 -45.016
   32   3HG1  VAL   4          3HG1      VAL   4   0.581  26.234 -45.701
   33   1HG2  VAL   4          1HG2      VAL   4   2.003  26.121 -47.653
   34   2HG2  VAL   4          2HG2      VAL   4   2.297  24.594 -48.485
   35   3HG2  VAL   4          3HG2      VAL   4   3.087  24.926 -46.942
   36    H    THR   5           H        THR   5   0.358  22.642 -44.182
   37    HA   THR   5           HA       THR   5  -1.802  20.865 -44.956
   38    HB   THR   5           HB       THR   5  -2.177  20.669 -42.476
   39    HG1  THR   5           1HG      THR   5  -1.179  22.037 -41.223
   40   1HG2  THR   5          1HG2      THR   5   0.609  20.047 -43.465
   41   2HG2  THR   5          2HG2      THR   5  -0.820  19.035 -43.687
   42   3HG2  THR   5          3HG2      THR   5  -0.174  19.310 -42.069
   43    HA   PRO   6           HA       PRO   6  -4.618  24.326 -44.817
   44   1HB   PRO   6          2HB       PRO   6  -6.804  22.981 -45.631
   45   2HB   PRO   6          1HB       PRO   6  -5.513  23.425 -46.753
   46   1HG   PRO   6          2HG       PRO   6  -6.073  20.801 -45.445
   47   2HG   PRO   6          1HG       PRO   6  -5.539  21.137 -47.102
   48   1HD   PRO   6          2HD       PRO   6  -3.874  20.348 -45.067
   49   2HD   PRO   6          1HD       PRO   6  -3.344  21.261 -46.485
   50    H    ALA   7           H        ALA   7  -6.296  24.940 -43.526
   51    HA   ALA   7           HA       ALA   7  -6.372  23.692 -40.960
   52   1HB   ALA   7          1HB       ALA   7  -7.883  25.497 -40.314
   53   2HB   ALA   7          2HB       ALA   7  -8.088  25.955 -42.006
   54   3HB   ALA   7          3HB       ALA   7  -6.517  26.142 -41.226
   55    H    HIS   8           H        HIS   8  -7.256  21.944 -40.721
   56    HA   HIS   8           HA       HIS   8  -9.800  21.093 -40.738
   57   1HB   HIS   8          2HB       HIS   8  -9.817  21.671 -43.187
   58   2HB   HIS   8          1HB       HIS   8  -8.534  20.497 -43.429
   59    HD1  HIS   8           1HD      HIS   8  -9.298  18.174 -44.000
   60    HD2  HIS   8           2HD      HIS   8 -12.269  20.427 -42.162
   61    HE1  HIS   8           1HE      HIS   8 -11.404  16.770 -44.065
   62    H    GLU   9           H        GLU   9  -6.478  20.860 -40.973
   63    HA   GLU   9           HA       GLU   9  -6.049  18.066 -40.932
   64   1HB   GLU   9          2HB       GLU   9  -3.840  18.583 -40.034
   65   2HB   GLU   9          1HB       GLU   9  -4.243  19.700 -41.327
   66   1HG   GLU   9          2HG       GLU   9  -4.800  21.413 -39.700
   67   2HG   GLU   9          1HG       GLU   9  -4.455  20.291 -38.385
   68    H    ALA  10           H        ALA  10  -6.028  16.589 -39.297
   69    HA   ALA  10           HA       ALA  10  -6.973  17.550 -36.691
   70   1HB   ALA  10          1HB       ALA  10  -8.501  15.673 -36.525
   71   2HB   ALA  10          2HB       ALA  10  -7.972  15.073 -38.097
   72   3HB   ALA  10          3HB       ALA  10  -8.849  16.600 -37.986
   73    H    VAL  11           H        VAL  11  -4.608  17.421 -36.501
   74    HA   VAL  11           HA       VAL  11  -3.307  14.944 -36.187
   75    HB   VAL  11           HB       VAL  11  -2.085  17.066 -36.452
   76   1HG1  VAL  11          1HG1      VAL  11  -1.823  18.599 -34.555
   77   2HG1  VAL  11          2HG1      VAL  11  -3.027  17.675 -33.656
   78   3HG1  VAL  11          3HG1      VAL  11  -3.490  18.525 -35.129
   79   1HG2  VAL  11          1HG2      VAL  11  -0.328  16.648 -34.804
   80   2HG2  VAL  11          2HG2      VAL  11  -0.937  15.142 -35.490
   81   3HG2  VAL  11          3HG2      VAL  11  -1.437  15.641 -33.874
   82    H    VAL  12           H        VAL  12  -5.280  16.916 -34.152
   83    HA   VAL  12           HA       VAL  12  -5.699  16.779 -31.887
   84    HB   VAL  12           HB       VAL  12  -7.238  14.769 -33.428
   85   1HG1  VAL  12          1HG1      VAL  12  -7.560  14.339 -31.046
   86   2HG1  VAL  12          2HG1      VAL  12  -9.021  15.053 -31.730
   87   3HG1  VAL  12          3HG1      VAL  12  -7.915  16.045 -30.778
   88   1HG2  VAL  12          1HG2      VAL  12  -8.880  16.578 -33.650
   89   2HG2  VAL  12          2HG2      VAL  12  -7.318  16.992 -34.358
   90   3HG2  VAL  12          3HG2      VAL  12  -7.777  17.650 -32.788
   91    H    ARG  13           H        ARG  13  -3.868  16.048 -30.911
   92    HA   ARG  13           HA       ARG  13  -3.858  13.244 -30.150
   93   1HB   ARG  13          2HB       ARG  13  -1.683  13.667 -29.099
   94   2HB   ARG  13          1HB       ARG  13  -1.678  14.079 -30.808
   95   1HG   ARG  13          2HG       ARG  13  -1.471  16.312 -30.415
   96   2HG   ARG  13          1HG       ARG  13  -2.271  16.210 -28.843
   97   1HD   ARG  13          2HD       ARG  13   0.171  16.701 -28.722
   98   2HD   ARG  13          1HD       ARG  13  -0.330  15.266 -27.834
   99    HE   ARG  13           HE       ARG  13   0.499  14.490 -30.407
  100   1HH1  ARG  13          1HH1      ARG  13   1.812  15.781 -27.436
  101   2HH1  ARG  13          2HH1      ARG  13   3.369  15.046 -27.643
  102   1HH2  ARG  13          1HH2      ARG  13   2.589  13.519 -30.693
  103   2HH2  ARG  13          2HH2      ARG  13   3.808  13.774 -29.476
  104    H    VAL  14           H        VAL  14  -5.045  12.794 -28.548
  105    HA   VAL  14           HA       VAL  14  -5.698  14.713 -26.491
  106    HB   VAL  14           HB       VAL  14  -6.691  11.893 -26.568
  107   1HG1  VAL  14          1HG1      VAL  14  -8.686  12.895 -25.523
  108   2HG1  VAL  14          2HG1      VAL  14  -7.887  14.466 -25.563
  109   3HG1  VAL  14          3HG1      VAL  14  -7.216  13.161 -24.586
  110   1HG2  VAL  14          1HG2      VAL  14  -7.783  14.195 -28.181
  111   2HG2  VAL  14          2HG2      VAL  14  -8.616  12.662 -27.931
  112   3HG2  VAL  14          3HG2      VAL  14  -7.086  12.702 -28.809
  113    H    GLY  15           H        GLY  15  -5.614  14.016 -24.294
  114   1HA   GLY  15          2HA       GLY  15  -4.582  12.984 -22.473
  115   2HA   GLY  15          1HA       GLY  15  -3.593  12.049 -23.596
  116    H    THR  16           H        THR  16  -4.145  15.281 -22.358
  117    HA   THR  16           HA       THR  16  -1.728  16.333 -23.398
  118    HB   THR  16           HB       THR  16  -3.549  17.498 -21.296
  119    HG1  THR  16           1HG      THR  16  -3.712  17.406 -24.120
  120   1HG2  THR  16          1HG2      THR  16  -2.686  19.643 -22.075
  121   2HG2  THR  16          2HG2      THR  16  -1.634  18.808 -23.218
  122   3HG2  THR  16          3HG2      THR  16  -1.386  18.611 -21.484
  123    H    LYS  17           H        LYS  17  -2.846  15.103 -20.381
  124    HA   LYS  17           HA       LYS  17  -0.236  15.497 -19.120
  125   1HB   LYS  17          2HB       LYS  17  -2.698  14.410 -17.768
  126   2HB   LYS  17          1HB       LYS  17  -1.295  15.162 -17.027
  127   1HG   LYS  17          2HG       LYS  17  -3.530  16.474 -18.541
  128   2HG   LYS  17          1HG       LYS  17  -3.032  16.734 -16.868
  129   1HD   LYS  17          2HD       LYS  17  -1.441  17.442 -19.325
  130   2HD   LYS  17          1HD       LYS  17  -2.343  18.584 -18.319
  131   1HE   LYS  17          2HE       LYS  17   0.015  16.909 -17.445
  132   2HE   LYS  17          1HE       LYS  17   0.038  18.639 -17.778
  133   1HZ   LYS  17          1HZ       LYS  17  -0.106  18.373 -15.449
  134   2HZ   LYS  17          2HZ       LYS  17  -1.368  17.244 -15.567
  135   3HZ   LYS  17          3HZ       LYS  17  -1.645  18.870 -15.965
  136    HA   PRO  18           HA       PRO  18   0.226  11.063 -20.051
  137   1HB   PRO  18          2HB       PRO  18   3.067  11.544 -19.914
  138   2HB   PRO  18          1HB       PRO  18   2.091  11.118 -21.321
  139   1HG   PRO  18          2HG       PRO  18   3.307  13.538 -21.004
  140   2HG   PRO  18          1HG       PRO  18   1.838  13.289 -21.961
  141   1HD   PRO  18          2HD       PRO  18   2.122  14.333 -19.167
  142   2HD   PRO  18          1HD       PRO  18   1.067  14.908 -20.481
  143    H    GLY  19           H        GLY  19   1.579   9.448 -19.013
  144   1HA   GLY  19          2HA       GLY  19   2.922   8.894 -17.021
  145   2HA   GLY  19          1HA       GLY  19   1.910  10.030 -16.137
  146    H    THR  20           H        THR  20   1.142   7.513 -18.469
  147    HA   THR  20           HA       THR  20  -1.094   6.534 -17.040
  148    HB   THR  20           HB       THR  20   0.484   5.158 -19.222
  149    HG1  THR  20           1HG      THR  20  -1.498   7.195 -19.285
  150   1HG2  THR  20          1HG2      THR  20  -1.113   3.710 -18.081
  151   2HG2  THR  20          2HG2      THR  20  -1.640   4.058 -19.730
  152   3HG2  THR  20          3HG2      THR  20  -2.395   4.887 -18.368
  153    H    GLU  21           H        GLU  21   2.278   5.751 -17.071
  154    HA   GLU  21           HA       GLU  21   1.832   3.495 -15.302
  155   1HB   GLU  21          2HB       GLU  21   4.061   3.905 -17.304
  156   2HB   GLU  21          1HB       GLU  21   3.955   2.561 -16.174
  157   1HG   GLU  21          2HG       GLU  21   1.874   1.839 -17.238
  158   2HG   GLU  21          1HG       GLU  21   2.004   3.172 -18.383
  159    H    VAL  22           H        VAL  22   3.119   3.365 -13.549
  160    HA   VAL  22           HA       VAL  22   4.234   5.879 -12.629
  161    HB   VAL  22           HB       VAL  22   4.024   3.249 -11.156
  162   1HG1  VAL  22          1HG1      VAL  22   5.623   4.800 -10.163
  163   2HG1  VAL  22          2HG1      VAL  22   4.194   4.637  -9.144
  164   3HG1  VAL  22          3HG1      VAL  22   4.400   6.071 -10.150
  165   1HG2  VAL  22          1HG2      VAL  22   1.839   4.047 -11.952
  166   2HG2  VAL  22          2HG2      VAL  22   2.121   5.591 -11.145
  167   3HG2  VAL  22          3HG2      VAL  22   1.969   4.113 -10.193
  168    HA   PRO  23           HA       PRO  23   8.280   4.660 -14.096
  169   1HB   PRO  23          2HB       PRO  23   9.110   7.009 -12.511
  170   2HB   PRO  23          1HB       PRO  23   9.384   6.649 -14.217
  171   1HG   PRO  23          2HG       PRO  23   7.610   8.499 -13.431
  172   2HG   PRO  23          1HG       PRO  23   7.339   7.486 -14.863
  173   1HD   PRO  23          2HD       PRO  23   6.145   7.302 -12.144
  174   2HD   PRO  23          1HD       PRO  23   5.413   6.978 -13.723
  175    HA   PRO  24           HA       PRO  24   9.674   2.336 -10.534
  176   1HB   PRO  24          2HB       PRO  24  12.208   1.893 -11.629
  177   2HB   PRO  24          1HB       PRO  24  10.798   0.847 -11.826
  178   1HG   PRO  24          2HG       PRO  24  11.850   2.971 -13.644
  179   2HG   PRO  24          1HG       PRO  24  11.160   1.385 -14.048
  180   1HD   PRO  24          2HD       PRO  24   9.696   3.572 -14.345
  181   2HD   PRO  24          1HD       PRO  24   8.977   2.109 -13.644
  182    H    VAL  25           H        VAL  25  10.809   2.802  -8.797
  183    HA   VAL  25           HA       VAL  25  12.434   5.254  -8.800
  184    HB   VAL  25           HB       VAL  25  10.883   4.099  -6.475
  185   1HG1  VAL  25          1HG1      VAL  25  12.776   5.477  -5.815
  186   2HG1  VAL  25          2HG1      VAL  25  11.251   6.266  -5.427
  187   3HG1  VAL  25          3HG1      VAL  25  12.188   6.791  -6.829
  188   1HG2  VAL  25          1HG2      VAL  25   9.316   4.803  -8.172
  189   2HG2  VAL  25          2HG2      VAL  25  10.132   6.357  -8.324
  190   3HG2  VAL  25          3HG2      VAL  25   9.289   5.946  -6.832
  191    H    ILE  26           H        ILE  26  14.359   5.238  -7.737
  192    HA   ILE  26           HA       ILE  26  15.820   2.851  -7.838
  193    HB   ILE  26           HB       ILE  26  16.492   5.564  -6.712
  194   1HG1  ILE  26          2HG1      ILE  26  18.100   5.499  -8.691
  195   2HG1  ILE  26          1HG1      ILE  26  17.225   4.072  -9.224
  196   1HG2  ILE  26          1HG2      ILE  26  18.818   4.877  -6.535
  197   2HG2  ILE  26          2HG2      ILE  26  18.380   3.232  -6.998
  198   3HG2  ILE  26          3HG2      ILE  26  17.797   3.903  -5.474
  199   1HD1  ILE  26          1HD1      ILE  26  16.517   6.123 -10.363
  200   2HD1  ILE  26          2HD1      ILE  26  16.000   6.788  -8.815
  201   3HD1  ILE  26          3HD1      ILE  26  15.204   5.358  -9.471
  202    H    ASP  27           H        ASP  27  14.049   4.269  -5.271
  203    HA   ASP  27           HA       ASP  27  15.433   2.787  -3.218
  204   1HB   ASP  27          2HB       ASP  27  13.105   4.693  -3.088
  205   2HB   ASP  27          1HB       ASP  27  13.750   3.841  -1.692
  206    H    GLY  28           H        GLY  28  13.311   2.103  -5.471
  207   1HA   GLY  28          2HA       GLY  28  11.290   0.639  -4.147
  208   2HA   GLY  28          1HA       GLY  28  11.813   0.400  -5.812
  209    H    SER  29           H        SER  29  14.585   0.199  -4.452
  210    HA   SER  29           HA       SER  29  14.638  -2.677  -4.297
  211   1HB   SER  29          2HB       SER  29  16.796  -0.738  -3.514
  212   2HB   SER  29          1HB       SER  29  16.994  -2.427  -3.979
  213    HG   SER  29           HG       SER  29  17.473  -0.803  -5.646
  214    H    ILE  30           H        ILE  30  14.756   0.020  -2.130
  215    HA   ILE  30           HA       ILE  30  15.190  -1.465   0.283
  216    HB   ILE  30           HB       ILE  30  13.662   1.081   0.479
  217   1HG1  ILE  30          2HG1      ILE  30  15.152   1.619  -1.415
  218   2HG1  ILE  30          1HG1      ILE  30  15.599   2.511   0.033
  219   1HG2  ILE  30          1HG2      ILE  30  15.252   1.523   2.267
  220   2HG2  ILE  30          2HG2      ILE  30  16.144   0.066   1.832
  221   3HG2  ILE  30          3HG2      ILE  30  14.494  -0.061   2.438
  222   1HD1  ILE  30          1HD1      ILE  30  17.433   0.950   0.440
  223   2HD1  ILE  30          2HD1      ILE  30  17.564   1.715  -1.145
  224   3HD1  ILE  30          3HD1      ILE  30  16.986   0.053  -1.010
  225    H    TRP  31           H        TRP  31  12.551  -0.248  -1.576
  226    HA   TRP  31           HA       TRP  31  10.496  -0.767   0.290
  227   1HB   TRP  31          2HB       TRP  31  10.507  -0.151  -2.670
  228   2HB   TRP  31          1HB       TRP  31   9.019  -0.377  -1.754
  229    HD1  TRP  31           HD       TRP  31  10.748   2.435  -2.993
  230    HE1  TRP  31           1HE      TRP  31  10.548   4.507  -1.450
  231    HE3  TRP  31           3HE      TRP  31   9.349   0.077   1.259
  232    HZ2  TRP  31           2HZ      TRP  31   9.932   4.998   1.260
  233    HZ3  TRP  31           3HZ      TRP  31   9.008   1.388   3.306
  234    HH2  TRP  31           HH       TRP  31   9.299   3.806   3.299
  235    H    ASP  32           H        ASP  32  11.953  -2.578  -2.318
  236    HA   ASP  32           HA       ASP  32   9.965  -4.625  -2.234
  237   1HB   ASP  32          2HB       ASP  32  11.056  -4.184  -4.326
  238   2HB   ASP  32          1HB       ASP  32  12.648  -4.457  -3.601
  239    H    ALA  33           H        ALA  33  13.197  -4.151  -0.863
  240    HA   ALA  33           HA       ALA  33  13.345  -6.771   0.198
  241   1HB   ALA  33          1HB       ALA  33  15.226  -5.963   1.485
  242   2HB   ALA  33          2HB       ALA  33  14.795  -4.296   1.107
  243   3HB   ALA  33          3HB       ALA  33  15.324  -5.384  -0.176
  244    H    ILE  34           H        ILE  34  12.067  -3.707   1.382
  245    HA   ILE  34           HA       ILE  34  11.518  -4.545   4.032
  246    HB   ILE  34           HB       ILE  34  10.180  -2.478   2.301
  247   1HG1  ILE  34          2HG1      ILE  34  12.104  -2.259   4.626
  248   2HG1  ILE  34          1HG1      ILE  34  12.502  -2.002   2.932
  249   1HG2  ILE  34          1HG2      ILE  34   8.554  -3.237   3.931
  250   2HG2  ILE  34          2HG2      ILE  34   9.119  -1.620   4.355
  251   3HG2  ILE  34          3HG2      ILE  34   9.725  -3.026   5.233
  252   1HD1  ILE  34          1HD1      ILE  34  10.605  -0.330   4.565
  253   2HD1  ILE  34          2HD1      ILE  34  11.034  -0.062   2.874
  254   3HD1  ILE  34          3HD1      ILE  34  12.262   0.099   4.131
  255    H    ALA  35           H        ALA  35   9.512  -4.550   1.095
  256    HA   ALA  35           HA       ALA  35   7.253  -5.771   2.227
  257   1HB   ALA  35          1HB       ALA  35   8.259  -5.986  -0.604
  258   2HB   ALA  35          2HB       ALA  35   7.253  -4.684   0.031
  259   3HB   ALA  35          3HB       ALA  35   6.621  -6.328  -0.048
  260    H    GLY  36           H        GLY  36  10.237  -7.050   0.941
  261   1HA   GLY  36          2HA       GLY  36   9.415  -9.805   1.056
  262   2HA   GLY  36          1HA       GLY  36  11.056  -9.214   0.826
  263    H    CYS  37           H        CYS  37  10.190  -7.552   3.367
  264    HA   CYS  37           HA       CYS  37  11.477  -9.392   5.194
  265   1HB   CYS  37          2HB       CYS  37  12.499  -7.308   5.269
  266   2HB   CYS  37          1HB       CYS  37  10.973  -6.446   5.136
  267    H    GLU  38           H        GLU  38   8.618  -7.213   5.394
  268    HA   GLU  38           HA       GLU  38   7.749  -8.805   7.676
  269   1HB   GLU  38          2HB       GLU  38   7.119  -6.078   6.719
  270   2HB   GLU  38          1HB       GLU  38   5.815  -6.946   7.524
  271   1HG   GLU  38          2HG       GLU  38   7.354  -7.370   9.427
  272   2HG   GLU  38          1HG       GLU  38   8.548  -6.346   8.634
  273    H    ALA  39           H        ALA  39   6.825  -8.114   4.385
  274    HA   ALA  39           HA       ALA  39   4.318  -9.499   4.728
  275   1HB   ALA  39          1HB       ALA  39   4.357  -7.488   3.352
  276   2HB   ALA  39          2HB       ALA  39   3.850  -8.896   2.418
  277   3HB   ALA  39          3HB       ALA  39   5.491  -8.268   2.250
  278    H    GLY  40           H        GLY  40   7.469 -10.352   4.079
  279   1HA   GLY  40          2HA       GLY  40   8.371 -12.431   3.582
  280   2HA   GLY  40          1HA       GLY  40   6.730 -13.050   3.401
  281    H    GLY  41           H        GLY  41   7.439 -10.194   1.786
  282   1HA   GLY  41          2HA       GLY  41   7.685  -9.644  -0.393
  283   2HA   GLY  41          1HA       GLY  41   8.222 -11.288  -0.737
  284    H    ASN  42           H        ASN  42   5.266  -9.610   0.310
  285    HA   ASN  42           HA       ASN  42   3.798 -10.917  -1.828
  286   1HB   ASN  42          2HB       ASN  42   3.609 -12.344   0.245
  287   2HB   ASN  42          1HB       ASN  42   2.826 -10.978   1.034
  288   1HD2  ASN  42          1HD2      ASN  42   2.251 -11.698  -2.355
  289   2HD2  ASN  42          2HD2      ASN  42   0.623 -12.258  -2.139
  290    H    TRP  43           H        TRP  43   3.428  -9.041  -2.840
  291    HA   TRP  43           HA       TRP  43   2.691  -6.652  -1.409
  292   1HB   TRP  43          2HB       TRP  43   2.817  -7.229  -4.370
  293   2HB   TRP  43          1HB       TRP  43   2.608  -5.635  -3.650
  294    HD1  TRP  43           HD       TRP  43   5.218  -8.500  -3.514
  295    HE1  TRP  43           1HE      TRP  43   7.568  -7.415  -3.389
  296    HE3  TRP  43           3HE      TRP  43   3.827  -3.604  -3.322
  297    HZ2  TRP  43           2HZ      TRP  43   8.652  -4.798  -3.248
  298    HZ3  TRP  43           3HZ      TRP  43   5.550  -1.862  -3.188
  299    HH2  TRP  43           HH       TRP  43   7.927  -2.454  -3.149
  300    H    ALA  44           H        ALA  44   1.103  -9.330  -2.322
  301    HA   ALA  44           HA       ALA  44  -1.470  -7.941  -2.704
  302   1HB   ALA  44          1HB       ALA  44  -0.812  -9.396  -4.564
  303   2HB   ALA  44          2HB       ALA  44  -2.281  -9.968  -3.774
  304   3HB   ALA  44          3HB       ALA  44  -0.741 -10.767  -3.458
  305    H    ILE  45           H        ILE  45   0.114  -8.890  -0.194
  306    HA   ILE  45           HA       ILE  45  -1.602 -10.786   1.033
  307    HB   ILE  45           HB       ILE  45   0.889 -10.368   1.506
  308   1HG1  ILE  45          2HG1      ILE  45  -1.004 -10.564   3.844
  309   2HG1  ILE  45          1HG1      ILE  45  -0.562 -11.893   2.779
  310   1HG2  ILE  45          1HG2      ILE  45   1.391  -8.807   3.318
  311   2HG2  ILE  45          2HG2      ILE  45  -0.271  -8.218   3.269
  312   3HG2  ILE  45          3HG2      ILE  45   0.794  -7.973   1.882
  313   1HD1  ILE  45          1HD1      ILE  45   0.710 -12.048   4.808
  314   2HD1  ILE  45          2HD1      ILE  45   1.264 -10.384   4.634
  315   3HD1  ILE  45          3HD1      ILE  45   1.794 -11.614   3.485
  316    H    ASN  46           H        ASN  46  -3.162 -10.435   2.569
  317    HA   ASN  46           HA       ASN  46  -3.879  -7.683   3.259
  318   1HB   ASN  46          2HB       ASN  46  -5.704  -9.591   1.788
  319   2HB   ASN  46          1HB       ASN  46  -6.309  -8.226   2.722
  320   1HD2  ASN  46          1HD2      ASN  46  -5.800  -6.100   2.026
  321   2HD2  ASN  46          2HD2      ASN  46  -5.331  -5.779   0.387
  322    H    THR  47           H        THR  47  -3.429  -7.999   5.316
  323    HA   THR  47           HA       THR  47  -4.094 -10.303   6.781
  324    HB   THR  47           HB       THR  47  -3.650  -8.831   8.791
  325    HG1  THR  47           1HG      THR  47  -2.812  -6.713   8.277
  326   1HG2  THR  47          1HG2      THR  47  -1.584  -8.747   6.586
  327   2HG2  THR  47          2HG2      THR  47  -1.837 -10.082   7.708
  328   3HG2  THR  47          3HG2      THR  47  -1.264  -8.525   8.306
  329    H    GLY  48           H        GLY  48  -5.853  -7.501   5.861
  330   1HA   GLY  48          2HA       GLY  48  -8.174  -7.224   5.969
  331   2HA   GLY  48          1HA       GLY  48  -8.245  -8.512   7.169
  332    H    ASN  49           H        ASN  49  -5.792  -6.227   7.616
  333    HA   ASN  49           HA       ASN  49  -7.155  -5.371  10.055
  334   1HB   ASN  49          2HB       ASN  49  -4.754  -6.392   9.896
  335   2HB   ASN  49          1HB       ASN  49  -4.283  -4.765   9.422
  336   1HD2  ASN  49          1HD2      ASN  49  -4.522  -3.071  10.931
  337   2HD2  ASN  49          2HD2      ASN  49  -4.633  -3.393  12.625
  338    H    GLY  50           H        GLY  50  -7.114  -4.265   7.074
  339   1HA   GLY  50          2HA       GLY  50  -7.838  -2.120   6.395
  340   2HA   GLY  50          1HA       GLY  50  -7.190  -1.462   7.894
  341    H    TYR  51           H        TYR  51  -4.939  -3.520   6.830
  342    HA   TYR  51           HA       TYR  51  -3.469  -1.459   5.376
  343   1HB   TYR  51          2HB       TYR  51  -2.132  -3.796   6.710
  344   2HB   TYR  51          1HB       TYR  51  -1.429  -2.284   6.204
  345    HD1  TYR  51           1HD      TYR  51  -4.124  -0.976   7.726
  346    HD2  TYR  51           2HD      TYR  51  -0.700  -3.298   8.758
  347    HE1  TYR  51           1HE      TYR  51  -4.231  -0.122  10.033
  348    HE2  TYR  51           2HE      TYR  51  -0.805  -2.446  11.060
  349    HH   TYR  51           HH       TYR  51  -3.497  -0.815  12.300
  350    H    TYR  52           H        TYR  52  -1.896  -2.428   3.792
  351    HA   TYR  52           HA       TYR  52  -3.217  -4.688   2.467
  352   1HB   TYR  52          2HB       TYR  52  -2.378  -2.131   1.111
  353   2HB   TYR  52          1HB       TYR  52  -3.237  -3.484   0.373
  354    HD1  TYR  52           1HD      TYR  52  -5.588  -3.897   0.930
  355    HD2  TYR  52           2HD      TYR  52  -3.510  -0.569   2.537
  356    HE1  TYR  52           1HE      TYR  52  -7.735  -2.893   1.593
  357    HE2  TYR  52           2HE      TYR  52  -5.640   0.464   3.202
  358    HH   TYR  52           HH       TYR  52  -8.522  -1.226   3.334
  359    H    GLY  53           H        GLY  53  -1.909  -5.307   0.429
  360   1HA   GLY  53          2HA       GLY  53   0.286  -6.607   1.537
  361   2HA   GLY  53          1HA       GLY  53  -0.140  -6.606  -0.159
  362    H    GLY  54           H        GLY  54   2.422  -6.793   0.670
  363   1HA   GLY  54          2HA       GLY  54   4.354  -5.946  -0.322
  364   2HA   GLY  54          1HA       GLY  54   3.523  -4.423  -0.604
  365    H    VAL  55           H        VAL  55   3.547  -2.844   0.952
  366    HA   VAL  55           HA       VAL  55   5.636  -3.229   2.970
  367    HB   VAL  55           HB       VAL  55   5.000  -0.499   2.837
  368   1HG1  VAL  55          1HG1      VAL  55   7.200  -1.447   3.281
  369   2HG1  VAL  55          2HG1      VAL  55   7.275  -0.304   1.940
  370   3HG1  VAL  55          3HG1      VAL  55   7.289  -2.039   1.622
  371   1HG2  VAL  55          1HG2      VAL  55   3.860  -0.858   0.727
  372   2HG2  VAL  55          2HG2      VAL  55   5.265  -1.715   0.090
  373   3HG2  VAL  55          3HG2      VAL  55   5.373   0.008   0.456
  374    H    GLN  56           H        GLN  56   2.522  -3.593   2.944
  375    HA   GLN  56           HA       GLN  56   0.923  -3.714   4.541
  376   1HB   GLN  56          2HB       GLN  56   3.350  -3.337   6.272
  377   2HB   GLN  56          1HB       GLN  56   1.741  -3.499   6.966
  378   1HG   GLN  56          2HG       GLN  56   3.002  -5.507   5.115
  379   2HG   GLN  56          1HG       GLN  56   3.021  -5.617   6.875
  380   1HE2  GLN  56          1HE2      GLN  56   1.021  -5.743   4.019
  381   2HE2  GLN  56          2HE2      GLN  56  -0.335  -6.505   4.765
  382    H    PHE  57           H        PHE  57   1.121  -1.308   3.232
  383    HA   PHE  57           HA       PHE  57   0.833   0.976   4.837
  384   1HB   PHE  57          2HB       PHE  57  -0.229   0.092   2.200
  385   2HB   PHE  57          1HB       PHE  57  -0.846   1.572   2.922
  386    HD1  PHE  57           1HD      PHE  57   0.710   3.424   3.436
  387    HD2  PHE  57           2HD      PHE  57   1.834   0.042   1.120
  388    HE1  PHE  57           1HE      PHE  57   2.592   4.696   2.497
  389    HE2  PHE  57           2HE      PHE  57   3.717   1.299   0.185
  390    HZ   PHE  57           HZ       PHE  57   4.092   3.634   0.858
  391    H    ASP  58           H        ASP  58  -0.703   1.360   6.412
  392    HA   ASP  58           HA       ASP  58  -3.289   0.161   6.281
  393   1HB   ASP  58          2HB       ASP  58  -3.965   1.791   7.959
  394   2HB   ASP  58          1HB       ASP  58  -2.426   1.065   8.407
  395    H    GLN  59           H        GLN  59  -5.286   1.372   5.799
  396    HA   GLN  59           HA       GLN  59  -5.166   2.461   3.247
  397   1HB   GLN  59          2HB       GLN  59  -7.139   1.379   4.107
  398   2HB   GLN  59          1HB       GLN  59  -7.300   2.588   5.372
  399   1HG   GLN  59          2HG       GLN  59  -8.895   3.137   3.765
  400   2HG   GLN  59          1HG       GLN  59  -7.584   4.288   3.561
  401   1HE2  GLN  59          1HE2      GLN  59  -5.917   2.248   2.161
  402   2HE2  GLN  59          2HE2      GLN  59  -6.583   2.141   0.564
  403    H    GLY  60           H        GLY  60  -5.061   3.976   6.394
  404   1HA   GLY  60          2HA       GLY  60  -5.749   6.609   5.560
  405   2HA   GLY  60          1HA       GLY  60  -4.994   6.166   7.084
  406    H    THR  61           H        THR  61  -2.635   5.094   6.368
  407    HA   THR  61           HA       THR  61  -1.073   7.348   5.679
  408    HB   THR  61           HB       THR  61  -0.364   4.454   5.882
  409    HG1  THR  61           1HG      THR  61  -0.591   4.906   7.920
  410   1HG2  THR  61          1HG2      THR  61   1.304   5.593   4.514
  411   2HG2  THR  61          2HG2      THR  61   1.977   5.191   6.092
  412   3HG2  THR  61          3HG2      THR  61   1.473   6.844   5.744
  413    H    TRP  62           H        TRP  62  -2.039   4.451   3.905
  414    HA   TRP  62           HA       TRP  62  -0.598   4.889   1.551
  415   1HB   TRP  62          2HB       TRP  62  -1.790   2.816   1.995
  416   2HB   TRP  62          1HB       TRP  62  -3.325   3.684   2.012
  417    HD1  TRP  62           HD       TRP  62  -4.512   4.084  -0.229
  418    HE1  TRP  62           1HE      TRP  62  -4.042   3.416  -2.665
  419    HE3  TRP  62           3HE      TRP  62   0.260   2.391   0.318
  420    HZ2  TRP  62           2HZ      TRP  62  -1.891   2.285  -4.199
  421    HZ3  TRP  62           3HZ      TRP  62   1.457   1.533  -1.641
  422    HH2  TRP  62           HH       TRP  62   0.424   1.472  -3.847
  423    H    GLU  63           H        GLU  63  -3.825   5.926   2.542
  424    HA   GLU  63           HA       GLU  63  -4.408   7.363   0.188
  425   1HB   GLU  63          2HB       GLU  63  -6.158   6.590   1.676
  426   2HB   GLU  63          1HB       GLU  63  -5.542   7.580   2.987
  427   1HG   GLU  63          2HG       GLU  63  -6.129   9.595   1.775
  428   2HG   GLU  63          1HG       GLU  63  -6.667   8.634   0.400
  429    H    ALA  64           H        ALA  64  -2.745   8.168   3.154
  430    HA   ALA  64           HA       ALA  64  -2.970  10.986   2.994
  431   1HB   ALA  64          1HB       ALA  64  -0.843   9.361   4.378
  432   2HB   ALA  64          2HB       ALA  64  -2.405   9.803   5.066
  433   3HB   ALA  64          3HB       ALA  64  -1.226  11.057   4.679
  434    H    ASN  65           H        ASN  65  -0.397   8.760   1.931
  435    HA   ASN  65           HA       ASN  65   1.076  10.911   0.715
  436   1HB   ASN  65          2HB       ASN  65   1.445   7.921   0.435
  437   2HB   ASN  65          1HB       ASN  65   2.595   9.157  -0.059
  438   1HD2  ASN  65          1HD2      ASN  65   1.173   7.474   2.628
  439   2HD2  ASN  65          2HD2      ASN  65   2.328   7.996   3.812
  440    H    GLY  66           H        GLY  66  -1.643   9.137  -0.115
  441   1HA   GLY  66          2HA       GLY  66  -3.004   9.796  -1.913
  442   2HA   GLY  66          1HA       GLY  66  -1.587  10.437  -2.728
  443    H    GLY  67           H        GLY  67  -2.395   7.203  -1.448
  444   1HA   GLY  67          2HA       GLY  67  -1.099   6.011  -3.724
  445   2HA   GLY  67          1HA       GLY  67  -1.832   5.167  -2.365
  446    H    LEU  68           H        LEU  68  -4.364   6.670  -2.702
  447    HA   LEU  68           HA       LEU  68  -5.727   4.746  -4.065
  448   1HB   LEU  68          2HB       LEU  68  -6.466   7.508  -3.211
  449   2HB   LEU  68          1HB       LEU  68  -7.616   6.494  -4.064
  450    HG   LEU  68           HG       LEU  68  -7.201   4.768  -2.246
  451   1HD1  LEU  68          1HD1      LEU  68  -6.410   5.581  -0.111
  452   2HD1  LEU  68          2HD1      LEU  68  -6.036   7.142  -0.841
  453   3HD1  LEU  68          3HD1      LEU  68  -5.161   5.700  -1.350
  454   1HD2  LEU  68          1HD2      LEU  68  -8.785   5.831  -0.709
  455   2HD2  LEU  68          2HD2      LEU  68  -9.259   6.055  -2.392
  456   3HD2  LEU  68          3HD2      LEU  68  -8.507   7.378  -1.505
  457    H    ARG  69           H        ARG  69  -4.162   7.515  -5.348
  458    HA   ARG  69           HA       ARG  69  -5.644   7.705  -7.762
  459   1HB   ARG  69          2HB       ARG  69  -3.841   9.092  -8.569
  460   2HB   ARG  69          1HB       ARG  69  -4.219   9.535  -6.911
  461   1HG   ARG  69          2HG       ARG  69  -2.289   8.482  -6.080
  462   2HG   ARG  69          1HG       ARG  69  -2.006   7.638  -7.603
  463   1HD   ARG  69          2HD       ARG  69  -1.844  10.624  -7.180
  464   2HD   ARG  69          1HD       ARG  69  -0.469   9.528  -7.301
  465    HE   ARG  69           HE       ARG  69  -1.435   9.021  -9.613
  466   1HH1  ARG  69          1HH1      ARG  69  -1.692  12.124  -7.999
  467   2HH1  ARG  69          2HH1      ARG  69  -1.771  13.026  -9.487
  468   1HH2  ARG  69          1HH2      ARG  69  -1.520  10.226 -11.573
  469   2HH2  ARG  69          2HH2      ARG  69  -1.676  11.954 -11.501
  470    H    TYR  70           H        TYR  70  -2.965   5.796  -6.630
  471    HA   TYR  70           HA       TYR  70  -2.367   4.690  -9.254
  472   1HB   TYR  70          2HB       TYR  70  -1.514   3.761  -6.508
  473   2HB   TYR  70          1HB       TYR  70  -0.727   3.394  -8.042
  474    HD1  TYR  70           1HD      TYR  70   0.429   5.317  -9.275
  475    HD2  TYR  70           2HD      TYR  70  -0.920   5.618  -5.252
  476    HE1  TYR  70           1HE      TYR  70   1.914   7.246  -8.925
  477    HE2  TYR  70           2HE      TYR  70   0.557   7.533  -4.895
  478    HH   TYR  70           HH       TYR  70   2.473   8.582  -5.763
  479    H    ALA  71           H        ALA  71  -4.010   4.075  -6.300
  480    HA   ALA  71           HA       ALA  71  -5.953   2.320  -7.107
  481   1HB   ALA  71          1HB       ALA  71  -3.536   0.835  -6.054
  482   2HB   ALA  71          2HB       ALA  71  -4.188   0.715  -7.688
  483   3HB   ALA  71          3HB       ALA  71  -5.135   0.136  -6.320
  484    HA   PRO  72           HA       PRO  72  -6.911   3.858  -3.071
  485   1HB   PRO  72          2HB       PRO  72  -8.993   1.827  -3.062
  486   2HB   PRO  72          1HB       PRO  72  -9.109   3.573  -2.906
  487   1HG   PRO  72          2HG       PRO  72  -9.840   2.238  -5.148
  488   2HG   PRO  72          1HG       PRO  72  -9.251   3.910  -5.146
  489   1HD   PRO  72          2HD       PRO  72  -7.900   1.436  -6.022
  490   2HD   PRO  72          1HD       PRO  72  -7.642   3.119  -6.527
  491    H    ARG  73           H        ARG  73  -5.838   0.756  -3.759
  492    HA   ARG  73           HA       ARG  73  -5.079   0.416  -0.971
  493   1HB   ARG  73          2HB       ARG  73  -5.848  -1.871  -0.824
  494   2HB   ARG  73          1HB       ARG  73  -7.210  -0.833  -1.223
  495   1HG   ARG  73          2HG       ARG  73  -6.758  -1.455  -3.639
  496   2HG   ARG  73          1HG       ARG  73  -5.713  -2.722  -2.987
  497   1HD   ARG  73          2HD       ARG  73  -8.577  -2.411  -2.111
  498   2HD   ARG  73          1HD       ARG  73  -8.145  -3.330  -3.550
  499    HE   ARG  73           HE       ARG  73  -6.555  -4.295  -1.499
  500   1HH1  ARG  73          1HH1      ARG  73  -9.990  -4.043  -2.126
  501   2HH1  ARG  73          2HH1      ARG  73 -10.373  -5.560  -1.381
  502   1HH2  ARG  73          1HH2      ARG  73  -7.043  -6.284  -0.523
  503   2HH2  ARG  73          2HH2      ARG  73  -8.684  -6.852  -0.466
  504    H    ALA  74           H        ALA  74  -3.159  -0.519  -0.751
  505    HA   ALA  74           HA       ALA  74  -1.300  -0.388  -2.772
  506   1HB   ALA  74          1HB       ALA  74  -0.889  -0.315  -0.301
  507   2HB   ALA  74          2HB       ALA  74   0.275  -1.249  -1.238
  508   3HB   ALA  74          3HB       ALA  74  -0.975  -2.076  -0.309
  509    H    ASP  75           H        ASP  75  -3.268  -3.156  -1.849
  510    HA   ASP  75           HA       ASP  75  -1.539  -4.995  -3.230
  511   1HB   ASP  75          2HB       ASP  75  -3.194  -6.715  -2.709
  512   2HB   ASP  75          1HB       ASP  75  -2.756  -5.796  -1.276
  513    H    LEU  76           H        LEU  76  -3.966  -2.882  -4.111
  514    HA   LEU  76           HA       LEU  76  -4.633  -4.286  -6.575
  515   1HB   LEU  76          2HB       LEU  76  -6.332  -2.949  -5.337
  516   2HB   LEU  76          1HB       LEU  76  -5.374  -1.512  -5.627
  517    HG   LEU  76           HG       LEU  76  -5.701  -1.832  -8.065
  518   1HD1  LEU  76          1HD1      LEU  76  -7.474  -3.364  -8.810
  519   2HD1  LEU  76          2HD1      LEU  76  -7.589  -4.006  -7.173
  520   3HD1  LEU  76          3HD1      LEU  76  -6.105  -4.221  -8.099
  521   1HD2  LEU  76          1HD2      LEU  76  -7.101  -0.294  -6.815
  522   2HD2  LEU  76          2HD2      LEU  76  -8.204  -1.605  -6.396
  523   3HD2  LEU  76          3HD2      LEU  76  -8.043  -1.091  -8.075
  524    H    ALA  77           H        ALA  77  -2.721  -1.663  -5.352
  525    HA   ALA  77           HA       ALA  77  -1.656  -0.825  -7.870
  526   1HB   ALA  77          1HB       ALA  77  -1.849   0.707  -5.971
  527   2HB   ALA  77          2HB       ALA  77  -0.171   0.544  -6.491
  528   3HB   ALA  77          3HB       ALA  77  -0.732  -0.295  -5.045
  529    H    THR  78           H        THR  78   0.688  -0.947  -8.307
  530    HA   THR  78           HA       THR  78   1.718  -3.602  -7.599
  531    HB   THR  78           HB       THR  78   3.135  -3.391  -9.581
  532    HG1  THR  78           1HG      THR  78   1.920  -0.806  -9.717
  533   1HG2  THR  78          1HG2      THR  78   1.305  -3.299 -11.266
  534   2HG2  THR  78          2HG2      THR  78   0.230  -2.723  -9.985
  535   3HG2  THR  78          3HG2      THR  78   0.948  -4.331  -9.880
  536    H    ARG  79           H        ARG  79   4.293  -3.543  -7.781
  537    HA   ARG  79           HA       ARG  79   5.246  -2.614  -5.396
  538   1HB   ARG  79          2HB       ARG  79   6.798  -3.024  -7.952
  539   2HB   ARG  79          1HB       ARG  79   7.532  -2.806  -6.375
  540   1HG   ARG  79          2HG       ARG  79   6.466  -4.854  -5.592
  541   2HG   ARG  79          1HG       ARG  79   5.721  -5.065  -7.178
  542   1HD   ARG  79          2HD       ARG  79   7.785  -6.422  -6.832
  543   2HD   ARG  79          1HD       ARG  79   7.849  -5.347  -8.226
  544    HE   ARG  79           HE       ARG  79   9.172  -4.764  -5.648
  545   1HH1  ARG  79          1HH1      ARG  79   9.111  -4.778  -9.148
  546   2HH1  ARG  79          2HH1      ARG  79  10.679  -4.039  -9.303
  547   1HH2  ARG  79          1HH2      ARG  79  11.248  -3.791  -5.863
  548   2HH2  ARG  79          2HH2      ARG  79  11.892  -3.495  -7.451
  549    H    GLU  80           H        GLU  80   5.629  -1.079  -8.549
  550    HA   GLU  80           HA       GLU  80   7.184   1.082  -7.677
  551   1HB   GLU  80          2HB       GLU  80   6.361   2.159  -9.835
  552   2HB   GLU  80          1HB       GLU  80   7.202   0.624  -9.968
  553   1HG   GLU  80          2HG       GLU  80   4.268   0.487  -9.767
  554   2HG   GLU  80          1HG       GLU  80   4.931   1.165 -11.253
  555    H    GLU  81           H        GLU  81   3.708   0.627  -7.717
  556    HA   GLU  81           HA       GLU  81   3.069   3.335  -7.088
  557   1HB   GLU  81          2HB       GLU  81   1.574   0.745  -7.002
  558   2HB   GLU  81          1HB       GLU  81   0.883   2.205  -6.302
  559   1HG   GLU  81          2HG       GLU  81   0.537   3.178  -8.285
  560   2HG   GLU  81          1HG       GLU  81   1.962   2.460  -9.017
  561    H    GLN  82           H        GLN  82   3.351   0.375  -5.080
  562    HA   GLN  82           HA       GLN  82   2.895   1.697  -2.623
  563   1HB   GLN  82          2HB       GLN  82   4.400  -0.804  -3.314
  564   2HB   GLN  82          1HB       GLN  82   4.454  -0.159  -1.683
  565   1HG   GLN  82          2HG       GLN  82   2.614  -1.292  -1.249
  566   2HG   GLN  82          1HG       GLN  82   1.752  -0.231  -2.366
  567   1HE2  GLN  82          1HE2      GLN  82   1.523  -3.179  -1.724
  568   2HE2  GLN  82          2HE2      GLN  82   1.626  -3.939  -3.289
  569    H    ILE  83           H        ILE  83   5.719   1.254  -4.596
  570    HA   ILE  83           HA       ILE  83   7.670   2.265  -2.858
  571    HB   ILE  83           HB       ILE  83   7.468   2.181  -5.861
  572   1HG1  ILE  83          2HG1      ILE  83   9.441   0.775  -4.071
  573   2HG1  ILE  83          1HG1      ILE  83   7.853   0.099  -4.402
  574   1HG2  ILE  83          1HG2      ILE  83   8.800   4.111  -5.432
  575   2HG2  ILE  83          2HG2      ILE  83   9.876   2.800  -5.913
  576   3HG2  ILE  83          3HG2      ILE  83   9.741   3.256  -4.217
  577   1HD1  ILE  83          1HD1      ILE  83   8.371   0.076  -6.794
  578   2HD1  ILE  83          2HD1      ILE  83   9.538  -0.860  -5.859
  579   3HD1  ILE  83          3HD1      ILE  83   9.967   0.747  -6.446
  580    H    ALA  84           H        ALA  84   5.711   3.920  -5.331
  581    HA   ALA  84           HA       ALA  84   6.777   6.482  -4.959
  582   1HB   ALA  84          1HB       ALA  84   4.782   7.292  -6.100
  583   2HB   ALA  84          2HB       ALA  84   3.996   5.730  -5.856
  584   3HB   ALA  84          3HB       ALA  84   5.417   5.849  -6.893
  585    H    VAL  85           H        VAL  85   3.961   4.933  -3.451
  586    HA   VAL  85           HA       VAL  85   3.159   7.201  -1.960
  587    HB   VAL  85           HB       VAL  85   2.639   4.274  -1.486
  588   1HG1  VAL  85          1HG1      VAL  85   0.626   5.044  -0.272
  589   2HG1  VAL  85          2HG1      VAL  85   1.178   6.709  -0.456
  590   3HG1  VAL  85          3HG1      VAL  85   2.121   5.567   0.503
  591   1HG2  VAL  85          1HG2      VAL  85   1.063   6.333  -3.018
  592   2HG2  VAL  85          2HG2      VAL  85   0.514   4.697  -2.661
  593   3HG2  VAL  85          3HG2      VAL  85   1.923   4.949  -3.690
  594    H    ALA  86           H        ALA  86   4.936   4.237  -1.029
  595    HA   ALA  86           HA       ALA  86   5.379   4.957   1.635
  596   1HB   ALA  86          1HB       ALA  86   7.059   3.194   1.647
  597   2HB   ALA  86          2HB       ALA  86   7.024   3.135  -0.115
  598   3HB   ALA  86          3HB       ALA  86   5.600   2.661   0.812
  599    H    GLU  87           H        GLU  87   7.068   5.728  -1.324
  600    HA   GLU  87           HA       GLU  87   9.431   6.569   0.042
  601   1HB   GLU  87          2HB       GLU  87  10.368   7.057  -2.000
  602   2HB   GLU  87          1HB       GLU  87   9.196   5.818  -2.420
  603   1HG   GLU  87          2HG       GLU  87   8.921   7.297  -4.088
  604   2HG   GLU  87          1HG       GLU  87   7.663   7.819  -2.970
  605    H    VAL  88           H        VAL  88   6.455   8.201  -0.925
  606    HA   VAL  88           HA       VAL  88   7.269  10.776  -0.071
  607    HB   VAL  88           HB       VAL  88   4.490   9.568   0.179
  608   1HG1  VAL  88          1HG1      VAL  88   5.426  12.443   0.228
  609   2HG1  VAL  88          2HG1      VAL  88   4.812  11.517   1.606
  610   3HG1  VAL  88          3HG1      VAL  88   3.744  11.906   0.249
  611   1HG2  VAL  88          1HG2      VAL  88   4.017  10.749  -1.926
  612   2HG2  VAL  88          2HG2      VAL  88   5.282   9.539  -2.135
  613   3HG2  VAL  88          3HG2      VAL  88   5.705  11.247  -2.027
  614    H    THR  89           H        THR  89   5.989   7.955   1.589
  615    HA   THR  89           HA       THR  89   5.635   9.157   4.109
  616    HB   THR  89           HB       THR  89   6.328   6.251   3.813
  617    HG1  THR  89           1HG      THR  89   4.306   7.617   2.546
  618   1HG2  THR  89          1HG2      THR  89   5.801   7.257   6.030
  619   2HG2  THR  89          2HG2      THR  89   4.698   5.970   5.550
  620   3HG2  THR  89          3HG2      THR  89   4.197   7.655   5.417
  621    H    ARG  90           H        ARG  90   8.309   7.292   2.727
  622    HA   ARG  90           HA       ARG  90   9.876   7.100   5.037
  623   1HB   ARG  90          2HB       ARG  90  11.712   6.473   3.563
  624   2HB   ARG  90          1HB       ARG  90  10.220   5.683   3.079
  625   1HG   ARG  90          2HG       ARG  90  11.033   6.318   1.046
  626   2HG   ARG  90          1HG       ARG  90  10.037   7.711   1.440
  627   1HD   ARG  90          2HD       ARG  90  12.121   8.815   2.305
  628   2HD   ARG  90          1HD       ARG  90  13.029   7.465   1.616
  629    HE   ARG  90           HE       ARG  90  11.220   8.738  -0.232
  630   1HH1  ARG  90          1HH1      ARG  90  14.474   8.844   1.090
  631   2HH1  ARG  90          2HH1      ARG  90  15.133   9.634  -0.316
  632   1HH2  ARG  90          1HH2      ARG  90  12.075   9.747  -2.052
  633   2HH2  ARG  90          2HH2      ARG  90  13.771  10.145  -2.096
  634    H    LEU  91           H        LEU  91   9.577   9.642   2.699
  635    HA   LEU  91           HA       LEU  91  12.048  10.899   3.418
  636   1HB   LEU  91          2HB       LEU  91  11.394  12.737   1.981
  637   2HB   LEU  91          1HB       LEU  91  11.167  11.202   1.177
  638    HG   LEU  91           HG       LEU  91   8.668  11.488   1.898
  639   1HD1  LEU  91          1HD1      LEU  91   9.622  14.349   1.955
  640   2HD1  LEU  91          2HD1      LEU  91   9.043  13.430   3.342
  641   3HD1  LEU  91          3HD1      LEU  91   7.946  13.806   2.015
  642   1HD2  LEU  91          1HD2      LEU  91   9.465  11.466  -0.399
  643   2HD2  LEU  91          2HD2      LEU  91   9.929  13.162  -0.271
  644   3HD2  LEU  91          3HD2      LEU  91   8.229  12.702  -0.176
  645    H    ARG  92           H        ARG  92   8.918  10.849   4.702
  646    HA   ARG  92           HA       ARG  92   9.108  13.417   6.014
  647   1HB   ARG  92          2HB       ARG  92   7.092  11.297   6.627
  648   2HB   ARG  92          1HB       ARG  92   6.948  13.037   6.834
  649   1HG   ARG  92          2HG       ARG  92   6.672  13.393   4.536
  650   2HG   ARG  92          1HG       ARG  92   7.226  11.760   4.143
  651   1HD   ARG  92          2HD       ARG  92   4.620  12.652   5.276
  652   2HD   ARG  92          1HD       ARG  92   4.945  11.542   3.941
  653    HE   ARG  92           HE       ARG  92   5.986  10.234   6.026
  654   1HH1  ARG  92          1HH1      ARG  92   2.880  11.789   5.561
  655   2HH1  ARG  92          2HH1      ARG  92   2.031  10.736   6.660
  656   1HH2  ARG  92          1HH2      ARG  92   4.847   8.815   7.481
  657   2HH2  ARG  92          2HH2      ARG  92   3.132   9.010   7.699
  658    H    GLN  93           H        GLN  93   9.021   9.999   6.914
  659    HA   GLN  93           HA       GLN  93   9.654  10.829   9.621
  660   1HB   GLN  93          2HB       GLN  93   8.459   9.099  10.444
  661   2HB   GLN  93          1HB       GLN  93   7.676   9.245   8.874
  662   1HG   GLN  93          2HG       GLN  93   9.917   7.325   9.444
  663   2HG   GLN  93          1HG       GLN  93   8.212   6.923   9.619
  664   1HE2  GLN  93          1HE2      GLN  93   6.929   6.754   7.771
  665   2HE2  GLN  93          2HE2      GLN  93   7.646   6.565   6.197
  666    H    GLY  94           H        GLY  94  11.094   9.015   7.016
  667   1HA   GLY  94          2HA       GLY  94  13.466   9.005   6.823
  668   2HA   GLY  94          1HA       GLY  94  13.586   9.148   8.570
  669    H    TRP  95           H        TRP  95  11.557   6.899   6.837
  670    HA   TRP  95           HA       TRP  95  11.420   4.664   6.748
  671   1HB   TRP  95          2HB       TRP  95  14.349   4.495   7.473
  672   2HB   TRP  95          1HB       TRP  95  13.379   3.299   6.615
  673    HD1  TRP  95           HD       TRP  95  15.023   6.725   6.080
  674    HE1  TRP  95           1HE      TRP  95  15.410   7.054   3.572
  675    HE3  TRP  95           3HE      TRP  95  12.574   2.594   4.351
  676    HZ2  TRP  95           2HZ      TRP  95  14.747   5.746   1.158
  677    HZ3  TRP  95           3HZ      TRP  95  12.491   2.211   1.920
  678    HH2  TRP  95           HH       TRP  95  13.554   3.757   0.359
  679    H    GLY  96           H        GLY  96  11.717   6.418   9.356
  680   1HA   GLY  96          2HA       GLY  96  12.362   4.626  11.443
  681   2HA   GLY  96          1HA       GLY  96  11.403   6.090  11.610
  682    H    ALA  97           H        ALA  97   9.391   5.241   9.707
  683    HA   ALA  97           HA       ALA  97   7.647   3.866  11.461
  684   1HB   ALA  97          1HB       ALA  97   6.834   5.467   9.797
  685   2HB   ALA  97          2HB       ALA  97   6.055   3.893   9.617
  686   3HB   ALA  97          3HB       ALA  97   7.335   4.376   8.503
  687    H    TRP  98           H        TRP  98   9.777   2.862   8.891
  688    HA   TRP  98           HA       TRP  98   8.780   0.110   9.110
  689   1HB   TRP  98          2HB       TRP  98  10.739   1.398   7.188
  690   2HB   TRP  98          1HB       TRP  98  10.282  -0.302   7.158
  691    HD1  TRP  98           HD       TRP  98   7.781  -0.882   6.330
  692    HE1  TRP  98           1HE      TRP  98   6.162   0.395   4.797
  693    HE3  TRP  98           3HE      TRP  98   9.930   3.792   6.548
  694    HZ2  TRP  98           2HZ      TRP  98   5.839   3.016   3.782
  695    HZ3  TRP  98           3HZ      TRP  98   8.889   5.605   5.260
  696    HH2  TRP  98           HH       TRP  98   6.890   5.222   3.924
  697    HA   PRO  99           HA       PRO  99  12.098   0.028  12.113
  698   1HB   PRO  99          2HB       PRO  99  10.995  -2.588  12.863
  699   2HB   PRO  99          1HB       PRO  99  11.165  -1.116  13.817
  700   1HG   PRO  99          2HG       PRO  99   8.765  -1.916  12.989
  701   2HG   PRO  99          1HG       PRO  99   9.220  -0.198  13.003
  702   1HD   PRO  99          2HD       PRO  99   9.240  -2.109  10.674
  703   2HD   PRO  99          1HD       PRO  99   8.507  -0.487  10.779
  704    H    VAL 100           H        VAL 100  11.678  -3.422  11.639
  705    HA   VAL 100           HA       VAL 100  14.511  -3.731  11.479
  706    HB   VAL 100           HB       VAL 100  12.367  -5.816  11.010
  707   1HG1  VAL 100          1HG1      VAL 100  14.591  -6.485  10.240
  708   2HG1  VAL 100          2HG1      VAL 100  14.082  -7.423  11.646
  709   3HG1  VAL 100          3HG1      VAL 100  15.252  -6.117  11.834
  710   1HG2  VAL 100          1HG2      VAL 100  13.756  -5.062  13.579
  711   2HG2  VAL 100          2HG2      VAL 100  12.612  -6.387  13.365
  712   3HG2  VAL 100          3HG2      VAL 100  12.072  -4.721  13.177
  713    H    CYS 101           H        CYS 101  11.935  -3.460   9.247
  714    HA   CYS 101           HA       CYS 101  13.164  -4.968   7.150
  715   1HB   CYS 101          2HB       CYS 101  10.780  -3.118   7.104
  716   2HB   CYS 101          1HB       CYS 101  11.259  -4.195   5.790
  717    H    ALA 102           H        ALA 102  12.869  -1.518   7.901
  718    HA   ALA 102           HA       ALA 102  13.911  -0.645   5.408
  719   1HB   ALA 102          1HB       ALA 102  12.629   0.849   6.846
  720   2HB   ALA 102          2HB       ALA 102  14.221   1.519   6.488
  721   3HB   ALA 102          3HB       ALA 102  13.904   0.788   8.062
  722    H    ALA 103           H        ALA 103  15.370  -1.234   8.583
  723    HA   ALA 103           HA       ALA 103  17.976  -0.446   7.966
  724   1HB   ALA 103          1HB       ALA 103  17.122  -2.624   9.869
  725   2HB   ALA 103          2HB       ALA 103  17.173  -0.901  10.245
  726   3HB   ALA 103          3HB       ALA 103  18.665  -1.768   9.879
  727    H    ARG 104           H        ARG 104  16.319  -3.502   7.466
  728    HA   ARG 104           HA       ARG 104  18.549  -4.964   6.584
  729   1HB   ARG 104          2HB       ARG 104  16.534  -5.931   7.594
  730   2HB   ARG 104          1HB       ARG 104  15.570  -5.346   6.244
  731   1HG   ARG 104          2HG       ARG 104  15.988  -7.643   5.922
  732   2HG   ARG 104          1HG       ARG 104  16.940  -6.724   4.757
  733   1HD   ARG 104          2HD       ARG 104  18.262  -8.532   5.738
  734   2HD   ARG 104          1HD       ARG 104  18.906  -6.943   6.162
  735    HE   ARG 104           HE       ARG 104  17.100  -8.245   8.061
  736   1HH1  ARG 104          1HH1      ARG 104  20.327  -7.209   7.198
  737   2HH1  ARG 104          2HH1      ARG 104  20.973  -7.454   8.794
  738   1HH2  ARG 104          1HH2      ARG 104  17.932  -8.564  10.163
  739   2HH2  ARG 104          2HH2      ARG 104  19.612  -8.233  10.485
  740    H    ALA 105           H        ALA 105  16.146  -2.931   5.055
  741    HA   ALA 105           HA       ALA 105  16.687  -3.941   2.381
  742   1HB   ALA 105          1HB       ALA 105  14.891  -2.458   1.715
  743   2HB   ALA 105          2HB       ALA 105  14.846  -1.767   3.337
  744   3HB   ALA 105          3HB       ALA 105  14.416  -3.459   3.086
  745    H    GLY 106           H        GLY 106  17.658  -1.253   4.366
  746   1HA   GLY 106          2HA       GLY 106  19.698  -0.092   3.528
  747   2HA   GLY 106          1HA       GLY 106  18.867   0.023   1.984
  748    H    ALA 107           H        ALA 107  18.123   0.778   5.366
  749    HA   ALA 107           HA       ALA 107  16.408   2.935   4.792
  750   1HB   ALA 107          1HB       ALA 107  16.279   1.664   6.887
  751   2HB   ALA 107          2HB       ALA 107  16.480   3.390   7.183
  752   3HB   ALA 107          3HB       ALA 107  17.854   2.299   7.364
  753    H    ARG 108           H        ARG 108  16.748   5.167   5.163
  754    HA   ARG 108           HA       ARG 108  19.551   5.928   4.762
  755   1HB   ARG 108          2HB       ARG 108  17.147   7.004   3.292
  756   2HB   ARG 108          1HB       ARG 108  18.815   7.519   3.059
  757   1HG   ARG 108          2HG       ARG 108  19.429   5.387   2.181
  758   2HG   ARG 108          1HG       ARG 108  17.855   4.693   2.601
  759   1HD   ARG 108          2HD       ARG 108  18.080   5.278   0.187
  760   2HD   ARG 108          1HD       ARG 108  16.753   6.126   0.988
  761    HE   ARG 108           HE       ARG 108  19.180   7.645   1.008
  762   1HH1  ARG 108          1HH1      ARG 108  16.507   6.725  -1.079
  763   2HH1  ARG 108          2HH1      ARG 108  16.553   8.212  -1.977
  764   1HH2  ARG 108          1HH2      ARG 108  19.234   9.575  -0.170
  765   2HH2  ARG 108          2HH2      ARG 108  18.096   9.843  -1.453
  Start of MODEL   15
    1   1H    ASN   1          1HT       ASN   1 -26.193  29.475   0.142
    2   2H    ASN   1          2HT       ASN   1 -25.228  30.814  -0.243
    3   3H    ASN   1          3HT       ASN   1 -24.546  29.470   0.529
    4    HA   ASN   1           HA       ASN   1 -25.772  29.396  -2.154
    5   1HB   ASN   1          2HB       ASN   1 -23.508  29.326  -3.071
    6   2HB   ASN   1          1HB       ASN   1 -23.766  30.820  -2.180
    7   1HD2  ASN   1          1HD2      ASN   1 -21.315  29.356  -2.903
    8   2HD2  ASN   1          2HD2      ASN   1 -20.472  29.092  -1.409
    9    H    VAL   2           H        VAL   2 -26.132  27.424  -2.872
   10    HA   VAL   2           HA       VAL   2 -24.997  25.151  -1.410
   11    HB   VAL   2           HB       VAL   2 -27.489  25.364  -1.733
   12   1HG1  VAL   2          1HG1      VAL   2 -28.426  24.693  -3.900
   13   2HG1  VAL   2          2HG1      VAL   2 -26.807  24.730  -4.599
   14   3HG1  VAL   2          3HG1      VAL   2 -27.541  26.214  -3.991
   15   1HG2  VAL   2          1HG2      VAL   2 -26.154  22.889  -2.820
   16   2HG2  VAL   2          2HG2      VAL   2 -27.826  22.982  -2.265
   17   3HG2  VAL   2          3HG2      VAL   2 -26.502  23.242  -1.129
   18    H    VAL   3           H        VAL   3 -23.820  26.943  -3.555
   19    HA   VAL   3           HA       VAL   3 -23.554  25.633  -5.974
   20    HB   VAL   3           HB       VAL   3 -21.604  27.530  -4.671
   21   1HG1  VAL   3          1HG1      VAL   3 -21.951  26.783  -7.573
   22   2HG1  VAL   3          2HG1      VAL   3 -20.597  26.331  -6.538
   23   3HG1  VAL   3          3HG1      VAL   3 -20.864  28.025  -6.952
   24   1HG2  VAL   3          1HG2      VAL   3 -23.840  28.479  -4.815
   25   2HG2  VAL   3          2HG2      VAL   3 -23.918  28.073  -6.529
   26   3HG2  VAL   3          3HG2      VAL   3 -22.756  29.272  -5.960
   27    H    VAL   4           H        VAL   4 -22.761  23.670  -6.282
   28    HA   VAL   4           HA       VAL   4 -20.346  22.818  -4.825
   29    HB   VAL   4           HB       VAL   4 -22.090  21.156  -6.651
   30   1HG1  VAL   4          1HG1      VAL   4 -20.030  20.359  -4.601
   31   2HG1  VAL   4          2HG1      VAL   4 -19.848  20.277  -6.353
   32   3HG1  VAL   4          3HG1      VAL   4 -21.029  19.249  -5.541
   33   1HG2  VAL   4          1HG2      VAL   4 -23.430  21.938  -4.771
   34   2HG2  VAL   4          2HG2      VAL   4 -22.205  21.353  -3.644
   35   3HG2  VAL   4          3HG2      VAL   4 -23.110  20.210  -4.636
   36    H    THR   5           H        THR   5 -18.565  22.044  -6.026
   37    HA   THR   5           HA       THR   5 -18.125  23.573  -8.433
   38    HB   THR   5           HB       THR   5 -15.802  22.551  -8.292
   39    HG1  THR   5           1HG      THR   5 -15.626  20.922  -6.960
   40   1HG2  THR   5          1HG2      THR   5 -16.819  24.071  -5.886
   41   2HG2  THR   5          2HG2      THR   5 -16.324  24.782  -7.423
   42   3HG2  THR   5          3HG2      THR   5 -15.137  23.965  -6.405
   43    HA   PRO   6           HA       PRO   6 -19.460  20.149 -11.022
   44   1HB   PRO   6          2HB       PRO   6 -18.449  22.010 -13.096
   45   2HB   PRO   6          1HB       PRO   6 -20.006  21.178 -12.980
   46   1HG   PRO   6          2HG       PRO   6 -19.890  23.756 -12.443
   47   2HG   PRO   6          1HG       PRO   6 -20.828  22.672 -11.394
   48   1HD   PRO   6          2HD       PRO   6 -18.061  23.759 -10.961
   49   2HD   PRO   6          1HD       PRO   6 -19.433  23.726  -9.833
   50    H    ALA   7           H        ALA   7 -18.157  18.625 -10.840
   51    HA   ALA   7           HA       ALA   7 -15.409  18.829 -11.868
   52   1HB   ALA   7          1HB       ALA   7 -16.453  16.985  -9.735
   53   2HB   ALA   7          2HB       ALA   7 -15.530  18.460  -9.453
   54   3HB   ALA   7          3HB       ALA   7 -14.784  17.096 -10.286
   55    H    HIS   8           H        HIS   8 -17.717  18.227 -13.411
   56    HA   HIS   8           HA       HIS   8 -17.546  15.505 -14.229
   57   1HB   HIS   8          2HB       HIS   8 -18.467  17.948 -15.768
   58   2HB   HIS   8          1HB       HIS   8 -18.667  16.285 -16.306
   59    HD1  HIS   8           1HD      HIS   8 -20.325  14.786 -14.817
   60    HD2  HIS   8           2HD      HIS   8 -20.385  18.882 -14.102
   61    HE1  HIS   8           1HE      HIS   8 -22.459  15.257 -13.541
   62    H    GLU   9           H        GLU   9 -15.494  18.128 -14.405
   63    HA   GLU   9           HA       GLU   9 -13.978  16.949 -16.618
   64   1HB   GLU   9          2HB       GLU   9 -13.007  19.163 -16.953
   65   2HB   GLU   9          1HB       GLU   9 -14.762  19.243 -17.024
   66   1HG   GLU   9          2HG       GLU   9 -14.773  20.023 -14.676
   67   2HG   GLU   9          1HG       GLU   9 -13.012  20.067 -14.728
   68    H    ALA  10           H        ALA  10 -11.950  16.256 -16.199
   69    HA   ALA  10           HA       ALA  10 -10.579  17.045 -13.778
   70   1HB   ALA  10          1HB       ALA  10 -10.279  14.755 -12.973
   71   2HB   ALA  10          2HB       ALA  10 -11.314  14.162 -14.272
   72   3HB   ALA  10          3HB       ALA  10 -11.988  15.195 -13.011
   73    H    VAL  11           H        VAL  11  -9.481  17.915 -15.696
   74    HA   VAL  11           HA       VAL  11  -7.881  16.072 -17.210
   75    HB   VAL  11           HB       VAL  11  -8.848  18.113 -18.229
   76   1HG1  VAL  11          1HG1      VAL  11  -7.808  20.287 -17.829
   77   2HG1  VAL  11          2HG1      VAL  11  -6.841  19.579 -16.534
   78   3HG1  VAL  11          3HG1      VAL  11  -8.598  19.656 -16.383
   79   1HG2  VAL  11          1HG2      VAL  11  -6.968  17.030 -19.303
   80   2HG2  VAL  11          2HG2      VAL  11  -5.839  17.937 -18.293
   81   3HG2  VAL  11          3HG2      VAL  11  -6.834  18.780 -19.481
   82    H    VAL  12           H        VAL  12  -7.624  18.086 -14.431
   83    HA   VAL  12           HA       VAL  12  -5.886  18.963 -13.279
   84    HB   VAL  12           HB       VAL  12  -6.543  17.057 -12.070
   85   1HG1  VAL  12          1HG1      VAL  12  -4.588  15.434 -13.683
   86   2HG1  VAL  12          2HG1      VAL  12  -6.346  15.359 -13.795
   87   3HG1  VAL  12          3HG1      VAL  12  -5.534  14.851 -12.312
   88   1HG2  VAL  12          1HG2      VAL  12  -4.488  16.537 -10.830
   89   2HG2  VAL  12          2HG2      VAL  12  -4.644  18.257 -11.194
   90   3HG2  VAL  12          3HG2      VAL  12  -3.544  17.253 -12.139
   91    H    ARG  13           H        ARG  13  -4.796  20.053 -14.737
   92    HA   ARG  13           HA       ARG  13  -3.301  20.706 -16.291
   93   1HB   ARG  13          2HB       ARG  13  -1.031  20.590 -15.616
   94   2HB   ARG  13          1HB       ARG  13  -2.014  20.706 -14.167
   95   1HG   ARG  13          2HG       ARG  13  -1.735  18.322 -13.778
   96   2HG   ARG  13          1HG       ARG  13  -0.761  18.191 -15.242
   97   1HD   ARG  13          2HD       ARG  13   0.694  18.314 -13.328
   98   2HD   ARG  13          1HD       ARG  13   0.844  19.796 -14.273
   99    HE   ARG  13           HE       ARG  13  -0.962  19.758 -11.959
  100   1HH1  ARG  13          1HH1      ARG  13   1.937  20.960 -13.529
  101   2HH1  ARG  13          2HH1      ARG  13   2.245  22.170 -12.309
  102   1HH2  ARG  13          1HH2      ARG  13  -0.566  21.320 -10.370
  103   2HH2  ARG  13          2HH2      ARG  13   0.821  22.363 -10.495
  104    H    VAL  14           H        VAL  14  -2.951  20.206 -18.331
  105    HA   VAL  14           HA       VAL  14  -2.908  17.553 -19.291
  106    HB   VAL  14           HB       VAL  14  -1.752  19.852 -20.803
  107   1HG1  VAL  14          1HG1      VAL  14  -3.361  17.466 -21.676
  108   2HG1  VAL  14          2HG1      VAL  14  -1.617  17.669 -21.838
  109   3HG1  VAL  14          3HG1      VAL  14  -2.713  18.714 -22.742
  110   1HG2  VAL  14          1HG2      VAL  14  -4.694  19.320 -20.422
  111   2HG2  VAL  14          2HG2      VAL  14  -4.015  20.442 -21.602
  112   3HG2  VAL  14          3HG2      VAL  14  -3.802  20.741 -19.877
  113    H    GLY  15           H        GLY  15  -1.144  16.546 -20.288
  114   1HA   GLY  15          2HA       GLY  15   1.400  17.281 -19.109
  115   2HA   GLY  15          1HA       GLY  15   0.800  15.639 -18.989
  116    H    THR  16           H        THR  16   1.403  18.120 -21.397
  117    HA   THR  16           HA       THR  16   2.195  16.189 -23.360
  118    HB   THR  16           HB       THR  16   2.516  19.183 -23.502
  119    HG1  THR  16           1HG      THR  16   0.387  18.857 -24.719
  120   1HG2  THR  16          1HG2      THR  16   2.129  17.089 -25.634
  121   2HG2  THR  16          2HG2      THR  16   3.657  17.860 -25.213
  122   3HG2  THR  16          3HG2      THR  16   2.345  18.818 -25.899
  123    H    LYS  17           H        LYS  17   3.603  18.385 -21.146
  124    HA   LYS  17           HA       LYS  17   6.262  18.383 -22.023
  125   1HB   LYS  17          2HB       LYS  17   5.291  18.759 -19.187
  126   2HB   LYS  17          1HB       LYS  17   6.801  19.341 -19.876
  127   1HG   LYS  17          2HG       LYS  17   4.015  20.287 -20.500
  128   2HG   LYS  17          1HG       LYS  17   5.309  21.185 -19.702
  129   1HD   LYS  17          2HD       LYS  17   6.635  21.051 -21.783
  130   2HD   LYS  17          1HD       LYS  17   5.275  20.231 -22.559
  131   1HE   LYS  17          2HE       LYS  17   3.871  22.185 -22.194
  132   2HE   LYS  17          1HE       LYS  17   5.201  23.003 -21.373
  133   1HZ   LYS  17          1HZ       LYS  17   5.125  22.182 -24.225
  134   2HZ   LYS  17          2HZ       LYS  17   6.476  22.848 -23.453
  135   3HZ   LYS  17          3HZ       LYS  17   5.063  23.768 -23.625
  136    HA   PRO  18           HA       PRO  18   7.141  14.151 -20.830
  137   1HB   PRO  18          2HB       PRO  18   9.788  14.851 -21.914
  138   2HB   PRO  18          1HB       PRO  18   8.679  13.565 -22.400
  139   1HG   PRO  18          2HG       PRO  18   9.062  15.699 -23.947
  140   2HG   PRO  18          1HG       PRO  18   7.458  14.958 -23.778
  141   1HD   PRO  18          2HD       PRO  18   8.560  17.394 -22.409
  142   2HD   PRO  18          1HD       PRO  18   6.975  17.178 -23.187
  143    H    GLY  19           H        GLY  19   8.635  13.139 -19.526
  144   1HA   GLY  19          2HA       GLY  19  10.461  13.163 -17.928
  145   2HA   GLY  19          1HA       GLY  19  10.162  14.885 -17.712
  146    H    THR  20           H        THR  20   7.348  14.494 -17.793
  147    HA   THR  20           HA       THR  20   6.678  14.300 -15.104
  148    HB   THR  20           HB       THR  20   4.850  13.776 -17.454
  149    HG1  THR  20           1HG      THR  20   5.376  15.759 -18.001
  150   1HG2  THR  20          1HG2      THR  20   4.318  14.940 -14.724
  151   2HG2  THR  20          2HG2      THR  20   3.876  13.320 -15.256
  152   3HG2  THR  20          3HG2      THR  20   3.131  14.727 -16.009
  153    H    GLU  21           H        GLU  21   6.738  11.883 -17.652
  154    HA   GLU  21           HA       GLU  21   5.411   9.819 -16.285
  155   1HB   GLU  21          2HB       GLU  21   7.599   9.322 -18.279
  156   2HB   GLU  21          1HB       GLU  21   6.148   8.374 -17.978
  157   1HG   GLU  21          2HG       GLU  21   5.478   9.380 -19.864
  158   2HG   GLU  21          1HG       GLU  21   5.018  10.651 -18.728
  159    H    VAL  22           H        VAL  22   6.007   9.180 -14.437
  160    HA   VAL  22           HA       VAL  22   8.755   9.176 -13.551
  161    HB   VAL  22           HB       VAL  22   6.333   8.071 -12.114
  162   1HG1  VAL  22          1HG1      VAL  22   8.452   7.280 -11.212
  163   2HG1  VAL  22          2HG1      VAL  22   7.682   8.406 -10.092
  164   3HG1  VAL  22          3HG1      VAL  22   9.036   8.939 -11.089
  165   1HG2  VAL  22          1HG2      VAL  22   5.987  10.423 -12.680
  166   2HG2  VAL  22          2HG2      VAL  22   7.540  10.833 -11.949
  167   3HG2  VAL  22          3HG2      VAL  22   6.228  10.214 -10.945
  168    HA   PRO  23           HA       PRO  23   9.484   4.924 -14.935
  169   1HB   PRO  23          2HB       PRO  23  12.022   5.529 -13.533
  170   2HB   PRO  23          1HB       PRO  23  11.761   4.894 -15.162
  171   1HG   PRO  23          2HG       PRO  23  12.552   7.416 -14.749
  172   2HG   PRO  23          1HG       PRO  23  11.451   6.992 -16.072
  173   1HD   PRO  23          2HD       PRO  23  10.873   8.280 -13.451
  174   2HD   PRO  23          1HD       PRO  23  10.149   8.575 -15.041
  175    HA   PRO  24           HA       PRO  24   8.585   2.780 -11.148
  176   1HB   PRO  24          2HB       PRO  24  10.460   0.698 -11.415
  177   2HB   PRO  24          1HB       PRO  24   8.782   0.672 -11.966
  178   1HG   PRO  24          2HG       PRO  24  11.270   1.278 -13.493
  179   2HG   PRO  24          1HG       PRO  24   9.802   0.430 -14.020
  180   1HD   PRO  24          2HD       PRO  24  10.246   2.937 -14.780
  181   2HD   PRO  24          1HD       PRO  24   8.619   2.417 -14.300
  182    H    VAL  25           H        VAL  25   9.388   2.697  -9.127
  183    HA   VAL  25           HA       VAL  25  11.440   4.653  -8.797
  184    HB   VAL  25           HB       VAL  25   9.590   3.353  -6.784
  185   1HG1  VAL  25          1HG1      VAL  25  11.447   5.733  -6.464
  186   2HG1  VAL  25          2HG1      VAL  25  11.681   4.151  -5.724
  187   3HG1  VAL  25          3HG1      VAL  25  10.301   5.144  -5.261
  188   1HG2  VAL  25          1HG2      VAL  25   8.456   4.730  -8.429
  189   2HG2  VAL  25          2HG2      VAL  25   9.573   6.059  -8.127
  190   3HG2  VAL  25          3HG2      VAL  25   8.462   5.537  -6.861
  191    H    ILE  26           H        ILE  26  13.400   4.429  -8.183
  192    HA   ILE  26           HA       ILE  26  14.641   1.900  -8.274
  193    HB   ILE  26           HB       ILE  26  15.855   4.539  -7.461
  194   1HG1  ILE  26          2HG1      ILE  26  14.760   4.718  -9.640
  195   2HG1  ILE  26          1HG1      ILE  26  16.509   4.753  -9.827
  196   1HG2  ILE  26          1HG2      ILE  26  17.139   2.028  -8.525
  197   2HG2  ILE  26          2HG2      ILE  26  17.278   2.662  -6.887
  198   3HG2  ILE  26          3HG2      ILE  26  17.967   3.559  -8.240
  199   1HD1  ILE  26          1HD1      ILE  26  15.412   3.408 -11.548
  200   2HD1  ILE  26          2HD1      ILE  26  14.758   2.352 -10.297
  201   3HD1  ILE  26          3HD1      ILE  26  16.501   2.442 -10.550
  202    H    ASP  27           H        ASP  27  13.648   3.881  -5.594
  203    HA   ASP  27           HA       ASP  27  15.368   2.506  -3.739
  204   1HB   ASP  27          2HB       ASP  27  13.377   4.734  -3.414
  205   2HB   ASP  27          1HB       ASP  27  14.062   3.901  -2.023
  206    H    GLY  28           H        GLY  28  12.734   1.811  -5.330
  207   1HA   GLY  28          2HA       GLY  28  11.109   0.513  -3.415
  208   2HA   GLY  28          1HA       GLY  28  11.158   0.166  -5.141
  209    H    SER  29           H        SER  29  14.232   0.010  -4.272
  210    HA   SER  29           HA       SER  29  14.339  -2.841  -4.076
  211   1HB   SER  29          2HB       SER  29  16.494  -0.820  -3.497
  212   2HB   SER  29          1HB       SER  29  16.726  -2.529  -3.860
  213    HG   SER  29           HG       SER  29  16.113  -0.402  -5.567
  214    H    ILE  30           H        ILE  30  14.627  -0.143  -1.896
  215    HA   ILE  30           HA       ILE  30  15.148  -1.688   0.463
  216    HB   ILE  30           HB       ILE  30  13.722   0.859   0.919
  217   1HG1  ILE  30          2HG1      ILE  30  14.927   1.476  -1.171
  218   2HG1  ILE  30          1HG1      ILE  30  15.531   2.342   0.232
  219   1HG2  ILE  30          1HG2      ILE  30  14.839  -0.330   2.676
  220   2HG2  ILE  30          2HG2      ILE  30  15.579   1.252   2.437
  221   3HG2  ILE  30          3HG2      ILE  30  16.379  -0.196   1.828
  222   1HD1  ILE  30          1HD1      ILE  30  16.839  -0.049  -1.039
  223   2HD1  ILE  30          2HD1      ILE  30  17.458   0.871   0.334
  224   3HD1  ILE  30          3HD1      ILE  30  17.322   1.632  -1.254
  225    H    TRP  31           H        TRP  31  12.424  -0.408  -1.254
  226    HA   TRP  31           HA       TRP  31  10.462  -0.956   0.719
  227   1HB   TRP  31          2HB       TRP  31  10.211  -0.438  -2.253
  228   2HB   TRP  31          1HB       TRP  31   8.860  -0.486  -1.123
  229    HD1  TRP  31           HD       TRP  31  10.750   2.025  -2.789
  230    HE1  TRP  31           1HE      TRP  31  10.847   4.239  -1.452
  231    HE3  TRP  31           3HE      TRP  31   9.379   0.258   1.746
  232    HZ2  TRP  31           2HZ      TRP  31  10.417   5.083   1.167
  233    HZ3  TRP  31           3HZ      TRP  31   9.268   1.812   3.645
  234    HH2  TRP  31           HH       TRP  31   9.782   4.177   3.357
  235    H    ASP  32           H        ASP  32  11.745  -2.717  -2.035
  236    HA   ASP  32           HA       ASP  32   9.803  -4.802  -1.877
  237   1HB   ASP  32          2HB       ASP  32  10.808  -4.388  -4.000
  238   2HB   ASP  32          1HB       ASP  32  12.437  -4.542  -3.328
  239    H    ALA  33           H        ALA  33  13.054  -4.260  -0.580
  240    HA   ALA  33           HA       ALA  33  13.297  -6.869   0.483
  241   1HB   ALA  33          1HB       ALA  33  14.652  -4.322   1.345
  242   2HB   ALA  33          2HB       ALA  33  15.245  -5.448   0.127
  243   3HB   ALA  33          3HB       ALA  33  15.129  -5.953   1.813
  244    H    ILE  34           H        ILE  34  11.982  -3.818   1.677
  245    HA   ILE  34           HA       ILE  34  11.309  -4.699   4.280
  246    HB   ILE  34           HB       ILE  34  10.034  -2.637   2.496
  247   1HG1  ILE  34          2HG1      ILE  34  11.870  -2.399   4.895
  248   2HG1  ILE  34          1HG1      ILE  34  12.329  -2.143   3.215
  249   1HG2  ILE  34          1HG2      ILE  34   8.882  -1.793   4.505
  250   2HG2  ILE  34          2HG2      ILE  34   9.476  -3.183   5.412
  251   3HG2  ILE  34          3HG2      ILE  34   8.357  -3.420   4.069
  252   1HD1  ILE  34          1HD1      ILE  34  10.848  -0.223   3.090
  253   2HD1  ILE  34          2HD1      ILE  34  12.020  -0.043   4.397
  254   3HD1  ILE  34          3HD1      ILE  34  10.353  -0.489   4.762
  255    H    ALA  35           H        ALA  35   9.544  -4.749   1.210
  256    HA   ALA  35           HA       ALA  35   7.199  -5.987   2.057
  257   1HB   ALA  35          1HB       ALA  35   7.493  -5.079  -0.188
  258   2HB   ALA  35          2HB       ALA  35   6.974  -6.763  -0.253
  259   3HB   ALA  35          3HB       ALA  35   8.661  -6.348  -0.557
  260    H    GLY  36           H        GLY  36  10.346  -7.287   1.257
  261   1HA   GLY  36          2HA       GLY  36   9.562 -10.044   1.442
  262   2HA   GLY  36          1HA       GLY  36  11.210  -9.429   1.403
  263    H    CYS  37           H        CYS  37  10.142  -7.645   3.738
  264    HA   CYS  37           HA       CYS  37  11.000  -9.503   5.805
  265   1HB   CYS  37          2HB       CYS  37  12.179  -7.403   5.751
  266   2HB   CYS  37          1HB       CYS  37  10.666  -6.504   5.790
  267    H    GLU  38           H        GLU  38   8.410  -7.082   5.382
  268    HA   GLU  38           HA       GLU  38   7.130  -8.127   7.775
  269   1HB   GLU  38          2HB       GLU  38   7.428  -5.648   7.308
  270   2HB   GLU  38          1HB       GLU  38   6.213  -5.825   6.050
  271   1HG   GLU  38          2HG       GLU  38   5.203  -4.963   8.053
  272   2HG   GLU  38          1HG       GLU  38   4.602  -6.590   7.737
  273    H    ALA  39           H        ALA  39   6.664  -7.957   4.314
  274    HA   ALA  39           HA       ALA  39   4.022  -9.106   4.548
  275   1HB   ALA  39          1HB       ALA  39   3.827  -8.757   2.149
  276   2HB   ALA  39          2HB       ALA  39   5.511  -8.232   2.093
  277   3HB   ALA  39          3HB       ALA  39   4.318  -7.278   2.975
  278    H    GLY  40           H        GLY  40   7.203 -10.126   4.133
  279   1HA   GLY  40          2HA       GLY  40   8.003 -12.316   3.954
  280   2HA   GLY  40          1HA       GLY  40   6.361 -12.857   3.609
  281    H    GLY  41           H        GLY  41   7.008 -10.185   1.856
  282   1HA   GLY  41          2HA       GLY  41   7.841  -9.781  -0.249
  283   2HA   GLY  41          1HA       GLY  41   8.265 -11.486  -0.414
  284    H    ASN  42           H        ASN  42   5.316  -9.539   0.083
  285    HA   ASN  42           HA       ASN  42   4.192 -10.558  -2.363
  286   1HB   ASN  42          2HB       ASN  42   3.569 -12.244  -0.553
  287   2HB   ASN  42          1HB       ASN  42   2.638 -10.941   0.191
  288   1HD2  ASN  42          1HD2      ASN  42   0.724 -12.108  -0.129
  289   2HD2  ASN  42          2HD2      ASN  42  -0.020 -12.219  -1.687
  290    H    TRP  43           H        TRP  43   3.088  -9.000  -3.278
  291    HA   TRP  43           HA       TRP  43   2.734  -6.540  -1.729
  292   1HB   TRP  43          2HB       TRP  43   2.739  -7.031  -4.699
  293   2HB   TRP  43          1HB       TRP  43   2.644  -5.454  -3.923
  294    HD1  TRP  43           HD       TRP  43   5.079  -8.472  -4.013
  295    HE1  TRP  43           1HE      TRP  43   7.473  -7.564  -3.913
  296    HE3  TRP  43           3HE      TRP  43   4.032  -3.505  -3.540
  297    HZ2  TRP  43           2HZ      TRP  43   8.769  -5.042  -3.677
  298    HZ3  TRP  43           3HZ      TRP  43   5.873  -1.897  -3.400
  299    HH2  TRP  43           HH       TRP  43   8.213  -2.681  -3.489
  300    H    ALA  44           H        ALA  44   1.030  -9.098  -2.967
  301    HA   ALA  44           HA       ALA  44  -1.481  -7.592  -3.218
  302   1HB   ALA  44          1HB       ALA  44  -0.846  -9.056  -5.102
  303   2HB   ALA  44          2HB       ALA  44  -2.374  -9.525  -4.362
  304   3HB   ALA  44          3HB       ALA  44  -0.910 -10.445  -4.018
  305    H    ILE  45           H        ILE  45   0.160  -8.940  -0.831
  306    HA   ILE  45           HA       ILE  45  -1.700 -10.725   0.334
  307    HB   ILE  45           HB       ILE  45   0.838 -10.641   0.702
  308   1HG1  ILE  45          2HG1      ILE  45  -1.005 -10.768   3.088
  309   2HG1  ILE  45          1HG1      ILE  45  -0.683 -12.076   1.958
  310   1HG2  ILE  45          1HG2      ILE  45   1.068  -8.285   1.218
  311   2HG2  ILE  45          2HG2      ILE  45   1.611  -9.264   2.580
  312   3HG2  ILE  45          3HG2      ILE  45   0.036  -8.472   2.636
  313   1HD1  ILE  45          1HD1      ILE  45   1.658 -12.102   2.669
  314   2HD1  ILE  45          2HD1      ILE  45   0.554 -12.391   4.014
  315   3HD1  ILE  45          3HD1      ILE  45   1.314 -10.811   3.821
  316    H    ASN  46           H        ASN  46  -3.149 -10.337   1.943
  317    HA   ASN  46           HA       ASN  46  -3.360  -7.720   3.164
  318   1HB   ASN  46          2HB       ASN  46  -4.562  -7.559   0.929
  319   2HB   ASN  46          1HB       ASN  46  -5.703  -8.748   1.553
  320   1HD2  ASN  46          1HD2      ASN  46  -5.922  -5.878   0.755
  321   2HD2  ASN  46          2HD2      ASN  46  -6.685  -5.102   2.103
  322    H    THR  47           H        THR  47  -3.247  -8.549   5.150
  323    HA   THR  47           HA       THR  47  -4.526 -10.988   5.883
  324    HB   THR  47           HB       THR  47  -3.770 -10.355   8.202
  325    HG1  THR  47           1HG      THR  47  -2.143  -8.502   7.991
  326   1HG2  THR  47          1HG2      THR  47  -2.353 -11.704   6.737
  327   2HG2  THR  47          2HG2      THR  47  -1.373 -10.602   7.704
  328   3HG2  THR  47          3HG2      THR  47  -1.695 -10.239   6.008
  329    H    GLY  48           H        GLY  48  -5.524  -7.741   5.687
  330   1HA   GLY  48          2HA       GLY  48  -7.779  -7.081   5.856
  331   2HA   GLY  48          1HA       GLY  48  -8.071  -8.438   6.936
  332    H    ASN  49           H        ASN  49  -5.258  -6.553   7.454
  333    HA   ASN  49           HA       ASN  49  -6.391  -5.675   9.991
  334   1HB   ASN  49          2HB       ASN  49  -4.078  -5.307  10.695
  335   2HB   ASN  49          1HB       ASN  49  -4.279  -6.931  10.049
  336   1HD2  ASN  49          1HD2      ASN  49  -1.856  -5.452  10.328
  337   2HD2  ASN  49          2HD2      ASN  49  -1.188  -5.282   8.738
  338    H    GLY  50           H        GLY  50  -6.213  -4.414   7.026
  339   1HA   GLY  50          2HA       GLY  50  -6.915  -2.213   6.519
  340   2HA   GLY  50          1HA       GLY  50  -6.258  -1.680   8.061
  341    H    TYR  51           H        TYR  51  -3.903  -3.546   7.150
  342    HA   TYR  51           HA       TYR  51  -2.534  -1.451   5.630
  343   1HB   TYR  51          2HB       TYR  51  -1.084  -3.692   7.025
  344   2HB   TYR  51          1HB       TYR  51  -0.475  -2.125   6.540
  345    HD1  TYR  51           1HD      TYR  51  -3.316  -1.030   7.931
  346    HD2  TYR  51           2HD      TYR  51   0.208  -3.106   9.126
  347    HE1  TYR  51           1HE      TYR  51  -3.610  -0.217  10.244
  348    HE2  TYR  51           2HE      TYR  51  -0.086  -2.305  11.427
  349    HH   TYR  51           HH       TYR  51  -1.155  -0.543  12.636
  350    H    TYR  52           H        TYR  52  -1.666  -1.966   3.700
  351    HA   TYR  52           HA       TYR  52  -2.743  -4.487   2.680
  352   1HB   TYR  52          2HB       TYR  52  -2.109  -1.964   1.165
  353   2HB   TYR  52          1HB       TYR  52  -2.938  -3.387   0.530
  354    HD1  TYR  52           1HD      TYR  52  -3.499  -0.193   1.581
  355    HD2  TYR  52           2HD      TYR  52  -4.934  -4.124   2.301
  356    HE1  TYR  52           1HE      TYR  52  -5.622   0.732   2.395
  357    HE2  TYR  52           2HE      TYR  52  -7.075  -3.217   3.083
  358    HH   TYR  52           HH       TYR  52  -7.886  -1.001   4.096
  359    H    GLY  53           H        GLY  53  -1.616  -5.194   0.578
  360   1HA   GLY  53          2HA       GLY  53   0.688  -6.418   1.529
  361   2HA   GLY  53          1HA       GLY  53   0.120  -6.475  -0.126
  362    H    GLY  54           H        GLY  54   2.684  -6.666   0.183
  363   1HA   GLY  54          2HA       GLY  54   4.523  -5.773  -0.884
  364   2HA   GLY  54          1HA       GLY  54   3.643  -4.266  -1.102
  365    H    VAL  55           H        VAL  55   3.877  -2.630   0.362
  366    HA   VAL  55           HA       VAL  55   6.184  -2.856   2.112
  367    HB   VAL  55           HB       VAL  55   4.528  -0.374   1.944
  368   1HG1  VAL  55          1HG1      VAL  55   6.498  -0.561   3.434
  369   2HG1  VAL  55          2HG1      VAL  55   6.649   0.717   2.229
  370   3HG1  VAL  55          3HG1      VAL  55   7.508  -0.809   2.013
  371   1HG2  VAL  55          1HG2      VAL  55   4.702  -1.079  -0.382
  372   2HG2  VAL  55          2HG2      VAL  55   6.441  -1.304  -0.200
  373   3HG2  VAL  55          3HG2      VAL  55   5.745   0.312  -0.085
  374    H    GLN  56           H        GLN  56   2.968  -3.411   2.333
  375    HA   GLN  56           HA       GLN  56   1.562  -3.991   3.977
  376   1HB   GLN  56          2HB       GLN  56   3.527  -5.451   4.469
  377   2HB   GLN  56          1HB       GLN  56   4.058  -4.265   5.653
  378   1HG   GLN  56          2HG       GLN  56   2.967  -5.949   6.864
  379   2HG   GLN  56          1HG       GLN  56   1.846  -4.595   6.804
  380   1HE2  GLN  56          1HE2      GLN  56   1.052  -5.167   4.027
  381   2HE2  GLN  56          2HE2      GLN  56   0.030  -6.554   4.120
  382    H    PHE  57           H        PHE  57   1.490  -1.323   3.709
  383    HA   PHE  57           HA       PHE  57   1.258  -0.526   6.512
  384   1HB   PHE  57          2HB       PHE  57   1.796   1.782   5.976
  385   2HB   PHE  57          1HB       PHE  57   3.117   0.688   5.613
  386    HD1  PHE  57           1HD      PHE  57   3.058  -0.147   3.016
  387    HD2  PHE  57           2HD      PHE  57   1.425   3.481   4.534
  388    HE1  PHE  57           1HE      PHE  57   3.326   0.896   0.805
  389    HE2  PHE  57           2HE      PHE  57   1.682   4.524   2.322
  390    HZ   PHE  57           HZ       PHE  57   2.649   3.239   0.456
  391    H    ASP  58           H        ASP  58  -0.173   1.477   6.711
  392    HA   ASP  58           HA       ASP  58  -2.691   0.217   6.234
  393   1HB   ASP  58          2HB       ASP  58  -2.868   0.956   8.323
  394   2HB   ASP  58          1HB       ASP  58  -1.511   2.039   8.105
  395    H    GLN  59           H        GLN  59  -4.532   1.078   5.504
  396    HA   GLN  59           HA       GLN  59  -4.665   2.333   3.084
  397   1HB   GLN  59          2HB       GLN  59  -6.480   1.057   3.922
  398   2HB   GLN  59          1HB       GLN  59  -6.594   2.034   5.370
  399   1HG   GLN  59          2HG       GLN  59  -8.434   2.627   4.075
  400   2HG   GLN  59          1HG       GLN  59  -7.284   3.942   3.871
  401   1HE2  GLN  59          1HE2      GLN  59  -5.605   2.576   1.967
  402   2HE2  GLN  59          2HE2      GLN  59  -6.496   2.428   0.488
  403    H    GLY  60           H        GLY  60  -4.864   3.737   6.283
  404   1HA   GLY  60          2HA       GLY  60  -5.752   6.316   5.460
  405   2HA   GLY  60          1HA       GLY  60  -5.064   5.910   7.027
  406    H    THR  61           H        THR  61  -2.578   5.108   6.475
  407    HA   THR  61           HA       THR  61  -1.145   7.471   5.929
  408    HB   THR  61           HB       THR  61  -0.215   4.629   5.971
  409    HG1  THR  61           1HG      THR  61  -1.143   5.209   7.933
  410   1HG2  THR  61          1HG2      THR  61   1.364   7.182   6.284
  411   2HG2  THR  61          2HG2      THR  61   1.435   6.092   4.900
  412   3HG2  THR  61          3HG2      THR  61   2.005   5.553   6.478
  413    H    TRP  62           H        TRP  62  -1.809   4.600   4.001
  414    HA   TRP  62           HA       TRP  62  -0.405   5.215   1.677
  415   1HB   TRP  62          2HB       TRP  62  -1.464   3.064   2.057
  416   2HB   TRP  62          1HB       TRP  62  -3.048   3.827   2.130
  417    HD1  TRP  62           HD       TRP  62  -4.185   4.513  -0.204
  418    HE1  TRP  62           1HE      TRP  62  -3.750   3.732  -2.614
  419    HE3  TRP  62           3HE      TRP  62   0.391   2.332   0.460
  420    HZ2  TRP  62           2HZ      TRP  62  -1.728   2.361  -4.076
  421    HZ3  TRP  62           3HZ      TRP  62   1.514   1.314  -1.470
  422    HH2  TRP  62           HH       TRP  62   0.501   1.313  -3.685
  423    H    GLU  63           H        GLU  63  -3.689   6.002   2.670
  424    HA   GLU  63           HA       GLU  63  -4.425   7.460   0.388
  425   1HB   GLU  63          2HB       GLU  63  -6.040   6.555   1.974
  426   2HB   GLU  63          1HB       GLU  63  -5.427   7.610   3.238
  427   1HG   GLU  63          2HG       GLU  63  -6.094   9.529   1.664
  428   2HG   GLU  63          1HG       GLU  63  -7.052   8.306   0.828
  429    H    ALA  64           H        ALA  64  -2.868   8.330   3.400
  430    HA   ALA  64           HA       ALA  64  -3.129  11.148   3.155
  431   1HB   ALA  64          1HB       ALA  64  -1.447  11.273   4.925
  432   2HB   ALA  64          2HB       ALA  64  -1.097   9.557   4.723
  433   3HB   ALA  64          3HB       ALA  64  -2.680  10.071   5.304
  434    H    ASN  65           H        ASN  65  -0.686   8.828   2.165
  435    HA   ASN  65           HA       ASN  65   1.081  10.817   1.095
  436   1HB   ASN  65          2HB       ASN  65   0.974   7.839   0.567
  437   2HB   ASN  65          1HB       ASN  65   2.308   8.910   0.167
  438   1HD2  ASN  65          1HD2      ASN  65   1.917  10.415   2.708
  439   2HD2  ASN  65          2HD2      ASN  65   2.587   9.402   3.940
  440    H    GLY  66           H        GLY  66  -1.806   9.402   0.109
  441   1HA   GLY  66          2HA       GLY  66  -3.087  10.096  -1.714
  442   2HA   GLY  66          1HA       GLY  66  -1.638  10.775  -2.450
  443    H    GLY  67           H        GLY  67  -2.372   7.494  -1.271
  444   1HA   GLY  67          2HA       GLY  67  -0.948   6.414  -3.527
  445   2HA   GLY  67          1HA       GLY  67  -1.673   5.506  -2.209
  446    H    LEU  68           H        LEU  68  -4.217   7.096  -2.775
  447    HA   LEU  68           HA       LEU  68  -5.502   5.043  -4.085
  448   1HB   LEU  68          2HB       LEU  68  -6.324   7.835  -3.434
  449   2HB   LEU  68          1HB       LEU  68  -7.420   6.722  -4.229
  450    HG   LEU  68           HG       LEU  68  -6.940   5.169  -2.238
  451   1HD1  LEU  68          1HD1      LEU  68  -6.379   6.320  -0.161
  452   2HD1  LEU  68          2HD1      LEU  68  -6.033   7.783  -1.082
  453   3HD1  LEU  68          3HD1      LEU  68  -5.056   6.336  -1.324
  454   1HD2  LEU  68          1HD2      LEU  68  -8.704   6.220  -0.912
  455   2HD2  LEU  68          2HD2      LEU  68  -9.091   6.242  -2.632
  456   3HD2  LEU  68          3HD2      LEU  68  -8.514   7.707  -1.840
  457    H    ARG  69           H        ARG  69  -3.919   7.808  -5.390
  458    HA   ARG  69           HA       ARG  69  -5.205   7.797  -7.919
  459   1HB   ARG  69          2HB       ARG  69  -3.294   9.112  -8.692
  460   2HB   ARG  69          1HB       ARG  69  -3.899   9.727  -7.158
  461   1HG   ARG  69          2HG       ARG  69  -2.080   8.936  -5.975
  462   2HG   ARG  69          1HG       ARG  69  -1.653   7.765  -7.225
  463   1HD   ARG  69          2HD       ARG  69  -0.058   9.563  -7.234
  464   2HD   ARG  69          1HD       ARG  69  -1.022   9.636  -8.707
  465    HE   ARG  69           HE       ARG  69  -2.097  11.305  -6.646
  466   1HH1  ARG  69          1HH1      ARG  69   0.342  11.122  -9.171
  467   2HH1  ARG  69          2HH1      ARG  69   0.516  12.846  -9.297
  468   1HH2  ARG  69          1HH2      ARG  69  -1.889  13.581  -6.854
  469   2HH2  ARG  69          2HH2      ARG  69  -0.743  14.242  -7.982
  470    H    TYR  70           H        TYR  70  -2.550   6.039  -6.464
  471    HA   TYR  70           HA       TYR  70  -1.676   4.820  -8.939
  472   1HB   TYR  70          2HB       TYR  70  -1.138   4.108  -6.047
  473   2HB   TYR  70          1HB       TYR  70  -0.220   3.533  -7.433
  474    HD1  TYR  70           1HD      TYR  70   1.284   5.127  -8.637
  475    HD2  TYR  70           2HD      TYR  70  -0.757   6.187  -5.067
  476    HE1  TYR  70           1HE      TYR  70   2.822   7.021  -8.329
  477    HE2  TYR  70           2HE      TYR  70   0.762   8.077  -4.749
  478    HH   TYR  70           HH       TYR  70   3.016   8.766  -5.419
  479    H    ALA  71           H        ALA  71  -3.642   4.289  -6.190
  480    HA   ALA  71           HA       ALA  71  -5.600   2.669  -7.111
  481   1HB   ALA  71          1HB       ALA  71  -3.377   0.943  -5.983
  482   2HB   ALA  71          2HB       ALA  71  -3.949   0.920  -7.653
  483   3HB   ALA  71          3HB       ALA  71  -5.015   0.400  -6.348
  484    HA   PRO  72           HA       PRO  72  -6.635   4.148  -3.086
  485   1HB   PRO  72          2HB       PRO  72  -8.798   2.222  -3.091
  486   2HB   PRO  72          1HB       PRO  72  -8.845   3.974  -3.012
  487   1HG   PRO  72          2HG       PRO  72  -9.553   2.522  -5.215
  488   2HG   PRO  72          1HG       PRO  72  -8.992   4.204  -5.263
  489   1HD   PRO  72          2HD       PRO  72  -7.610   1.735  -6.072
  490   2HD   PRO  72          1HD       PRO  72  -7.325   3.417  -6.565
  491    H    ARG  73           H        ARG  73  -5.623   1.030  -3.731
  492    HA   ARG  73           HA       ARG  73  -4.984   0.639  -0.922
  493   1HB   ARG  73          2HB       ARG  73  -5.834  -1.629  -0.835
  494   2HB   ARG  73          1HB       ARG  73  -7.152  -0.556  -1.302
  495   1HG   ARG  73          2HG       ARG  73  -6.547  -1.163  -3.700
  496   2HG   ARG  73          1HG       ARG  73  -5.605  -2.475  -2.992
  497   1HD   ARG  73          2HD       ARG  73  -8.537  -2.020  -2.464
  498   2HD   ARG  73          1HD       ARG  73  -7.919  -3.100  -3.710
  499    HE   ARG  73           HE       ARG  73  -6.699  -3.901  -1.374
  500   1HH1  ARG  73          1HH1      ARG  73  -9.986  -3.608  -2.586
  501   2HH1  ARG  73          2HH1      ARG  73 -10.598  -4.887  -1.581
  502   1HH2  ARG  73          1HH2      ARG  73  -7.523  -5.590  -0.073
  503   2HH2  ARG  73          2HH2      ARG  73  -9.208  -6.001  -0.137
  504    H    ALA  74           H        ALA  74  -3.080  -0.432  -0.659
  505    HA   ALA  74           HA       ALA  74  -1.206  -0.320  -2.706
  506   1HB   ALA  74          1HB       ALA  74   0.361  -1.154  -1.194
  507   2HB   ALA  74          2HB       ALA  74  -0.840  -2.089  -0.318
  508   3HB   ALA  74          3HB       ALA  74  -0.819  -0.331  -0.174
  509    H    ASP  75           H        ASP  75  -3.292  -2.963  -1.743
  510    HA   ASP  75           HA       ASP  75  -1.652  -4.884  -3.152
  511   1HB   ASP  75          2HB       ASP  75  -3.173  -6.571  -2.357
  512   2HB   ASP  75          1HB       ASP  75  -2.735  -5.510  -1.028
  513    H    LEU  76           H        LEU  76  -3.510  -2.607  -4.253
  514    HA   LEU  76           HA       LEU  76  -4.553  -4.224  -6.481
  515   1HB   LEU  76          2HB       LEU  76  -6.227  -2.856  -5.275
  516   2HB   LEU  76          1HB       LEU  76  -5.299  -1.417  -5.655
  517    HG   LEU  76           HG       LEU  76  -5.687  -1.848  -8.066
  518   1HD1  LEU  76          1HD1      LEU  76  -7.402  -3.461  -8.721
  519   2HD1  LEU  76          2HD1      LEU  76  -7.522  -4.014  -7.050
  520   3HD1  LEU  76          3HD1      LEU  76  -6.027  -4.256  -7.953
  521   1HD2  LEU  76          1HD2      LEU  76  -8.181  -1.635  -6.380
  522   2HD2  LEU  76          2HD2      LEU  76  -8.021  -1.137  -8.067
  523   3HD2  LEU  76          3HD2      LEU  76  -7.105  -0.304  -6.809
  524    H    ALA  77           H        ALA  77  -2.629  -1.481  -5.515
  525    HA   ALA  77           HA       ALA  77  -1.666  -0.851  -8.139
  526   1HB   ALA  77          1HB       ALA  77  -1.796   0.839  -6.360
  527   2HB   ALA  77          2HB       ALA  77  -0.144   0.644  -6.949
  528   3HB   ALA  77          3HB       ALA  77  -0.624  -0.077  -5.411
  529    H    THR  78           H        THR  78   0.744  -1.004  -8.585
  530    HA   THR  78           HA       THR  78   1.644  -3.643  -7.686
  531    HB   THR  78           HB       THR  78   2.990  -3.792  -9.642
  532    HG1  THR  78           1HG      THR  78   2.370  -1.021 -10.045
  533   1HG2  THR  78          1HG2      THR  78   1.317  -3.370 -11.440
  534   2HG2  THR  78          2HG2      THR  78   0.334  -2.506 -10.252
  535   3HG2  THR  78          3HG2      THR  78   0.658  -4.228 -10.045
  536    H    ARG  79           H        ARG  79   4.283  -3.599  -7.998
  537    HA   ARG  79           HA       ARG  79   5.214  -2.682  -5.599
  538   1HB   ARG  79          2HB       ARG  79   6.852  -2.975  -8.116
  539   2HB   ARG  79          1HB       ARG  79   7.469  -2.989  -6.471
  540   1HG   ARG  79          2HG       ARG  79   6.258  -5.038  -6.016
  541   2HG   ARG  79          1HG       ARG  79   5.591  -5.017  -7.652
  542   1HD   ARG  79          2HD       ARG  79   7.372  -6.151  -8.325
  543   2HD   ARG  79          1HD       ARG  79   8.352  -4.732  -7.957
  544    HE   ARG  79           HE       ARG  79   8.645  -5.700  -5.697
  545   1HH1  ARG  79          1HH1      ARG  79   7.666  -7.739  -8.378
  546   2HH1  ARG  79          2HH1      ARG  79   8.398  -9.178  -7.732
  547   1HH2  ARG  79          1HH2      ARG  79   9.680  -7.607  -4.867
  548   2HH2  ARG  79          2HH2      ARG  79   9.567  -9.100  -5.759
  549    H    GLU  80           H        GLU  80   5.634  -1.121  -8.757
  550    HA   GLU  80           HA       GLU  80   7.226   0.979  -7.837
  551   1HB   GLU  80          2HB       GLU  80   6.616   2.101  -9.972
  552   2HB   GLU  80          1HB       GLU  80   7.162   0.441 -10.155
  553   1HG   GLU  80          2HG       GLU  80   4.795  -0.263 -10.310
  554   2HG   GLU  80          1HG       GLU  80   4.335   1.439 -10.297
  555    H    GLU  81           H        GLU  81   3.691   0.880  -8.242
  556    HA   GLU  81           HA       GLU  81   3.120   3.469  -7.335
  557   1HB   GLU  81          2HB       GLU  81   1.583   0.889  -7.197
  558   2HB   GLU  81          1HB       GLU  81   0.930   2.400  -6.594
  559   1HG   GLU  81          2HG       GLU  81   0.046   2.054  -8.716
  560   2HG   GLU  81          1HG       GLU  81   1.225   3.342  -8.882
  561    H    GLN  82           H        GLN  82   3.164   0.387  -5.565
  562    HA   GLN  82           HA       GLN  82   2.420   1.407  -3.063
  563   1HB   GLN  82          2HB       GLN  82   4.082  -1.033  -3.734
  564   2HB   GLN  82          1HB       GLN  82   3.332  -0.720  -2.173
  565   1HG   GLN  82          2HG       GLN  82   1.169  -0.979  -3.033
  566   2HG   GLN  82          1HG       GLN  82   1.726  -0.846  -4.699
  567   1HE2  GLN  82          1HE2      GLN  82   1.463  -2.931  -1.927
  568   2HE2  GLN  82          2HE2      GLN  82   1.801  -4.394  -2.774
  569    H    ILE  83           H        ILE  83   5.517   0.907  -4.553
  570    HA   ILE  83           HA       ILE  83   7.214   1.744  -2.505
  571    HB   ILE  83           HB       ILE  83   7.399   1.741  -5.505
  572   1HG1  ILE  83          2HG1      ILE  83   9.145   0.261  -3.563
  573   2HG1  ILE  83          1HG1      ILE  83   7.545  -0.351  -3.959
  574   1HG2  ILE  83          1HG2      ILE  83   9.382   2.840  -3.555
  575   2HG2  ILE  83          2HG2      ILE  83   8.747   3.581  -5.021
  576   3HG2  ILE  83          3HG2      ILE  83   9.868   2.223  -5.132
  577   1HD1  ILE  83          1HD1      ILE  83   9.268  -1.403  -5.314
  578   2HD1  ILE  83          2HD1      ILE  83   9.767   0.177  -5.920
  579   3HD1  ILE  83          3HD1      ILE  83   8.169  -0.455  -6.314
  580    H    ALA  84           H        ALA  84   5.693   3.599  -5.142
  581    HA   ALA  84           HA       ALA  84   6.941   6.055  -4.566
  582   1HB   ALA  84          1HB       ALA  84   5.881   5.559  -6.718
  583   2HB   ALA  84          2HB       ALA  84   5.272   7.060  -6.021
  584   3HB   ALA  84          3HB       ALA  84   4.298   5.593  -5.942
  585    H    VAL  85           H        VAL  85   3.851   4.715  -3.490
  586    HA   VAL  85           HA       VAL  85   2.971   6.965  -2.039
  587    HB   VAL  85           HB       VAL  85   2.467   4.049  -1.476
  588   1HG1  VAL  85          1HG1      VAL  85   1.855   5.477   0.405
  589   2HG1  VAL  85          2HG1      VAL  85   0.411   4.838  -0.383
  590   3HG1  VAL  85          3HG1      VAL  85   0.909   6.507  -0.669
  591   1HG2  VAL  85          1HG2      VAL  85   0.930   6.004  -3.175
  592   2HG2  VAL  85          2HG2      VAL  85   0.427   4.356  -2.799
  593   3HG2  VAL  85          3HG2      VAL  85   1.882   4.639  -3.757
  594    H    ALA  86           H        ALA  86   4.763   4.067  -0.994
  595    HA   ALA  86           HA       ALA  86   5.279   4.839   1.635
  596   1HB   ALA  86          1HB       ALA  86   7.113   3.231   1.566
  597   2HB   ALA  86          2HB       ALA  86   7.011   3.174  -0.193
  598   3HB   ALA  86          3HB       ALA  86   5.673   2.574   0.788
  599    H    GLU  87           H        GLU  87   6.727   5.727  -1.382
  600    HA   GLU  87           HA       GLU  87   9.134   6.861  -0.498
  601   1HB   GLU  87          2HB       GLU  87   7.371   7.455  -2.863
  602   2HB   GLU  87          1HB       GLU  87   8.813   8.406  -2.557
  603   1HG   GLU  87          2HG       GLU  87   8.821   5.420  -2.896
  604   2HG   GLU  87          1HG       GLU  87   9.071   6.564  -4.213
  605    H    VAL  88           H        VAL  88   5.886   8.298  -0.793
  606    HA   VAL  88           HA       VAL  88   6.674  10.948  -0.273
  607    HB   VAL  88           HB       VAL  88   4.033   9.601   0.302
  608   1HG1  VAL  88          1HG1      VAL  88   3.086  11.848   0.454
  609   2HG1  VAL  88          2HG1      VAL  88   4.691  12.546   0.240
  610   3HG1  VAL  88          3HG1      VAL  88   4.326  11.602   1.691
  611   1HG2  VAL  88          1HG2      VAL  88   4.667   9.615  -2.065
  612   2HG2  VAL  88          2HG2      VAL  88   4.902  11.361  -1.988
  613   3HG2  VAL  88          3HG2      VAL  88   3.293  10.679  -1.759
  614    H    THR  89           H        THR  89   5.438   8.426   1.899
  615    HA   THR  89           HA       THR  89   5.637  10.155   4.141
  616    HB   THR  89           HB       THR  89   3.931   8.417   4.078
  617    HG1  THR  89           1HG      THR  89   4.540   7.505   6.254
  618   1HG2  THR  89          1HG2      THR  89   5.643   6.699   3.089
  619   2HG2  THR  89          2HG2      THR  89   4.292   6.172   4.094
  620   3HG2  THR  89          3HG2      THR  89   5.900   6.330   4.800
  621    H    ARG  90           H        ARG  90   7.780   7.693   2.744
  622    HA   ARG  90           HA       ARG  90   9.616   7.586   4.876
  623   1HB   ARG  90          2HB       ARG  90  11.121   6.520   3.474
  624   2HB   ARG  90          1HB       ARG  90   9.597   6.172   2.675
  625   1HG   ARG  90          2HG       ARG  90  10.107   7.401   0.866
  626   2HG   ARG  90          1HG       ARG  90  11.007   8.603   1.792
  627   1HD   ARG  90          2HD       ARG  90  12.936   7.290   1.849
  628   2HD   ARG  90          1HD       ARG  90  12.055   5.821   1.428
  629    HE   ARG  90           HE       ARG  90  11.758   6.818  -0.818
  630   1HH1  ARG  90          1HH1      ARG  90  14.407   7.906   1.216
  631   2HH1  ARG  90          2HH1      ARG  90  15.395   8.384  -0.132
  632   1HH2  ARG  90          1HH2      ARG  90  13.007   7.470  -2.559
  633   2HH2  ARG  90          2HH2      ARG  90  14.597   8.123  -2.298
  634    H    LEU  91           H        LEU  91   9.151   9.948   2.364
  635    HA   LEU  91           HA       LEU  91  11.540  11.432   2.724
  636   1HB   LEU  91          2HB       LEU  91   8.898  12.738   2.138
  637   2HB   LEU  91          1HB       LEU  91  10.495  13.245   1.628
  638    HG   LEU  91           HG       LEU  91   9.005  10.836   0.637
  639   1HD1  LEU  91          1HD1      LEU  91   8.865  12.094  -1.478
  640   2HD1  LEU  91          2HD1      LEU  91   9.590  13.490  -0.678
  641   3HD1  LEU  91          3HD1      LEU  91   8.011  12.898  -0.159
  642   1HD2  LEU  91          1HD2      LEU  91  11.418  10.475   0.620
  643   2HD2  LEU  91          2HD2      LEU  91  11.658  11.998  -0.238
  644   3HD2  LEU  91          3HD2      LEU  91  10.809  10.665  -1.024
  645    H    ARG  92           H        ARG  92   8.578  11.245   4.484
  646    HA   ARG  92           HA       ARG  92   9.031  13.706   5.930
  647   1HB   ARG  92          2HB       ARG  92   6.899  11.742   6.608
  648   2HB   ARG  92          1HB       ARG  92   6.882  13.494   6.763
  649   1HG   ARG  92          2HG       ARG  92   6.510  13.806   4.472
  650   2HG   ARG  92          1HG       ARG  92   6.977  12.142   4.095
  651   1HD   ARG  92          2HD       ARG  92   4.442  13.187   5.247
  652   2HD   ARG  92          1HD       ARG  92   4.702  11.952   4.004
  653    HE   ARG  92           HE       ARG  92   5.729  10.720   6.092
  654   1HH1  ARG  92          1HH1      ARG  92   2.740  12.561   5.880
  655   2HH1  ARG  92          2HH1      ARG  92   1.971  11.677   7.168
  656   1HH2  ARG  92          1HH2      ARG  92   4.672   9.550   7.763
  657   2HH2  ARG  92          2HH2      ARG  92   3.053   9.993   8.225
  658    H    GLN  93           H        GLN  93   8.695  10.257   6.716
  659    HA   GLN  93           HA       GLN  93   9.990  10.913   9.249
  660   1HB   GLN  93          2HB       GLN  93   8.475   9.765  10.458
  661   2HB   GLN  93          1HB       GLN  93   7.465  10.081   9.053
  662   1HG   GLN  93          2HG       GLN  93   9.052   7.583   9.042
  663   2HG   GLN  93          1HG       GLN  93   7.700   7.682  10.165
  664   1HE2  GLN  93          1HE2      GLN  93   8.659   7.274   6.912
  665   2HE2  GLN  93          2HE2      GLN  93   7.076   7.117   6.234
  666    H    GLY  94           H        GLY  94  10.603   9.415   6.452
  667   1HA   GLY  94          2HA       GLY  94  12.569   8.405   5.842
  668   2HA   GLY  94          1HA       GLY  94  13.025   8.361   7.541
  669    H    TRP  95           H        TRP  95  13.241   6.500   8.293
  670    HA   TRP  95           HA       TRP  95  11.495   4.338   7.421
  671   1HB   TRP  95          2HB       TRP  95  14.382   3.837   8.134
  672   2HB   TRP  95          1HB       TRP  95  13.285   2.834   7.177
  673    HD1  TRP  95           HD       TRP  95  15.285   6.117   6.857
  674    HE1  TRP  95           1HE      TRP  95  15.768   6.529   4.378
  675    HE3  TRP  95           3HE      TRP  95  12.631   2.227   4.881
  676    HZ2  TRP  95           2HZ      TRP  95  15.113   5.353   1.892
  677    HZ3  TRP  95           3HZ      TRP  95  12.607   1.947   2.437
  678    HH2  TRP  95           HH       TRP  95  13.823   3.477   0.976
  679    H    GLY  96           H        GLY  96  11.459   6.301   9.541
  680   1HA   GLY  96          2HA       GLY  96  11.882   4.802  11.978
  681   2HA   GLY  96          1HA       GLY  96  11.067   6.356  11.830
  682    H    ALA  97           H        ALA  97   9.314   5.312   9.678
  683    HA   ALA  97           HA       ALA  97   7.311   4.050  11.328
  684   1HB   ALA  97          1HB       ALA  97   7.272   4.670   8.373
  685   2HB   ALA  97          2HB       ALA  97   6.649   5.709   9.652
  686   3HB   ALA  97          3HB       ALA  97   5.894   4.148   9.338
  687    H    TRP  98           H        TRP  98   9.766   3.125   9.089
  688    HA   TRP  98           HA       TRP  98   8.730   0.370   9.076
  689   1HB   TRP  98          2HB       TRP  98  10.760   1.745   7.316
  690   2HB   TRP  98          1HB       TRP  98  10.385   0.027   7.236
  691    HD1  TRP  98           HD       TRP  98   7.894  -0.632   6.387
  692    HE1  TRP  98           1HE      TRP  98   6.321   0.593   4.753
  693    HE3  TRP  98           3HE      TRP  98  10.015   4.050   6.562
  694    HZ2  TRP  98           2HZ      TRP  98   6.041   3.209   3.674
  695    HZ3  TRP  98           3HZ      TRP  98   9.040   5.828   5.189
  696    HH2  TRP  98           HH       TRP  98   7.116   5.393   3.774
  697    HA   PRO  99           HA       PRO  99  11.790  -0.077  12.324
  698   1HB   PRO  99          2HB       PRO  99  10.747  -2.856  12.153
  699   2HB   PRO  99          1HB       PRO  99  10.927  -1.806  13.566
  700   1HG   PRO  99          2HG       PRO  99   8.527  -2.210  12.560
  701   2HG   PRO  99          1HG       PRO  99   9.018  -0.571  13.039
  702   1HD   PRO  99          2HD       PRO  99   8.950  -1.785  10.291
  703   2HD   PRO  99          1HD       PRO  99   8.345  -0.201  10.832
  704    H    VAL 100           H        VAL 100  12.517  -3.029  12.427
  705    HA   VAL 100           HA       VAL 100  15.049  -2.893  11.333
  706    HB   VAL 100           HB       VAL 100  14.945  -5.452  11.424
  707   1HG1  VAL 100          1HG1      VAL 100  15.011  -5.440  13.890
  708   2HG1  VAL 100          2HG1      VAL 100  14.337  -3.809  13.880
  709   3HG1  VAL 100          3HG1      VAL 100  15.931  -4.110  13.188
  710   1HG2  VAL 100          1HG2      VAL 100  13.092  -6.425  12.648
  711   2HG2  VAL 100          2HG2      VAL 100  12.502  -5.627  11.191
  712   3HG2  VAL 100          3HG2      VAL 100  12.312  -4.849  12.761
  713    H    CYS 101           H        CYS 101  12.076  -3.834   9.826
  714    HA   CYS 101           HA       CYS 101  13.007  -5.247   7.621
  715   1HB   CYS 101          2HB       CYS 101  10.637  -3.377   7.821
  716   2HB   CYS 101          1HB       CYS 101  10.929  -4.476   6.474
  717    H    ALA 102           H        ALA 102  12.758  -1.752   8.122
  718    HA   ALA 102           HA       ALA 102  13.565  -1.072   5.476
  719   1HB   ALA 102          1HB       ALA 102  12.308   0.476   6.893
  720   2HB   ALA 102          2HB       ALA 102  13.822   1.180   6.324
  721   3HB   ALA 102          3HB       ALA 102  13.691   0.591   7.982
  722    H    ALA 103           H        ALA 103  15.237  -1.346   8.577
  723    HA   ALA 103           HA       ALA 103  17.750  -0.449   7.718
  724   1HB   ALA 103          1HB       ALA 103  17.149  -0.648  10.072
  725   2HB   ALA 103          2HB       ALA 103  18.628  -1.541   9.718
  726   3HB   ALA 103          3HB       ALA 103  17.105  -2.405   9.917
  727    H    ARG 104           H        ARG 104  16.384  -3.697   7.885
  728    HA   ARG 104           HA       ARG 104  18.637  -5.055   6.836
  729   1HB   ARG 104          2HB       ARG 104  15.788  -5.694   7.352
  730   2HB   ARG 104          1HB       ARG 104  16.608  -6.697   6.163
  731   1HG   ARG 104          2HG       ARG 104  16.800  -7.819   8.216
  732   2HG   ARG 104          1HG       ARG 104  18.380  -7.112   7.899
  733   1HD   ARG 104          2HD       ARG 104  16.352  -5.711   9.609
  734   2HD   ARG 104          1HD       ARG 104  17.411  -6.952  10.273
  735    HE   ARG 104           HE       ARG 104  18.807  -4.864   8.856
  736   1HH1  ARG 104          1HH1      ARG 104  17.554  -5.965  11.934
  737   2HH1  ARG 104          2HH1      ARG 104  18.505  -4.847  12.871
  738   1HH2  ARG 104          1HH2      ARG 104  20.097  -3.403  10.091
  739   2HH2  ARG 104          2HH2      ARG 104  19.970  -3.419  11.829
  740    H    ALA 105           H        ALA 105  16.253  -3.102   5.392
  741    HA   ALA 105           HA       ALA 105  16.515  -4.249   2.723
  742   1HB   ALA 105          1HB       ALA 105  14.329  -3.550   3.517
  743   2HB   ALA 105          2HB       ALA 105  14.830  -2.601   2.116
  744   3HB   ALA 105          3HB       ALA 105  14.923  -1.904   3.735
  745    H    GLY 106           H        GLY 106  17.878  -1.717   4.629
  746   1HA   GLY 106          2HA       GLY 106  19.903  -0.627   3.809
  747   2HA   GLY 106          1HA       GLY 106  19.152  -0.576   2.220
  748    H    ALA 107           H        ALA 107  18.422   0.468   5.527
  749    HA   ALA 107           HA       ALA 107  16.634   2.513   4.807
  750   1HB   ALA 107          1HB       ALA 107  18.200   2.187   7.364
  751   2HB   ALA 107          2HB       ALA 107  16.627   1.465   7.016
  752   3HB   ALA 107          3HB       ALA 107  16.786   3.218   7.134
  753    H    ARG 108           H        ARG 108  16.894   4.810   4.940
  754    HA   ARG 108           HA       ARG 108  19.660   5.735   4.612
  755   1HB   ARG 108          2HB       ARG 108  17.462   6.390   2.640
  756   2HB   ARG 108          1HB       ARG 108  19.151   6.868   2.542
  757   1HG   ARG 108          2HG       ARG 108  19.814   4.558   2.216
  758   2HG   ARG 108          1HG       ARG 108  18.135   4.029   2.371
  759   1HD   ARG 108          2HD       ARG 108  18.668   4.138   0.036
  760   2HD   ARG 108          1HD       ARG 108  17.590   5.489   0.405
  761    HE   ARG 108           HE       ARG 108  20.318   6.268   0.619
  762   1HH1  ARG 108          1HH1      ARG 108  17.806   5.623  -1.759
  763   2HH1  ARG 108          2HH1      ARG 108  18.535   6.638  -2.966
  764   1HH2  ARG 108          1HH2      ARG 108  21.273   7.565  -0.986
  765   2HH2  ARG 108          2HH2      ARG 108  20.505   7.731  -2.538
  Start of MODEL   16
    1   1H    ASN   1          1HT       ASN   1  35.109  43.905 -21.817
    2   2H    ASN   1          2HT       ASN   1  35.067  42.533 -20.820
    3   3H    ASN   1          3HT       ASN   1  34.011  43.828 -20.528
    4    HA   ASN   1           HA       ASN   1  34.014  42.203 -22.990
    5   1HB   ASN   1          2HB       ASN   1  31.923  41.185 -22.107
    6   2HB   ASN   1          1HB       ASN   1  33.347  40.769 -21.167
    7   1HD2  ASN   1          1HD2      ASN   1  30.512  40.744 -20.455
    8   2HD2  ASN   1          2HD2      ASN   1  30.380  41.731 -19.036
    9    H    VAL   2           H        VAL   2  32.971  43.110 -24.589
   10    HA   VAL   2           HA       VAL   2  31.556  45.613 -24.157
   11    HB   VAL   2           HB       VAL   2  32.080  44.137 -26.745
   12   1HG1  VAL   2          1HG1      VAL   2  30.236  45.737 -26.889
   13   2HG1  VAL   2          2HG1      VAL   2  31.632  46.291 -27.814
   14   3HG1  VAL   2          3HG1      VAL   2  31.278  47.003 -26.240
   15   1HG2  VAL   2          1HG2      VAL   2  34.170  44.724 -25.625
   16   2HG2  VAL   2          2HG2      VAL   2  33.630  46.397 -25.481
   17   3HG2  VAL   2          3HG2      VAL   2  33.929  45.700 -27.074
   18    H    VAL   3           H        VAL   3  30.954  42.363 -25.367
   19    HA   VAL   3           HA       VAL   3  28.195  42.729 -25.782
   20    HB   VAL   3           HB       VAL   3  29.462  40.976 -26.939
   21   1HG1  VAL   3          1HG1      VAL   3  29.655  39.650 -24.238
   22   2HG1  VAL   3          2HG1      VAL   3  30.987  40.352 -25.155
   23   3HG1  VAL   3          3HG1      VAL   3  30.141  38.935 -25.776
   24   1HG2  VAL   3          1HG2      VAL   3  27.848  39.143 -26.672
   25   2HG2  VAL   3          2HG2      VAL   3  27.056  40.716 -26.742
   26   3HG2  VAL   3          3HG2      VAL   3  27.249  39.895 -25.193
   27    H    VAL   4           H        VAL   4  26.487  42.367 -24.437
   28    HA   VAL   4           HA       VAL   4  27.053  42.051 -21.608
   29    HB   VAL   4           HB       VAL   4  24.321  42.191 -22.853
   30   1HG1  VAL   4          1HG1      VAL   4  25.345  42.980 -20.140
   31   2HG1  VAL   4          2HG1      VAL   4  24.385  41.551 -20.522
   32   3HG1  VAL   4          3HG1      VAL   4  23.683  43.160 -20.700
   33   1HG2  VAL   4          1HG2      VAL   4  24.383  44.631 -22.543
   34   2HG2  VAL   4          2HG2      VAL   4  25.569  44.082 -23.728
   35   3HG2  VAL   4          3HG2      VAL   4  26.086  44.514 -22.097
   36    H    THR   5           H        THR   5  26.433  40.301 -20.391
   37    HA   THR   5           HA       THR   5  25.886  37.875 -21.940
   38    HB   THR   5           HB       THR   5  26.723  36.708 -19.828
   39    HG1  THR   5           1HG      THR   5  26.592  38.594 -18.469
   40   1HG2  THR   5          1HG2      THR   5  28.644  38.454 -21.380
   41   2HG2  THR   5          2HG2      THR   5  28.058  36.865 -21.872
   42   3HG2  THR   5          3HG2      THR   5  29.081  37.023 -20.443
   43    HA   PRO   6           HA       PRO   6  22.049  37.886 -19.566
   44   1HB   PRO   6          2HB       PRO   6  20.453  37.496 -21.705
   45   2HB   PRO   6          1HB       PRO   6  21.130  39.080 -21.316
   46   1HG   PRO   6          2HG       PRO   6  21.752  37.332 -23.560
   47   2HG   PRO   6          1HG       PRO   6  22.230  39.016 -23.296
   48   1HD   PRO   6          2HD       PRO   6  23.730  36.540 -22.751
   49   2HD   PRO   6          1HD       PRO   6  24.328  38.204 -22.920
   50    H    ALA   7           H        ALA   7  20.385  36.283 -19.320
   51    HA   ALA   7           HA       ALA   7  21.079  33.620 -20.360
   52   1HB   ALA   7          1HB       ALA   7  21.491  33.725 -17.965
   53   2HB   ALA   7          2HB       ALA   7  20.141  32.653 -18.331
   54   3HB   ALA   7          3HB       ALA   7  19.835  34.268 -17.699
   55    H    HIS   8           H        HIS   8  19.768  34.460 -22.108
   56    HA   HIS   8           HA       HIS   8  16.902  34.278 -21.716
   57   1HB   HIS   8          2HB       HIS   8  18.490  34.438 -24.294
   58   2HB   HIS   8          1HB       HIS   8  16.745  34.596 -24.148
   59    HD1  HIS   8           1HD      HIS   8  19.365  36.679 -24.897
   60    HD2  HIS   8           2HD      HIS   8  16.395  36.871 -21.991
   61    HE1  HIS   8           1HE      HIS   8  19.159  39.118 -24.245
   62    H    GLU   9           H        GLU   9  19.570  32.336 -22.121
   63    HA   GLU   9           HA       GLU   9  18.449  30.248 -23.718
   64   1HB   GLU   9          2HB       GLU   9  20.947  30.689 -22.193
   65   2HB   GLU   9          1HB       GLU   9  20.479  29.018 -22.490
   66   1HG   GLU   9          2HG       GLU   9  20.735  29.194 -24.746
   67   2HG   GLU   9          1HG       GLU   9  20.472  30.941 -24.757
   68    H    ALA  10           H        ALA  10  16.992  28.870 -23.114
   69    HA   ALA  10           HA       ALA  10  17.327  27.439 -20.638
   70   1HB   ALA  10          1HB       ALA  10  15.856  29.257 -19.933
   71   2HB   ALA  10          2HB       ALA  10  14.977  27.727 -19.949
   72   3HB   ALA  10          3HB       ALA  10  14.751  28.890 -21.257
   73    H    VAL  11           H        VAL  11  17.993  26.241 -22.622
   74    HA   VAL  11           HA       VAL  11  16.232  25.224 -24.493
   75    HB   VAL  11           HB       VAL  11  18.618  24.861 -24.667
   76   1HG1  VAL  11          1HG1      VAL  11  19.776  23.158 -23.335
   77   2HG1  VAL  11          2HG1      VAL  11  18.325  22.956 -22.352
   78   3HG1  VAL  11          3HG1      VAL  11  19.190  24.493 -22.344
   79   1HG2  VAL  11          1HG2      VAL  11  17.071  22.277 -24.554
   80   2HG2  VAL  11          2HG2      VAL  11  18.616  22.502 -25.372
   81   3HG2  VAL  11          3HG2      VAL  11  17.189  23.375 -25.929
   82    H    VAL  12           H        VAL  12  17.023  23.810 -21.331
   83    HA   VAL  12           HA       VAL  12  16.166  22.022 -20.251
   84    HB   VAL  12           HB       VAL  12  15.255  23.908 -19.184
   85   1HG1  VAL  12          1HG1      VAL  12  14.188  25.012 -21.057
   86   2HG1  VAL  12          2HG1      VAL  12  13.067  24.854 -19.702
   87   3HG1  VAL  12          3HG1      VAL  12  12.935  23.770 -21.089
   88   1HG2  VAL  12          1HG2      VAL  12  13.145  21.783 -19.462
   89   2HG2  VAL  12          2HG2      VAL  12  13.268  22.945 -18.140
   90   3HG2  VAL  12          3HG2      VAL  12  14.533  21.737 -18.374
   91    H    ARG  13           H        ARG  13  16.180  20.380 -21.633
   92    HA   ARG  13           HA       ARG  13  13.918  19.811 -23.306
   93   1HB   ARG  13          2HB       ARG  13  15.220  17.824 -23.965
   94   2HB   ARG  13          1HB       ARG  13  16.112  19.324 -24.180
   95   1HG   ARG  13          2HG       ARG  13  17.221  18.898 -22.003
   96   2HG   ARG  13          1HG       ARG  13  16.420  17.329 -21.965
   97   1HD   ARG  13          2HD       ARG  13  18.386  18.310 -24.025
   98   2HD   ARG  13          1HD       ARG  13  18.665  17.064 -22.807
   99    HE   ARG  13           HE       ARG  13  16.463  16.566 -24.619
  100   1HH1  ARG  13          1HH1      ARG  13  19.871  16.081 -23.941
  101   2HH1  ARG  13          2HH1      ARG  13  20.007  14.677 -24.965
  102   1HH2  ARG  13          1HH2      ARG  13  16.634  14.743 -25.968
  103   2HH2  ARG  13          2HH2      ARG  13  18.156  13.915 -26.137
  104    H    VAL  14           H        VAL  14  12.239  18.990 -22.464
  105    HA   VAL  14           HA       VAL  14  12.398  17.129 -20.221
  106    HB   VAL  14           HB       VAL  14   9.956  18.718 -20.889
  107   1HG1  VAL  14          1HG1      VAL  14   9.642  16.890 -19.345
  108   2HG1  VAL  14          2HG1      VAL  14   9.464  18.425 -18.494
  109   3HG1  VAL  14          3HG1      VAL  14  10.951  17.492 -18.327
  110   1HG2  VAL  14          1HG2      VAL  14  12.211  19.644 -19.121
  111   2HG2  VAL  14          2HG2      VAL  14  10.623  20.407 -19.221
  112   3HG2  VAL  14          3HG2      VAL  14  11.681  20.387 -20.632
  113    H    GLY  15           H        GLY  15  10.689  15.579 -20.148
  114   1HA   GLY  15          2HA       GLY  15   8.897  14.397 -21.192
  115   2HA   GLY  15          1HA       GLY  15   9.555  14.846 -22.764
  116    H    THR  16           H        THR  16  10.793  13.440 -19.824
  117    HA   THR  16           HA       THR  16  12.288  11.462 -21.299
  118    HB   THR  16           HB       THR  16  12.157  11.831 -18.315
  119    HG1  THR  16           1HG      THR  16  14.278  12.953 -19.751
  120   1HG2  THR  16          1HG2      THR  16  14.364  10.823 -18.361
  121   2HG2  THR  16          2HG2      THR  16  14.292  10.725 -20.121
  122   3HG2  THR  16          3HG2      THR  16  13.178   9.774 -19.140
  123    H    LYS  17           H        LYS  17   9.510  11.804 -19.420
  124    HA   LYS  17           HA       LYS  17   9.150   9.110 -18.596
  125   1HB   LYS  17          2HB       LYS  17   7.185  11.407 -18.666
  126   2HB   LYS  17          1HB       LYS  17   6.901   9.862 -17.887
  127   1HG   LYS  17          2HG       LYS  17   7.464  11.358 -16.172
  128   2HG   LYS  17          1HG       LYS  17   8.901  10.368 -16.430
  129   1HD   LYS  17          2HD       LYS  17   9.990  12.125 -17.618
  130   2HD   LYS  17          1HD       LYS  17   8.505  13.076 -17.693
  131   1HE   LYS  17          2HE       LYS  17   9.907  12.340 -15.129
  132   2HE   LYS  17          1HE       LYS  17  10.175  13.853 -15.994
  133   1HZ   LYS  17          1HZ       LYS  17   7.856  14.409 -15.707
  134   2HZ   LYS  17          2HZ       LYS  17   8.558  14.090 -14.197
  135   3HZ   LYS  17          3HZ       LYS  17   7.556  12.937 -14.927
  136    HA   PRO  18           HA       PRO  18   7.123   7.878 -22.437
  137   1HB   PRO  18          2HB       PRO  18   7.423   5.191 -21.482
  138   2HB   PRO  18          1HB       PRO  18   8.288   5.979 -22.802
  139   1HG   PRO  18          2HG       PRO  18   9.456   5.191 -20.453
  140   2HG   PRO  18          1HG       PRO  18  10.076   6.485 -21.491
  141   1HD   PRO  18          2HD       PRO  18   8.446   6.687 -18.987
  142   2HD   PRO  18          1HD       PRO  18   9.813   7.696 -19.523
  143    H    GLY  19           H        GLY  19   5.345   6.469 -22.827
  144   1HA   GLY  19          2HA       GLY  19   3.450   6.423 -20.560
  145   2HA   GLY  19          1HA       GLY  19   2.994   6.623 -22.246
  146    H    THR  20           H        THR  20   4.766   4.702 -23.236
  147    HA   THR  20           HA       THR  20   3.203   2.370 -23.133
  148    HB   THR  20           HB       THR  20   6.090   2.599 -23.995
  149    HG1  THR  20           1HG      THR  20   3.792   2.940 -25.653
  150   1HG2  THR  20          1HG2      THR  20   3.872   0.743 -24.852
  151   2HG2  THR  20          2HG2      THR  20   5.248   0.316 -23.835
  152   3HG2  THR  20          3HG2      THR  20   5.505   0.776 -25.520
  153    H    GLU  21           H        GLU  21   5.972   3.413 -21.291
  154    HA   GLU  21           HA       GLU  21   5.925   0.940 -19.769
  155   1HB   GLU  21          2HB       GLU  21   8.403   2.382 -20.731
  156   2HB   GLU  21          1HB       GLU  21   8.396   1.021 -19.621
  157   1HG   GLU  21          2HG       GLU  21   7.453  -0.402 -21.352
  158   2HG   GLU  21          1HG       GLU  21   7.421   0.964 -22.467
  159    H    VAL  22           H        VAL  22   6.091   1.204 -17.649
  160    HA   VAL  22           HA       VAL  22   6.104   3.885 -16.545
  161    HB   VAL  22           HB       VAL  22   5.906   1.214 -15.123
  162   1HG1  VAL  22          1HG1      VAL  22   6.674   3.038 -13.672
  163   2HG1  VAL  22          2HG1      VAL  22   5.059   2.485 -13.233
  164   3HG1  VAL  22          3HG1      VAL  22   5.260   3.989 -14.131
  165   1HG2  VAL  22          1HG2      VAL  22   4.046   1.542 -16.665
  166   2HG2  VAL  22          2HG2      VAL  22   3.730   3.128 -15.964
  167   3HG2  VAL  22          3HG2      VAL  22   3.503   1.675 -14.993
  168    HA   PRO  23           HA       PRO  23  10.518   3.976 -16.195
  169   1HB   PRO  23          2HB       PRO  23   9.920   5.806 -13.928
  170   2HB   PRO  23          1HB       PRO  23  10.974   6.050 -15.324
  171   1HG   PRO  23          2HG       PRO  23   8.586   7.231 -15.181
  172   2HG   PRO  23          1HG       PRO  23   9.217   6.617 -16.722
  173   1HD   PRO  23          2HD       PRO  23   7.121   5.496 -14.934
  174   2HD   PRO  23          1HD       PRO  23   7.237   5.455 -16.703
  175    HA   PRO  24           HA       PRO  24  11.181   0.835 -13.123
  176   1HB   PRO  24          2HB       PRO  24  13.955   1.122 -13.165
  177   2HB   PRO  24          1HB       PRO  24  13.009   0.056 -14.210
  178   1HG   PRO  24          2HG       PRO  24  14.051   2.805 -14.750
  179   2HG   PRO  24          1HG       PRO  24  13.977   1.398 -15.831
  180   1HD   PRO  24          2HD       PRO  24  12.199   3.345 -16.078
  181   2HD   PRO  24          1HD       PRO  24  11.685   1.648 -16.183
  182    H    VAL  25           H        VAL  25  11.599   0.734 -11.022
  183    HA   VAL  25           HA       VAL  25  11.855   3.257  -9.645
  184    HB   VAL  25           HB       VAL  25  10.119   1.660  -8.924
  185   1HG1  VAL  25          1HG1      VAL  25  10.708  -0.344  -7.685
  186   2HG1  VAL  25          2HG1      VAL  25  12.416  -0.069  -8.034
  187   3HG1  VAL  25          3HG1      VAL  25  11.292  -0.429  -9.346
  188   1HG2  VAL  25          1HG2      VAL  25  10.632   1.796  -6.509
  189   2HG2  VAL  25          2HG2      VAL  25  10.862   3.309  -7.385
  190   3HG2  VAL  25          3HG2      VAL  25  12.256   2.334  -6.933
  191    H    ILE  26           H        ILE  26  13.610   4.006  -8.748
  192    HA   ILE  26           HA       ILE  26  16.066   2.492  -8.855
  193    HB   ILE  26           HB       ILE  26  15.614   5.296  -7.832
  194   1HG1  ILE  26          2HG1      ILE  26  14.918   5.100 -10.166
  195   2HG1  ILE  26          1HG1      ILE  26  16.402   6.039 -10.043
  196   1HG2  ILE  26          1HG2      ILE  26  18.021   5.586  -8.252
  197   2HG2  ILE  26          2HG2      ILE  26  18.139   3.876  -8.667
  198   3HG2  ILE  26          3HG2      ILE  26  17.694   4.358  -7.030
  199   1HD1  ILE  26          1HD1      ILE  26  16.187   3.154 -10.871
  200   2HD1  ILE  26          2HD1      ILE  26  17.688   4.067 -10.722
  201   3HD1  ILE  26          3HD1      ILE  26  16.490   4.530 -11.931
  202    H    ASP  27           H        ASP  27  13.770   3.459  -6.451
  203    HA   ASP  27           HA       ASP  27  15.614   2.753  -4.289
  204   1HB   ASP  27          2HB       ASP  27  13.056   4.350  -4.170
  205   2HB   ASP  27          1HB       ASP  27  14.101   3.987  -2.807
  206    H    GLY  28           H        GLY  28  13.554   1.282  -6.110
  207   1HA   GLY  28          2HA       GLY  28  11.629   0.324  -4.185
  208   2HA   GLY  28          1HA       GLY  28  11.743  -0.160  -5.873
  209    H    SER  29           H        SER  29  14.745  -0.238  -4.637
  210    HA   SER  29           HA       SER  29  14.791  -3.113  -4.465
  211   1HB   SER  29          2HB       SER  29  16.982  -1.225  -3.637
  212   2HB   SER  29          1HB       SER  29  17.145  -2.892  -4.185
  213    HG   SER  29           HG       SER  29  15.910  -1.642  -6.126
  214    H    ILE  30           H        ILE  30  15.314  -0.450  -2.249
  215    HA   ILE  30           HA       ILE  30  15.381  -2.024   0.090
  216    HB   ILE  30           HB       ILE  30  15.158   0.125   1.259
  217   1HG1  ILE  30          2HG1      ILE  30  14.740   1.188  -1.515
  218   2HG1  ILE  30          1HG1      ILE  30  13.773   1.480  -0.071
  219   1HG2  ILE  30          1HG2      ILE  30  17.168   0.136  -0.987
  220   2HG2  ILE  30          2HG2      ILE  30  17.353  -0.673   0.568
  221   3HG2  ILE  30          3HG2      ILE  30  17.285   1.086   0.493
  222   1HD1  ILE  30          1HD1      ILE  30  14.974   3.467  -0.534
  223   2HD1  ILE  30          2HD1      ILE  30  16.488   2.585  -0.726
  224   3HD1  ILE  30          3HD1      ILE  30  15.746   2.719   0.871
  225    H    TRP  31           H        TRP  31  12.945  -0.334  -1.734
  226    HA   TRP  31           HA       TRP  31  10.863  -0.596   0.155
  227   1HB   TRP  31          2HB       TRP  31  10.860  -0.054  -2.826
  228   2HB   TRP  31          1HB       TRP  31   9.366  -0.269  -1.908
  229    HD1  TRP  31           HD       TRP  31  11.034   2.506  -3.202
  230    HE1  TRP  31           1HE      TRP  31  10.846   4.612  -1.710
  231    HE3  TRP  31           3HE      TRP  31   9.696   0.258   1.139
  232    HZ2  TRP  31           2HZ      TRP  31  10.253   5.188   0.987
  233    HZ3  TRP  31           3HZ      TRP  31   9.347   1.630   3.148
  234    HH2  TRP  31           HH       TRP  31   9.623   4.051   3.065
  235    H    ASP  32           H        ASP  32  12.109  -2.650  -2.392
  236    HA   ASP  32           HA       ASP  32  10.034  -4.606  -2.107
  237   1HB   ASP  32          2HB       ASP  32  11.175  -4.420  -4.219
  238   2HB   ASP  32          1HB       ASP  32  12.740  -4.698  -3.448
  239    H    ALA  33           H        ALA  33  13.284  -4.097  -0.756
  240    HA   ALA  33           HA       ALA  33  13.459  -6.595   0.509
  241   1HB   ALA  33          1HB       ALA  33  15.399  -5.149   0.195
  242   2HB   ALA  33          2HB       ALA  33  15.188  -5.573   1.895
  243   3HB   ALA  33          3HB       ALA  33  14.708  -3.977   1.319
  244    H    ILE  34           H        ILE  34  12.033  -3.505   1.471
  245    HA   ILE  34           HA       ILE  34  11.273  -4.320   4.086
  246    HB   ILE  34           HB       ILE  34  10.116  -2.253   2.239
  247   1HG1  ILE  34          2HG1      ILE  34  11.990  -2.166   4.609
  248   2HG1  ILE  34          1HG1      ILE  34  12.285  -1.609   2.967
  249   1HG2  ILE  34          1HG2      ILE  34   9.412  -2.747   5.132
  250   2HG2  ILE  34          2HG2      ILE  34   8.360  -3.040   3.747
  251   3HG2  ILE  34          3HG2      ILE  34   8.847  -1.394   4.152
  252   1HD1  ILE  34          1HD1      ILE  34  10.812   0.245   3.266
  253   2HD1  ILE  34          2HD1      ILE  34  11.938   0.199   4.626
  254   3HD1  ILE  34          3HD1      ILE  34  10.284  -0.371   4.831
  255    H    ALA  35           H        ALA  35   9.573  -4.382   0.970
  256    HA   ALA  35           HA       ALA  35   7.165  -5.489   1.869
  257   1HB   ALA  35          1HB       ALA  35   6.855  -6.238  -0.451
  258   2HB   ALA  35          2HB       ALA  35   8.538  -5.838  -0.792
  259   3HB   ALA  35          3HB       ALA  35   7.398  -4.564  -0.358
  260    H    GLY  36           H        GLY  36  10.236  -6.920   1.058
  261   1HA   GLY  36          2HA       GLY  36   9.317  -9.643   1.276
  262   2HA   GLY  36          1HA       GLY  36  10.993  -9.108   1.201
  263    H    CYS  37           H        CYS  37  10.194  -7.186   3.445
  264    HA   CYS  37           HA       CYS  37  11.075  -8.941   5.560
  265   1HB   CYS  37          2HB       CYS  37  12.263  -6.914   5.397
  266   2HB   CYS  37          1HB       CYS  37  10.791  -5.970   5.228
  267    H    GLU  38           H        GLU  38   8.398  -6.600   5.132
  268    HA   GLU  38           HA       GLU  38   7.183  -7.583   7.586
  269   1HB   GLU  38          2HB       GLU  38   6.580  -5.273   5.757
  270   2HB   GLU  38          1HB       GLU  38   5.426  -5.788   6.979
  271   1HG   GLU  38          2HG       GLU  38   8.245  -4.872   7.485
  272   2HG   GLU  38          1HG       GLU  38   6.781  -3.926   7.746
  273    H    ALA  39           H        ALA  39   6.704  -7.703   4.128
  274    HA   ALA  39           HA       ALA  39   4.061  -8.826   4.528
  275   1HB   ALA  39          1HB       ALA  39   5.369  -8.011   1.957
  276   2HB   ALA  39          2HB       ALA  39   4.258  -7.022   2.904
  277   3HB   ALA  39          3HB       ALA  39   3.691  -8.517   2.157
  278    H    GLY  40           H        GLY  40   7.183  -9.905   4.086
  279   1HA   GLY  40          2HA       GLY  40   7.949 -12.097   3.907
  280   2HA   GLY  40          1HA       GLY  40   6.287 -12.623   3.639
  281    H    GLY  41           H        GLY  41   6.994 -10.003   1.794
  282   1HA   GLY  41          2HA       GLY  41   7.786  -9.671  -0.326
  283   2HA   GLY  41          1HA       GLY  41   8.187 -11.385  -0.451
  284    H    ASN  42           H        ASN  42   5.207  -9.469   0.064
  285    HA   ASN  42           HA       ASN  42   4.136 -10.386  -2.434
  286   1HB   ASN  42          2HB       ASN  42   3.511 -12.251  -0.921
  287   2HB   ASN  42          1HB       ASN  42   2.690 -11.083   0.120
  288   1HD2  ASN  42          1HD2      ASN  42   0.755 -12.223  -0.231
  289   2HD2  ASN  42          2HD2      ASN  42  -0.151 -12.019  -1.689
  290    H    TRP  43           H        TRP  43   3.082  -8.810  -3.280
  291    HA   TRP  43           HA       TRP  43   2.582  -6.463  -1.605
  292   1HB   TRP  43          2HB       TRP  43   2.719  -6.747  -4.604
  293   2HB   TRP  43          1HB       TRP  43   2.549  -5.233  -3.721
  294    HD1  TRP  43           HD       TRP  43   5.074  -8.184  -3.752
  295    HE1  TRP  43           1HE      TRP  43   7.441  -7.224  -3.546
  296    HE3  TRP  43           3HE      TRP  43   3.885  -3.236  -3.396
  297    HZ2  TRP  43           2HZ      TRP  43   8.662  -4.663  -3.282
  298    HZ3  TRP  43           3HZ      TRP  43   5.691  -1.590  -3.172
  299    HH2  TRP  43           HH       TRP  43   8.042  -2.294  -3.120
  300    H    ALA  44           H        ALA  44   0.976  -8.995  -3.039
  301    HA   ALA  44           HA       ALA  44  -1.529  -7.492  -3.351
  302   1HB   ALA  44          1HB       ALA  44  -0.874 -10.301  -4.233
  303   2HB   ALA  44          2HB       ALA  44  -0.822  -8.868  -5.259
  304   3HB   ALA  44          3HB       ALA  44  -2.357  -9.414  -4.587
  305    H    ILE  45           H        ILE  45  -0.031  -8.829  -0.903
  306    HA   ILE  45           HA       ILE  45  -1.946 -10.637   0.130
  307    HB   ILE  45           HB       ILE  45   0.648 -10.178   0.738
  308   1HG1  ILE  45          2HG1      ILE  45  -1.438 -11.345   2.590
  309   2HG1  ILE  45          1HG1      ILE  45  -0.661 -12.181   1.249
  310   1HG2  ILE  45          1HG2      ILE  45   0.236  -8.080   1.891
  311   2HG2  ILE  45          2HG2      ILE  45   0.798  -9.307   3.026
  312   3HG2  ILE  45          3HG2      ILE  45  -0.911  -8.875   2.970
  313   1HD1  ILE  45          1HD1      ILE  45   0.717 -11.138   3.710
  314   2HD1  ILE  45          2HD1      ILE  45   1.493 -11.981   2.369
  315   3HD1  ILE  45          3HD1      ILE  45   0.313 -12.823   3.376
  316    H    ASN  46           H        ASN  46  -3.484 -10.293   1.696
  317    HA   ASN  46           HA       ASN  46  -3.948  -7.704   2.855
  318   1HB   ASN  46          2HB       ASN  46  -4.855  -7.463   0.513
  319   2HB   ASN  46          1HB       ASN  46  -6.002  -8.742   0.889
  320   1HD2  ASN  46          1HD2      ASN  46  -6.403  -5.921   0.171
  321   2HD2  ASN  46          2HD2      ASN  46  -7.360  -5.253   1.447
  322    H    THR  47           H        THR  47  -4.105  -8.534   4.817
  323    HA   THR  47           HA       THR  47  -5.579 -10.953   5.312
  324    HB   THR  47           HB       THR  47  -4.954 -10.455   7.719
  325    HG1  THR  47           1HG      THR  47  -3.445  -8.794   8.031
  326   1HG2  THR  47          1HG2      THR  47  -2.592 -11.028   7.380
  327   2HG2  THR  47          2HG2      THR  47  -2.726 -10.577   5.680
  328   3HG2  THR  47          3HG2      THR  47  -3.635 -11.956   6.301
  329    H    GLY  48           H        GLY  48  -6.230  -7.603   5.260
  330   1HA   GLY  48          2HA       GLY  48  -8.393  -6.694   5.309
  331   2HA   GLY  48          1HA       GLY  48  -8.951  -8.126   6.168
  332    H    ASN  49           H        ASN  49  -6.038  -6.578   7.175
  333    HA   ASN  49           HA       ASN  49  -7.353  -5.996   9.711
  334   1HB   ASN  49          2HB       ASN  49  -5.160  -5.906  10.697
  335   2HB   ASN  49          1HB       ASN  49  -5.258  -7.339   9.681
  336   1HD2  ASN  49          1HD2      ASN  49  -2.955  -5.778  10.623
  337   2HD2  ASN  49          2HD2      ASN  49  -2.085  -5.335   9.192
  338    H    GLY  50           H        GLY  50  -7.224  -4.310   7.091
  339   1HA   GLY  50          2HA       GLY  50  -7.692  -2.006   6.933
  340   2HA   GLY  50          1HA       GLY  50  -6.901  -1.763   8.486
  341    H    TYR  51           H        TYR  51  -4.787  -3.676   7.179
  342    HA   TYR  51           HA       TYR  51  -3.382  -1.582   5.689
  343   1HB   TYR  51          2HB       TYR  51  -1.923  -3.884   6.942
  344   2HB   TYR  51          1HB       TYR  51  -1.297  -2.348   6.419
  345    HD1  TYR  51           1HD      TYR  51  -0.238  -3.145   8.804
  346    HD2  TYR  51           2HD      TYR  51  -4.058  -1.376   8.224
  347    HE1  TYR  51           1HE      TYR  51  -0.213  -2.356  11.129
  348    HE2  TYR  51           2HE      TYR  51  -4.047  -0.586  10.553
  349    HH   TYR  51           HH       TYR  51  -1.231  -0.687  12.531
  350    H    TYR  52           H        TYR  52  -1.835  -2.539   4.094
  351    HA   TYR  52           HA       TYR  52  -3.104  -4.852   2.818
  352   1HB   TYR  52          2HB       TYR  52  -2.276  -2.317   1.388
  353   2HB   TYR  52          1HB       TYR  52  -3.122  -3.701   0.695
  354    HD1  TYR  52           1HD      TYR  52  -5.487  -3.908   0.888
  355    HD2  TYR  52           2HD      TYR  52  -3.458  -0.905   3.104
  356    HE1  TYR  52           1HE      TYR  52  -7.649  -2.913   1.510
  357    HE2  TYR  52           2HE      TYR  52  -5.600   0.112   3.715
  358    HH   TYR  52           HH       TYR  52  -8.582  -1.482   3.250
  359    H    GLY  53           H        GLY  53  -1.683  -5.541   0.865
  360   1HA   GLY  53          2HA       GLY  53   0.644  -6.513   2.135
  361   2HA   GLY  53          1HA       GLY  53   0.159  -6.829   0.480
  362    H    GLY  54           H        GLY  54   2.564  -6.792   0.377
  363   1HA   GLY  54          2HA       GLY  54   4.316  -5.776  -0.713
  364   2HA   GLY  54          1HA       GLY  54   3.331  -4.325  -0.873
  365    H    VAL  55           H        VAL  55   3.756  -2.631   0.397
  366    HA   VAL  55           HA       VAL  55   6.032  -2.895   2.198
  367    HB   VAL  55           HB       VAL  55   4.643  -0.285   1.696
  368   1HG1  VAL  55          1HG1      VAL  55   6.539  -0.483   3.291
  369   2HG1  VAL  55          2HG1      VAL  55   6.841   0.636   1.963
  370   3HG1  VAL  55          3HG1      VAL  55   7.566  -0.972   1.945
  371   1HG2  VAL  55          1HG2      VAL  55   4.827  -1.268  -0.517
  372   2HG2  VAL  55          2HG2      VAL  55   6.525  -1.649  -0.229
  373   3HG2  VAL  55          3HG2      VAL  55   6.005   0.032  -0.332
  374    H    GLN  56           H        GLN  56   2.950  -3.515   2.562
  375    HA   GLN  56           HA       GLN  56   1.578  -3.796   4.337
  376   1HB   GLN  56          2HB       GLN  56   4.250  -3.569   5.606
  377   2HB   GLN  56          1HB       GLN  56   2.845  -3.467   6.660
  378   1HG   GLN  56          2HG       GLN  56   3.215  -5.689   4.683
  379   2HG   GLN  56          1HG       GLN  56   3.852  -5.759   6.327
  380   1HE2  GLN  56          1HE2      GLN  56   0.949  -5.633   4.377
  381   2HE2  GLN  56          2HE2      GLN  56  -0.125  -6.189   5.611
  382    H    PHE  57           H        PHE  57   1.211  -1.462   3.205
  383    HA   PHE  57           HA       PHE  57   1.187   0.763   5.002
  384   1HB   PHE  57          2HB       PHE  57  -0.162   0.093   2.424
  385   2HB   PHE  57          1HB       PHE  57  -0.572   1.558   3.304
  386    HD1  PHE  57           1HD      PHE  57   1.905  -0.106   1.245
  387    HD2  PHE  57           2HD      PHE  57   1.012   3.338   3.576
  388    HE1  PHE  57           1HE      PHE  57   3.736   1.103   0.148
  389    HE2  PHE  57           2HE      PHE  57   2.848   4.557   2.479
  390    HZ   PHE  57           HZ       PHE  57   4.199   3.442   0.754
  391    H    ASP  58           H        ASP  58  -0.281   1.063   6.668
  392    HA   ASP  58           HA       ASP  58  -2.874  -0.104   6.569
  393   1HB   ASP  58          2HB       ASP  58  -3.510   1.509   8.270
  394   2HB   ASP  58          1HB       ASP  58  -1.974   0.759   8.692
  395    H    GLN  59           H        GLN  59  -4.871   1.023   6.069
  396    HA   GLN  59           HA       GLN  59  -4.873   2.222   3.585
  397   1HB   GLN  59          2HB       GLN  59  -6.806   1.121   4.526
  398   2HB   GLN  59          1HB       GLN  59  -6.897   2.304   5.817
  399   1HG   GLN  59          2HG       GLN  59  -8.574   2.905   4.348
  400   2HG   GLN  59          1HG       GLN  59  -7.266   4.029   4.018
  401   1HE2  GLN  59          1HE2      GLN  59  -5.725   2.087   2.424
  402   2HE2  GLN  59          2HE2      GLN  59  -6.569   1.927   0.918
  403    H    GLY  60           H        GLY  60  -4.656   3.682   6.754
  404   1HA   GLY  60          2HA       GLY  60  -5.458   6.304   6.009
  405   2HA   GLY  60          1HA       GLY  60  -4.630   5.853   7.493
  406    H    THR  61           H        THR  61  -2.268   4.881   6.660
  407    HA   THR  61           HA       THR  61  -0.771   7.183   6.013
  408    HB   THR  61           HB       THR  61   0.011   4.300   5.921
  409    HG1  THR  61           1HG      THR  61  -0.188   4.453   8.007
  410   1HG2  THR  61          1HG2      THR  61   1.617   5.694   4.718
  411   2HG2  THR  61          2HG2      THR  61   2.314   5.095   6.223
  412   3HG2  THR  61          3HG2      THR  61   1.744   6.760   6.117
  413    H    TRP  62           H        TRP  62  -1.762   4.387   4.155
  414    HA   TRP  62           HA       TRP  62  -0.442   4.929   1.756
  415   1HB   TRP  62          2HB       TRP  62  -1.534   2.808   2.222
  416   2HB   TRP  62          1HB       TRP  62  -3.098   3.614   2.342
  417    HD1  TRP  62           HD       TRP  62  -4.359   4.173   0.102
  418    HE1  TRP  62           1HE      TRP  62  -3.998   3.449  -2.338
  419    HE3  TRP  62           3HE      TRP  62   0.364   2.257   0.505
  420    HZ2  TRP  62           2HZ      TRP  62  -1.976   2.206  -3.906
  421    HZ3  TRP  62           3HZ      TRP  62   1.443   1.330  -1.499
  422    HH2  TRP  62           HH       TRP  62   0.310   1.301  -3.652
  423    H    GLU  63           H        GLU  63  -3.654   5.807   2.921
  424    HA   GLU  63           HA       GLU  63  -4.397   7.246   0.608
  425   1HB   GLU  63          2HB       GLU  63  -6.076   6.335   2.079
  426   2HB   GLU  63          1HB       GLU  63  -5.484   7.292   3.430
  427   1HG   GLU  63          2HG       GLU  63  -6.247   9.313   2.434
  428   2HG   GLU  63          1HG       GLU  63  -6.598   8.497   0.910
  429    H    ALA  64           H        ALA  64  -2.783   8.097   3.590
  430    HA   ALA  64           HA       ALA  64  -3.173  10.889   3.486
  431   1HB   ALA  64          1HB       ALA  64  -2.481   9.690   5.517
  432   2HB   ALA  64          2HB       ALA  64  -1.409  11.040   5.143
  433   3HB   ALA  64          3HB       ALA  64  -0.904   9.390   4.787
  434    H    ASN  65           H        ASN  65  -0.514   8.837   2.261
  435    HA   ASN  65           HA       ASN  65   0.792  11.146   1.126
  436   1HB   ASN  65          2HB       ASN  65   1.390   8.190   0.890
  437   2HB   ASN  65          1HB       ASN  65   2.399   9.470   0.222
  438   1HD2  ASN  65          1HD2      ASN  65   0.772   9.700   3.343
  439   2HD2  ASN  65          2HD2      ASN  65   2.218   9.657   4.290
  440    H    GLY  66           H        GLY  66  -1.753   9.137   0.265
  441   1HA   GLY  66          2HA       GLY  66  -3.183   9.680  -1.517
  442   2HA   GLY  66          1HA       GLY  66  -1.840  10.470  -2.329
  443    H    GLY  67           H        GLY  67  -2.431   7.162  -1.115
  444   1HA   GLY  67          2HA       GLY  67  -1.057   6.074  -3.398
  445   2HA   GLY  67          1HA       GLY  67  -1.783   5.171  -2.075
  446    H    LEU  68           H        LEU  68  -4.333   6.707  -2.491
  447    HA   LEU  68           HA       LEU  68  -5.649   4.702  -3.800
  448   1HB   LEU  68          2HB       LEU  68  -6.449   7.482  -3.083
  449   2HB   LEU  68          1HB       LEU  68  -7.570   6.390  -3.872
  450    HG   LEU  68           HG       LEU  68  -7.086   4.789  -1.941
  451   1HD1  LEU  68          1HD1      LEU  68  -6.398   5.837   0.151
  452   2HD1  LEU  68          2HD1      LEU  68  -6.038   7.323  -0.727
  453   3HD1  LEU  68          3HD1      LEU  68  -5.120   5.856  -1.062
  454   1HD2  LEU  68          1HD2      LEU  68  -8.534   7.375  -1.403
  455   2HD2  LEU  68          2HD2      LEU  68  -8.750   5.870  -0.510
  456   3HD2  LEU  68          3HD2      LEU  68  -9.204   5.958  -2.212
  457    H    ARG  69           H        ARG  69  -4.165   7.495  -5.161
  458    HA   ARG  69           HA       ARG  69  -5.601   7.498  -7.608
  459   1HB   ARG  69          2HB       ARG  69  -3.787   8.878  -8.477
  460   2HB   ARG  69          1HB       ARG  69  -4.324   9.449  -6.906
  461   1HG   ARG  69          2HG       ARG  69  -2.364   8.946  -5.893
  462   2HG   ARG  69          1HG       ARG  69  -2.060   7.555  -6.941
  463   1HD   ARG  69          2HD       ARG  69  -0.486   9.467  -7.286
  464   2HD   ARG  69          1HD       ARG  69  -1.360   8.972  -8.733
  465    HE   ARG  69           HE       ARG  69  -2.205  11.299  -7.122
  466   1HH1  ARG  69          1HH1      ARG  69  -1.366   9.826 -10.194
  467   2HH1  ARG  69          2HH1      ARG  69  -1.814  11.226 -11.126
  468   1HH2  ARG  69          1HH2      ARG  69  -2.775  13.131  -8.345
  469   2HH2  ARG  69          2HH2      ARG  69  -2.592  13.110 -10.072
  470    H    TYR  70           H        TYR  70  -2.840   5.776  -6.354
  471    HA   TYR  70           HA       TYR  70  -2.120   4.592  -8.904
  472   1HB   TYR  70          2HB       TYR  70  -1.371   3.826  -6.071
  473   2HB   TYR  70          1HB       TYR  70  -0.529   3.330  -7.538
  474    HD1  TYR  70           1HD      TYR  70  -0.923   5.847  -5.008
  475    HD2  TYR  70           2HD      TYR  70   0.750   5.058  -8.842
  476    HE1  TYR  70           1HE      TYR  70   0.541   7.803  -4.772
  477    HE2  TYR  70           2HE      TYR  70   2.218   7.019  -8.616
  478    HH   TYR  70           HH       TYR  70   2.541   8.748  -5.622
  479    H    ALA  71           H        ALA  71  -3.882   4.041  -6.043
  480    HA   ALA  71           HA       ALA  71  -5.851   2.342  -6.835
  481   1HB   ALA  71          1HB       ALA  71  -3.504   0.733  -5.797
  482   2HB   ALA  71          2HB       ALA  71  -4.152   0.660  -7.434
  483   3HB   ALA  71          3HB       ALA  71  -5.130   0.114  -6.074
  484    HA   PRO  72           HA       PRO  72  -6.691   3.822  -2.756
  485   1HB   PRO  72          2HB       PRO  72  -8.884   1.984  -2.565
  486   2HB   PRO  72          1HB       PRO  72  -8.905   3.735  -2.689
  487   1HG   PRO  72          2HG       PRO  72  -9.652   1.945  -4.676
  488   2HG   PRO  72          1HG       PRO  72  -9.295   3.676  -4.898
  489   1HD   PRO  72          2HD       PRO  72  -7.737   1.340  -5.692
  490   2HD   PRO  72          1HD       PRO  72  -7.585   3.033  -6.198
  491    H    ARG  73           H        ARG  73  -5.593   0.808  -3.457
  492    HA   ARG  73           HA       ARG  73  -5.019   0.276  -0.677
  493   1HB   ARG  73          2HB       ARG  73  -5.951  -1.930  -0.644
  494   2HB   ARG  73          1HB       ARG  73  -7.225  -0.849  -1.201
  495   1HG   ARG  73          2HG       ARG  73  -6.516  -1.471  -3.544
  496   2HG   ARG  73          1HG       ARG  73  -5.571  -2.760  -2.797
  497   1HD   ARG  73          2HD       ARG  73  -7.967  -3.130  -1.607
  498   2HD   ARG  73          1HD       ARG  73  -8.477  -2.500  -3.166
  499    HE   ARG  73           HE       ARG  73  -6.704  -4.850  -2.878
  500   1HH1  ARG  73          1HH1      ARG  73  -9.381  -3.176  -4.403
  501   2HH1  ARG  73          2HH1      ARG  73  -9.659  -4.427  -5.581
  502   1HH2  ARG  73          1HH2      ARG  73  -7.028  -6.473  -4.464
  503   2HH2  ARG  73          2HH2      ARG  73  -8.300  -6.284  -5.641
  504    H    ALA  74           H        ALA  74  -3.102  -0.666  -0.472
  505    HA   ALA  74           HA       ALA  74  -1.211  -0.564  -2.463
  506   1HB   ALA  74          1HB       ALA  74  -0.755  -0.505  -0.045
  507   2HB   ALA  74          2HB       ALA  74   0.287  -1.627  -0.917
  508   3HB   ALA  74          3HB       ALA  74  -1.066  -2.239   0.033
  509    H    ASP  75           H        ASP  75  -3.318  -3.252  -1.646
  510    HA   ASP  75           HA       ASP  75  -1.626  -5.164  -3.005
  511   1HB   ASP  75          2HB       ASP  75  -3.335  -6.822  -2.434
  512   2HB   ASP  75          1HB       ASP  75  -2.857  -5.885  -1.022
  513    H    LEU  76           H        LEU  76  -3.756  -2.882  -4.003
  514    HA   LEU  76           HA       LEU  76  -4.457  -4.361  -6.444
  515   1HB   LEU  76          2HB       LEU  76  -6.265  -3.101  -5.346
  516   2HB   LEU  76          1HB       LEU  76  -5.325  -1.629  -5.475
  517    HG   LEU  76           HG       LEU  76  -5.456  -1.786  -7.937
  518   1HD1  LEU  76          1HD1      LEU  76  -7.280  -4.116  -7.370
  519   2HD1  LEU  76          2HD1      LEU  76  -5.706  -4.185  -8.163
  520   3HD1  LEU  76          3HD1      LEU  76  -7.051  -3.351  -8.943
  521   1HD2  LEU  76          1HD2      LEU  76  -7.838  -1.203  -8.110
  522   2HD2  LEU  76          2HD2      LEU  76  -7.050  -0.422  -6.740
  523   3HD2  LEU  76          3HD2      LEU  76  -8.090  -1.820  -6.475
  524    H    ALA  77           H        ALA  77  -2.616  -1.730  -5.136
  525    HA   ALA  77           HA       ALA  77  -1.531  -0.837  -7.624
  526   1HB   ALA  77          1HB       ALA  77  -1.753   0.679  -5.717
  527   2HB   ALA  77          2HB       ALA  77  -0.066   0.525  -6.206
  528   3HB   ALA  77          3HB       ALA  77  -0.651  -0.330  -4.779
  529    H    THR  78           H        THR  78   0.838  -0.900  -7.972
  530    HA   THR  78           HA       THR  78   1.771  -3.627  -7.487
  531    HB   THR  78           HB       THR  78   3.257  -3.178  -9.428
  532    HG1  THR  78           1HG      THR  78   2.380  -1.151 -10.611
  533   1HG2  THR  78          1HG2      THR  78   1.406  -3.069 -11.107
  534   2HG2  THR  78          2HG2      THR  78   0.296  -2.687  -9.784
  535   3HG2  THR  78          3HG2      THR  78   1.131  -4.242  -9.822
  536    H    ARG  79           H        ARG  79   4.402  -3.505  -7.819
  537    HA   ARG  79           HA       ARG  79   5.464  -2.671  -5.399
  538   1HB   ARG  79          2HB       ARG  79   6.867  -3.063  -8.045
  539   2HB   ARG  79          1HB       ARG  79   7.692  -2.861  -6.509
  540   1HG   ARG  79          2HG       ARG  79   6.550  -4.909  -5.696
  541   2HG   ARG  79          1HG       ARG  79   5.898  -5.131  -7.321
  542   1HD   ARG  79          2HD       ARG  79   7.950  -6.457  -6.894
  543   2HD   ARG  79          1HD       ARG  79   8.109  -5.329  -8.243
  544    HE   ARG  79           HE       ARG  79   9.177  -4.759  -5.548
  545   1HH1  ARG  79          1HH1      ARG  79   9.449  -4.732  -9.030
  546   2HH1  ARG  79          2HH1      ARG  79  11.079  -4.120  -9.033
  547   1HH2  ARG  79          1HH2      ARG  79  11.335  -3.923  -5.551
  548   2HH2  ARG  79          2HH2      ARG  79  12.139  -3.665  -7.066
  549    H    GLU  80           H        GLU  80   5.749  -1.153  -8.574
  550    HA   GLU  80           HA       GLU  80   7.268   1.048  -7.753
  551   1HB   GLU  80          2HB       GLU  80   6.307   2.068  -9.935
  552   2HB   GLU  80          1HB       GLU  80   7.322   0.638 -10.030
  553   1HG   GLU  80          2HG       GLU  80   4.390   0.250  -9.858
  554   2HG   GLU  80          1HG       GLU  80   5.069   0.846 -11.373
  555    H    GLU  81           H        GLU  81   3.780   0.656  -8.077
  556    HA   GLU  81           HA       GLU  81   2.993   3.251  -7.389
  557   1HB   GLU  81          2HB       GLU  81   1.776   0.554  -7.370
  558   2HB   GLU  81          1HB       GLU  81   0.969   1.809  -6.445
  559   1HG   GLU  81          2HG       GLU  81   0.212   1.412  -8.826
  560   2HG   GLU  81          1HG       GLU  81   0.495   3.073  -8.327
  561    H    GLN  82           H        GLN  82   3.343   0.377  -5.280
  562    HA   GLN  82           HA       GLN  82   2.668   1.762  -2.908
  563   1HB   GLN  82          2HB       GLN  82   4.428  -0.674  -3.197
  564   2HB   GLN  82          1HB       GLN  82   3.702  -0.105  -1.703
  565   1HG   GLN  82          2HG       GLN  82   1.460  -0.428  -2.895
  566   2HG   GLN  82          1HG       GLN  82   2.383  -1.377  -4.066
  567   1HE2  GLN  82          1HE2      GLN  82   1.552  -3.353  -3.566
  568   2HE2  GLN  82          2HE2      GLN  82   1.771  -4.122  -2.025
  569    H    ILE  83           H        ILE  83   5.665   1.185  -4.592
  570    HA   ILE  83           HA       ILE  83   7.473   2.212  -2.731
  571    HB   ILE  83           HB       ILE  83   7.472   2.020  -5.724
  572   1HG1  ILE  83          2HG1      ILE  83   9.514   0.862  -3.869
  573   2HG1  ILE  83          1HG1      ILE  83   7.928   0.108  -3.980
  574   1HG2  ILE  83          1HG2      ILE  83   9.805   2.826  -5.732
  575   2HG2  ILE  83          2HG2      ILE  83   9.612   3.304  -4.046
  576   3HG2  ILE  83          3HG2      ILE  83   8.638   4.074  -5.297
  577   1HD1  ILE  83          1HD1      ILE  83   8.262  -0.179  -6.389
  578   2HD1  ILE  83          2HD1      ILE  83   9.507  -0.988  -5.440
  579   3HD1  ILE  83          3HD1      ILE  83   9.865   0.542  -6.241
  580    H    ALA  84           H        ALA  84   5.612   3.840  -5.279
  581    HA   ALA  84           HA       ALA  84   6.754   6.386  -4.987
  582   1HB   ALA  84          1HB       ALA  84   5.394   5.760  -6.915
  583   2HB   ALA  84          2HB       ALA  84   4.766   7.220  -6.151
  584   3HB   ALA  84          3HB       ALA  84   3.963   5.672  -5.890
  585    H    VAL  85           H        VAL  85   3.928   4.919  -3.481
  586    HA   VAL  85           HA       VAL  85   3.157   7.160  -1.939
  587    HB   VAL  85           HB       VAL  85   2.649   4.221  -1.521
  588   1HG1  VAL  85          1HG1      VAL  85   2.176   5.502   0.508
  589   2HG1  VAL  85          2HG1      VAL  85   0.673   4.953  -0.233
  590   3HG1  VAL  85          3HG1      VAL  85   1.188   6.629  -0.419
  591   1HG2  VAL  85          1HG2      VAL  85   0.571   4.575  -2.705
  592   2HG2  VAL  85          2HG2      VAL  85   1.929   5.071  -3.715
  593   3HG2  VAL  85          3HG2      VAL  85   0.945   6.286  -2.900
  594    H    ALA  86           H        ALA  86   4.972   4.198  -1.114
  595    HA   ALA  86           HA       ALA  86   5.440   4.804   1.583
  596   1HB   ALA  86          1HB       ALA  86   5.742   2.557   0.641
  597   2HB   ALA  86          2HB       ALA  86   7.194   3.105   1.476
  598   3HB   ALA  86          3HB       ALA  86   7.127   3.134  -0.285
  599    H    GLU  87           H        GLU  87   7.066   5.690  -1.357
  600    HA   GLU  87           HA       GLU  87   9.431   6.573  -0.023
  601   1HB   GLU  87          2HB       GLU  87  10.345   6.968  -2.072
  602   2HB   GLU  87          1HB       GLU  87   9.111   5.794  -2.495
  603   1HG   GLU  87          2HG       GLU  87   8.821   7.269  -4.138
  604   2HG   GLU  87          1HG       GLU  87   7.701   7.954  -2.960
  605    H    VAL  88           H        VAL  88   6.402   8.117  -0.955
  606    HA   VAL  88           HA       VAL  88   7.141  10.739  -0.221
  607    HB   VAL  88           HB       VAL  88   4.408   9.457   0.240
  608   1HG1  VAL  88          1HG1      VAL  88   4.780  11.497   1.534
  609   2HG1  VAL  88          2HG1      VAL  88   3.599  11.763   0.245
  610   3HG1  VAL  88          3HG1      VAL  88   5.251  12.358   0.065
  611   1HG2  VAL  88          1HG2      VAL  88   5.067   9.322  -2.112
  612   2HG2  VAL  88          2HG2      VAL  88   5.463  11.040  -2.120
  613   3HG2  VAL  88          3HG2      VAL  88   3.792  10.520  -1.893
  614    H    THR  89           H        THR  89   6.071   7.949   1.637
  615    HA   THR  89           HA       THR  89   5.785   9.374   4.074
  616    HB   THR  89           HB       THR  89   6.287   6.479   4.268
  617    HG1  THR  89           1HG      THR  89   4.269   7.577   2.581
  618   1HG2  THR  89          1HG2      THR  89   3.954   8.228   5.030
  619   2HG2  THR  89          2HG2      THR  89   5.353   7.901   6.049
  620   3HG2  THR  89          3HG2      THR  89   4.265   6.586   5.595
  621    H    ARG  90           H        ARG  90   8.343   7.398   2.670
  622    HA   ARG  90           HA       ARG  90   9.939   7.060   4.947
  623   1HB   ARG  90          2HB       ARG  90  11.718   6.454   3.435
  624   2HB   ARG  90          1HB       ARG  90  10.207   5.852   2.764
  625   1HG   ARG  90          2HG       ARG  90  10.130   7.560   1.146
  626   2HG   ARG  90          1HG       ARG  90  11.421   8.463   1.932
  627   1HD   ARG  90          2HD       ARG  90  13.028   6.805   1.330
  628   2HD   ARG  90          1HD       ARG  90  11.766   5.737   0.714
  629    HE   ARG  90           HE       ARG  90  11.485   8.059  -0.713
  630   1HH1  ARG  90          1HH1      ARG  90  14.101   5.800  -0.187
  631   2HH1  ARG  90          2HH1      ARG  90  14.800   6.038  -1.764
  632   1HH2  ARG  90          1HH2      ARG  90  12.353   8.364  -2.782
  633   2HH2  ARG  90          2HH2      ARG  90  13.793   7.497  -3.244
  634    H    LEU  91           H        LEU  91   9.641   9.713   2.712
  635    HA   LEU  91           HA       LEU  91  12.193  10.835   3.385
  636   1HB   LEU  91          2HB       LEU  91  11.596  12.680   1.907
  637   2HB   LEU  91          1HB       LEU  91  11.379  11.122   1.146
  638    HG   LEU  91           HG       LEU  91   8.860  11.448   1.831
  639   1HD1  LEU  91          1HD1      LEU  91   9.895  14.279   1.798
  640   2HD1  LEU  91          2HD1      LEU  91   9.147  13.446   3.161
  641   3HD1  LEU  91          3HD1      LEU  91   8.195  13.814   1.724
  642   1HD2  LEU  91          1HD2      LEU  91  10.152  12.997  -0.411
  643   2HD2  LEU  91          2HD2      LEU  91   8.456  12.519  -0.320
  644   3HD2  LEU  91          3HD2      LEU  91   9.714  11.288  -0.451
  645    H    ARG  92           H        ARG  92   9.022  11.117   4.623
  646    HA   ARG  92           HA       ARG  92   9.434  13.717   5.802
  647   1HB   ARG  92          2HB       ARG  92   7.199  11.898   6.556
  648   2HB   ARG  92          1HB       ARG  92   7.215  13.652   6.462
  649   1HG   ARG  92          2HG       ARG  92   6.872  13.666   4.185
  650   2HG   ARG  92          1HG       ARG  92   7.501  12.025   3.980
  651   1HD   ARG  92          2HD       ARG  92   4.836  12.914   5.003
  652   2HD   ARG  92          1HD       ARG  92   5.220  11.697   3.777
  653    HE   ARG  92           HE       ARG  92   6.273  10.504   5.830
  654   1HH1  ARG  92          1HH1      ARG  92   3.309  12.364   5.769
  655   2HH1  ARG  92          2HH1      ARG  92   2.590  11.528   7.119
  656   1HH2  ARG  92          1HH2      ARG  92   5.323   9.381   7.621
  657   2HH2  ARG  92          2HH2      ARG  92   3.731   9.818   8.161
  658    H    GLN  93           H        GLN  93   9.170  10.353   6.777
  659    HA   GLN  93           HA       GLN  93   9.438  11.162   9.560
  660   1HB   GLN  93          2HB       GLN  93   8.561   8.972  10.105
  661   2HB   GLN  93          1HB       GLN  93   7.540   9.753   8.896
  662   1HG   GLN  93          2HG       GLN  93   8.981   8.460   7.191
  663   2HG   GLN  93          1HG       GLN  93   9.426   7.463   8.575
  664   1HE2  GLN  93          1HE2      GLN  93   7.905   6.841   6.156
  665   2HE2  GLN  93          2HE2      GLN  93   6.388   6.222   6.717
  666    H    GLY  94           H        GLY  94  11.101   9.201   7.131
  667   1HA   GLY  94          2HA       GLY  94  13.451   8.946   7.154
  668   2HA   GLY  94          1HA       GLY  94  13.449   9.293   8.880
  669    H    TRP  95           H        TRP  95  11.309   7.056   7.277
  670    HA   TRP  95           HA       TRP  95  11.072   4.830   7.279
  671   1HB   TRP  95          2HB       TRP  95  13.969   4.720   8.130
  672   2HB   TRP  95          1HB       TRP  95  13.028   3.379   7.471
  673    HD1  TRP  95           HD       TRP  95  14.203   6.892   6.348
  674    HE1  TRP  95           1HE      TRP  95  14.648   6.820   3.825
  675    HE3  TRP  95           3HE      TRP  95  12.749   2.090   5.442
  676    HZ2  TRP  95           2HZ      TRP  95  14.395   4.958   1.714
  677    HZ3  TRP  95           3HZ      TRP  95  12.882   1.240   3.137
  678    HH2  TRP  95           HH       TRP  95  13.680   2.641   1.320
  679    H    GLY  96           H        GLY  96  10.845   6.612   9.658
  680   1HA   GLY  96          2HA       GLY  96  11.224   5.013  11.970
  681   2HA   GLY  96          1HA       GLY  96  10.167   6.411  11.845
  682    H    ALA  97           H        ALA  97   8.672   5.189   9.595
  683    HA   ALA  97           HA       ALA  97   6.772   3.703  11.128
  684   1HB   ALA  97          1HB       ALA  97   6.889   4.174   8.149
  685   2HB   ALA  97          2HB       ALA  97   6.045   5.181   9.327
  686   3HB   ALA  97          3HB       ALA  97   5.511   3.524   9.038
  687    H    TRP  98           H        TRP  98   9.377   2.925   8.946
  688    HA   TRP  98           HA       TRP  98   8.610   0.083   9.021
  689   1HB   TRP  98          2HB       TRP  98  10.626   1.539   7.289
  690   2HB   TRP  98          1HB       TRP  98  10.223  -0.171   7.167
  691    HD1  TRP  98           HD       TRP  98   7.698  -0.758   6.302
  692    HE1  TRP  98           1HE      TRP  98   6.154   0.517   4.690
  693    HE3  TRP  98           3HE      TRP  98   9.928   3.883   6.499
  694    HZ2  TRP  98           2HZ      TRP  98   5.918   3.121   3.619
  695    HZ3  TRP  98           3HZ      TRP  98   8.968   5.679   5.157
  696    HH2  TRP  98           HH       TRP  98   7.007   5.314   3.752
  697    HA   PRO  99           HA       PRO  99  11.684   0.177  12.266
  698   1HB   PRO  99          2HB       PRO  99  10.732  -2.544  12.856
  699   2HB   PRO  99          1HB       PRO  99  10.734  -1.105  13.869
  700   1HG   PRO  99          2HG       PRO  99   8.456  -2.030  12.851
  701   2HG   PRO  99          1HG       PRO  99   8.789  -0.287  12.958
  702   1HD   PRO  99          2HD       PRO  99   9.084  -2.096  10.568
  703   2HD   PRO  99          1HD       PRO  99   8.243  -0.529  10.685
  704    H    VAL 100           H        VAL 100  11.631  -3.300  11.659
  705    HA   VAL 100           HA       VAL 100  14.492  -3.260  11.645
  706    HB   VAL 100           HB       VAL 100  12.839  -5.074  12.540
  707   1HG1  VAL 100          1HG1      VAL 100  12.590  -7.006  11.071
  708   2HG1  VAL 100          2HG1      VAL 100  13.266  -6.067   9.740
  709   3HG1  VAL 100          3HG1      VAL 100  11.730  -5.590  10.464
  710   1HG2  VAL 100          1HG2      VAL 100  15.241  -5.165  12.822
  711   2HG2  VAL 100          2HG2      VAL 100  15.427  -5.789  11.183
  712   3HG2  VAL 100          3HG2      VAL 100  14.616  -6.762  12.410
  713    H    CYS 101           H        CYS 101  11.972  -3.316   9.368
  714    HA   CYS 101           HA       CYS 101  13.323  -4.508   7.180
  715   1HB   CYS 101          2HB       CYS 101  11.075  -2.501   7.018
  716   2HB   CYS 101          1HB       CYS 101  11.524  -3.703   5.800
  717    H    ALA 102           H        ALA 102  13.143  -1.194   8.339
  718    HA   ALA 102           HA       ALA 102  14.220   0.001   6.014
  719   1HB   ALA 102          1HB       ALA 102  13.051   1.285   7.748
  720   2HB   ALA 102          2HB       ALA 102  14.660   1.935   7.429
  721   3HB   ALA 102          3HB       ALA 102  14.371   0.962   8.871
  722    H    ALA 103           H        ALA 103  15.690  -1.131   9.036
  723    HA   ALA 103           HA       ALA 103  18.341  -0.449   8.393
  724   1HB   ALA 103          1HB       ALA 103  17.636  -0.943  10.671
  725   2HB   ALA 103          2HB       ALA 103  18.960  -2.007  10.194
  726   3HB   ALA 103          3HB       ALA 103  17.305  -2.615  10.220
  727    H    ARG 104           H        ARG 104  16.439  -3.355   7.855
  728    HA   ARG 104           HA       ARG 104  18.577  -4.900   6.800
  729   1HB   ARG 104          2HB       ARG 104  15.645  -5.186   7.084
  730   2HB   ARG 104          1HB       ARG 104  16.402  -6.148   5.827
  731   1HG   ARG 104          2HG       ARG 104  16.197  -7.422   7.867
  732   2HG   ARG 104          1HG       ARG 104  17.889  -7.151   7.478
  733   1HD   ARG 104          2HD       ARG 104  16.385  -5.421   9.424
  734   2HD   ARG 104          1HD       ARG 104  17.192  -6.908   9.913
  735    HE   ARG 104           HE       ARG 104  18.546  -4.529   8.818
  736   1HH1  ARG 104          1HH1      ARG 104  18.597  -7.493  10.682
  737   2HH1  ARG 104          2HH1      ARG 104  20.210  -7.235  11.287
  738   1HH2  ARG 104          1HH2      ARG 104  20.655  -4.156   9.652
  739   2HH2  ARG 104          2HH2      ARG 104  21.361  -5.323  10.735
  740    H    ALA 105           H        ALA 105  16.117  -2.820   5.331
  741    HA   ALA 105           HA       ALA 105  16.732  -3.711   2.643
  742   1HB   ALA 105          1HB       ALA 105  14.482  -3.046   3.236
  743   2HB   ALA 105          2HB       ALA 105  15.130  -2.003   1.968
  744   3HB   ALA 105          3HB       ALA 105  15.047  -1.423   3.632
  745    H    GLY 106           H        GLY 106  17.762  -1.119   4.770
  746   1HA   GLY 106          2HA       GLY 106  19.774   0.137   4.219
  747   2HA   GLY 106          1HA       GLY 106  19.293   0.063   2.530
  748    H    ALA 107           H        ALA 107  18.057   1.192   5.630
  749    HA   ALA 107           HA       ALA 107  16.268   3.104   4.752
  750   1HB   ALA 107          1HB       ALA 107  16.382   4.027   6.997
  751   2HB   ALA 107          2HB       ALA 107  17.858   3.113   7.310
  752   3HB   ALA 107          3HB       ALA 107  16.333   2.266   7.050
  753    H    ARG 108           H        ARG 108  16.371   5.370   4.696
  754    HA   ARG 108           HA       ARG 108  18.819   6.785   4.622
  755   1HB   ARG 108          2HB       ARG 108  18.582   7.183   2.045
  756   2HB   ARG 108          1HB       ARG 108  19.424   5.756   2.634
  757   1HG   ARG 108          2HG       ARG 108  17.350   4.447   2.357
  758   2HG   ARG 108          1HG       ARG 108  16.576   5.878   1.661
  759   1HD   ARG 108          2HD       ARG 108  18.954   4.384   0.570
  760   2HD   ARG 108          1HD       ARG 108  17.327   4.436  -0.108
  761    HE   ARG 108           HE       ARG 108  17.959   7.013  -0.162
  762   1HH1  ARG 108          1HH1      ARG 108  19.835   4.215  -1.093
  763   2HH1  ARG 108          2HH1      ARG 108  20.750   5.056  -2.303
  764   1HH2  ARG 108          1HH2      ARG 108  19.151   8.145  -1.737
  765   2HH2  ARG 108          2HH2      ARG 108  20.358   7.308  -2.675
  Start of MODEL   17
    1   1H    ASN   1          1HT       ASN   1  37.727   6.544 -45.194
    2   2H    ASN   1          2HT       ASN   1  39.398   6.817 -45.225
    3   3H    ASN   1          3HT       ASN   1  38.388   7.612 -46.329
    4    HA   ASN   1           HA       ASN   1  39.142   9.032 -44.482
    5   1HB   ASN   1          2HB       ASN   1  36.179   8.468 -44.614
    6   2HB   ASN   1          1HB       ASN   1  36.900   9.884 -43.869
    7   1HD2  ASN   1          1HD2      ASN   1  38.942  10.244 -45.908
    8   2HD2  ASN   1          2HD2      ASN   1  38.115  10.829 -47.316
    9    H    VAL   2           H        VAL   2  40.204   8.112 -42.825
   10    HA   VAL   2           HA       VAL   2  38.840   6.498 -40.855
   11    HB   VAL   2           HB       VAL   2  41.246   6.132 -41.443
   12   1HG1  VAL   2          1HG1      VAL   2  41.663   8.714 -39.944
   13   2HG1  VAL   2          2HG1      VAL   2  41.975   8.431 -41.658
   14   3HG1  VAL   2          3HG1      VAL   2  42.939   7.601 -40.436
   15   1HG2  VAL   2          1HG2      VAL   2  40.681   6.756 -38.549
   16   2HG2  VAL   2          2HG2      VAL   2  42.012   5.761 -39.144
   17   3HG2  VAL   2          3HG2      VAL   2  40.344   5.236 -39.379
   18    H    VAL   3           H        VAL   3  39.353   9.778 -41.468
   19    HA   VAL   3           HA       VAL   3  39.324  10.832 -38.896
   20    HB   VAL   3           HB       VAL   3  40.061  12.187 -40.721
   21   1HG1  VAL   3          1HG1      VAL   3  38.578  13.010 -42.471
   22   2HG1  VAL   3          2HG1      VAL   3  37.263  12.031 -41.824
   23   3HG1  VAL   3          3HG1      VAL   3  38.694  11.250 -42.499
   24   1HG2  VAL   3          1HG2      VAL   3  39.091  13.377 -38.837
   25   2HG2  VAL   3          2HG2      VAL   3  37.497  13.298 -39.588
   26   3HG2  VAL   3          3HG2      VAL   3  38.783  14.239 -40.343
   27    H    VAL   4           H        VAL   4  37.768   9.936 -37.605
   28    HA   VAL   4           HA       VAL   4  34.975  10.474 -38.320
   29    HB   VAL   4           HB       VAL   4  35.929   9.153 -35.793
   30   1HG1  VAL   4          1HG1      VAL   4  33.646   9.942 -35.748
   31   2HG1  VAL   4          2HG1      VAL   4  33.677   8.180 -35.786
   32   3HG1  VAL   4          3HG1      VAL   4  33.298   9.086 -37.249
   33   1HG2  VAL   4          1HG2      VAL   4  35.512   6.978 -36.870
   34   2HG2  VAL   4          2HG2      VAL   4  36.834   7.855 -37.639
   35   3HG2  VAL   4          3HG2      VAL   4  35.246   7.805 -38.405
   36    H    THR   5           H        THR   5  33.752  11.902 -37.162
   37    HA   THR   5           HA       THR   5  35.315  13.750 -35.510
   38    HB   THR   5           HB       THR   5  33.553  15.450 -36.300
   39    HG1  THR   5           1HG      THR   5  32.601  14.928 -38.315
   40   1HG2  THR   5          1HG2      THR   5  34.812  15.901 -38.375
   41   2HG2  THR   5          2HG2      THR   5  35.568  14.313 -38.242
   42   3HG2  THR   5          3HG2      THR   5  35.874  15.542 -37.015
   43    HA   PRO   6           HA       PRO   6  32.178  13.115 -32.349
   44   1HB   PRO   6          2HB       PRO   6  33.581  15.261 -30.950
   45   2HB   PRO   6          1HB       PRO   6  33.407  13.566 -30.486
   46   1HG   PRO   6          2HG       PRO   6  35.768  14.599 -31.250
   47   2HG   PRO   6          1HG       PRO   6  35.308  12.925 -31.616
   48   1HD   PRO   6          2HD       PRO   6  35.158  15.350 -33.380
   49   2HD   PRO   6          1HD       PRO   6  35.799  13.735 -33.758
   50    H    ALA   7           H        ALA   7  30.780  14.615 -31.203
   51    HA   ALA   7           HA       ALA   7  28.988  16.019 -31.399
   52   1HB   ALA   7          1HB       ALA   7  30.768  17.653 -30.895
   53   2HB   ALA   7          2HB       ALA   7  29.465  18.333 -31.869
   54   3HB   ALA   7          3HB       ALA   7  30.999  17.901 -32.625
   55    H    HIS   8           H        HIS   8  28.323  17.927 -33.369
   56    HA   HIS   8           HA       HIS   8  27.108  18.007 -35.298
   57   1HB   HIS   8          2HB       HIS   8  29.457  17.354 -36.194
   58   2HB   HIS   8          1HB       HIS   8  28.760  15.751 -36.380
   59    HD1  HIS   8           1HD      HIS   8  27.315  15.354 -38.451
   60    HD2  HIS   8           2HD      HIS   8  28.250  19.358 -37.828
   61    HE1  HIS   8           1HE      HIS   8  26.523  16.595 -40.502
   62    H    GLU   9           H        GLU   9  27.026  15.828 -33.129
   63    HA   GLU   9           HA       GLU   9  25.754  13.539 -34.130
   64   1HB   GLU   9          2HB       GLU   9  25.046  13.196 -31.777
   65   2HB   GLU   9          1HB       GLU   9  26.761  13.550 -31.949
   66   1HG   GLU   9          2HG       GLU   9  26.389  15.843 -31.271
   67   2HG   GLU   9          1HG       GLU   9  24.653  15.552 -31.175
   68    H    ALA  10           H        ALA  10  23.610  12.841 -33.808
   69    HA   ALA  10           HA       ALA  10  21.522  14.809 -33.450
   70   1HB   ALA  10          1HB       ALA  10  20.411  14.287 -35.558
   71   2HB   ALA  10          2HB       ALA  10  21.740  13.217 -36.005
   72   3HB   ALA  10          3HB       ALA  10  22.018  14.952 -35.854
   73    H    VAL  11           H        VAL  11  21.276  13.519 -31.594
   74    HA   VAL  11           HA       VAL  11  20.871  10.764 -31.560
   75    HB   VAL  11           HB       VAL  11  21.310  12.105 -29.544
   76   1HG1  VAL  11          1HG1      VAL  11  18.444  12.991 -29.818
   77   2HG1  VAL  11          2HG1      VAL  11  19.878  14.006 -29.974
   78   3HG1  VAL  11          3HG1      VAL  11  19.475  13.280 -28.418
   79   1HG2  VAL  11          1HG2      VAL  11  19.808  10.888 -28.027
   80   2HG2  VAL  11          2HG2      VAL  11  20.462   9.849 -29.294
   81   3HG2  VAL  11          3HG2      VAL  11  18.802  10.437 -29.403
   82    H    VAL  12           H        VAL  12  18.650  13.349 -32.297
   83    HA   VAL  12           HA       VAL  12  16.419  13.449 -32.582
   84    HB   VAL  12           HB       VAL  12  17.249  13.185 -34.751
   85   1HG1  VAL  12          1HG1      VAL  12  18.545  11.142 -34.467
   86   2HG1  VAL  12          2HG1      VAL  12  17.513  11.059 -35.898
   87   3HG1  VAL  12          3HG1      VAL  12  17.053  10.199 -34.429
   88   1HG2  VAL  12          1HG2      VAL  12  15.311  12.186 -35.906
   89   2HG2  VAL  12          2HG2      VAL  12  14.848  13.239 -34.566
   90   3HG2  VAL  12          3HG2      VAL  12  14.794  11.486 -34.370
   91    H    ARG  13           H        ARG  13  15.581  12.800 -30.714
   92    HA   ARG  13           HA       ARG  13  14.928  10.045 -30.252
   93   1HB   ARG  13          2HB       ARG  13  14.607  12.542 -28.607
   94   2HB   ARG  13          1HB       ARG  13  14.053  10.963 -28.103
   95   1HG   ARG  13          2HG       ARG  13  16.259  10.104 -28.010
   96   2HG   ARG  13          1HG       ARG  13  16.905  11.529 -28.825
   97   1HD   ARG  13          2HD       ARG  13  15.626  11.488 -26.096
   98   2HD   ARG  13          1HD       ARG  13  17.358  11.575 -26.421
   99    HE   ARG  13           HE       ARG  13  15.708  13.663 -27.602
  100   1HH1  ARG  13          1HH1      ARG  13  17.904  12.693 -25.045
  101   2HH1  ARG  13          2HH1      ARG  13  18.239  14.325 -24.549
  102   1HH2  ARG  13          1HH2      ARG  13  16.135  15.798 -26.938
  103   2HH2  ARG  13          2HH2      ARG  13  17.238  16.092 -25.624
  104    H    VAL  14           H        VAL  14  13.208   9.299 -31.122
  105    HA   VAL  14           HA       VAL  14  10.864  10.946 -31.609
  106    HB   VAL  14           HB       VAL  14  11.128   8.078 -32.425
  107   1HG1  VAL  14          1HG1      VAL  14   9.690   8.771 -34.290
  108   2HG1  VAL  14          2HG1      VAL  14   9.677  10.414 -33.650
  109   3HG1  VAL  14          3HG1      VAL  14   8.957   9.099 -32.719
  110   1HG2  VAL  14          1HG2      VAL  14  12.120   8.771 -34.563
  111   2HG2  VAL  14          2HG2      VAL  14  13.181   9.117 -33.197
  112   3HG2  VAL  14          3HG2      VAL  14  12.260  10.418 -33.949
  113    H    GLY  15           H        GLY  15   8.808   9.990 -31.114
  114   1HA   GLY  15          2HA       GLY  15   7.714   8.119 -29.852
  115   2HA   GLY  15          1HA       GLY  15   8.863   8.501 -28.581
  116    H    THR  16           H        THR  16   5.929   9.399 -30.159
  117    HA   THR  16           HA       THR  16   5.668  11.919 -28.845
  118    HB   THR  16           HB       THR  16   3.649  10.337 -30.427
  119    HG1  THR  16           1HG      THR  16   5.640  12.233 -31.169
  120   1HG2  THR  16          1HG2      THR  16   3.771  13.272 -29.747
  121   2HG2  THR  16          2HG2      THR  16   2.650  12.099 -29.062
  122   3HG2  THR  16          3HG2      THR  16   2.565  12.499 -30.775
  123    H    LYS  17           H        LYS  17   4.554   8.683 -28.382
  124    HA   LYS  17           HA       LYS  17   2.976   9.548 -26.054
  125   1HB   LYS  17          2HB       LYS  17   2.669   6.989 -27.637
  126   2HB   LYS  17          1HB       LYS  17   1.653   7.515 -26.304
  127   1HG   LYS  17          2HG       LYS  17   0.354   8.094 -28.091
  128   2HG   LYS  17          1HG       LYS  17   1.242   9.595 -27.825
  129   1HD   LYS  17          2HD       LYS  17   1.210   9.084 -30.185
  130   2HD   LYS  17          1HD       LYS  17   2.854   8.918 -29.567
  131   1HE   LYS  17          2HE       LYS  17   2.547   6.492 -29.426
  132   2HE   LYS  17          1HE       LYS  17   0.907   6.663 -30.050
  133   1HZ   LYS  17          1HZ       LYS  17   3.437   7.288 -31.474
  134   2HZ   LYS  17          2HZ       LYS  17   1.899   7.672 -32.071
  135   3HZ   LYS  17          3HZ       LYS  17   2.335   6.047 -31.840
  136    HA   PRO  18           HA       PRO  18   6.198   7.109 -24.013
  137   1HB   PRO  18          2HB       PRO  18   6.157   8.939 -21.861
  138   2HB   PRO  18          1HB       PRO  18   7.377   8.812 -23.128
  139   1HG   PRO  18          2HG       PRO  18   5.660  10.957 -22.758
  140   2HG   PRO  18          1HG       PRO  18   6.555  10.597 -24.241
  141   1HD   PRO  18          2HD       PRO  18   3.704  10.022 -23.556
  142   2HD   PRO  18          1HD       PRO  18   4.414  10.524 -25.108
  143    H    GLY  19           H        GLY  19   6.272   6.325 -21.782
  144   1HA   GLY  19          2HA       GLY  19   5.292   5.624 -19.787
  145   2HA   GLY  19          1HA       GLY  19   3.764   6.331 -20.299
  146    H    THR  20           H        THR  20   5.694   4.274 -22.240
  147    HA   THR  20           HA       THR  20   3.655   2.342 -22.674
  148    HB   THR  20           HB       THR  20   6.623   2.121 -23.227
  149    HG1  THR  20           1HG      THR  20   6.263   3.218 -25.070
  150   1HG2  THR  20          1HG2      THR  20   5.426   0.012 -23.408
  151   2HG2  THR  20          2HG2      THR  20   5.919   0.587 -25.001
  152   3HG2  THR  20          3HG2      THR  20   4.243   0.760 -24.480
  153    H    GLU  21           H        GLU  21   6.290   2.729 -20.503
  154    HA   GLU  21           HA       GLU  21   5.569   0.349 -19.020
  155   1HB   GLU  21          2HB       GLU  21   8.404   1.139 -19.743
  156   2HB   GLU  21          1HB       GLU  21   7.954  -0.178 -18.669
  157   1HG   GLU  21          2HG       GLU  21   7.059  -1.448 -20.447
  158   2HG   GLU  21          1HG       GLU  21   7.111  -0.069 -21.546
  159    H    VAL  22           H        VAL  22   5.738   0.692 -16.831
  160    HA   VAL  22           HA       VAL  22   5.916   3.407 -15.945
  161    HB   VAL  22           HB       VAL  22   5.833   0.902 -14.247
  162   1HG1  VAL  22          1HG1      VAL  22   5.044   3.748 -13.633
  163   2HG1  VAL  22          2HG1      VAL  22   6.477   2.919 -13.027
  164   3HG1  VAL  22          3HG1      VAL  22   4.871   2.371 -12.548
  165   1HG2  VAL  22          1HG2      VAL  22   3.418   1.181 -14.203
  166   2HG2  VAL  22          2HG2      VAL  22   3.986   0.957 -15.860
  167   3HG2  VAL  22          3HG2      VAL  22   3.543   2.566 -15.289
  168    HA   PRO  23           HA       PRO  23  10.298   3.664 -15.811
  169   1HB   PRO  23          2HB       PRO  23   9.785   5.588 -13.603
  170   2HB   PRO  23          1HB       PRO  23  10.726   5.797 -15.083
  171   1HG   PRO  23          2HG       PRO  23   8.302   6.886 -14.821
  172   2HG   PRO  23          1HG       PRO  23   8.855   6.227 -16.372
  173   1HD   PRO  23          2HD       PRO  23   6.929   5.114 -14.406
  174   2HD   PRO  23          1HD       PRO  23   6.941   4.986 -16.173
  175    HA   PRO  24           HA       PRO  24  11.345   0.723 -12.668
  176   1HB   PRO  24          2HB       PRO  24  14.086   1.198 -12.866
  177   2HB   PRO  24          1HB       PRO  24  13.167   0.036 -13.829
  178   1HG   PRO  24          2HG       PRO  24  13.983   2.832 -14.503
  179   2HG   PRO  24          1HG       PRO  24  13.966   1.386 -15.534
  180   1HD   PRO  24          2HD       PRO  24  12.032   3.179 -15.760
  181   2HD   PRO  24          1HD       PRO  24  11.644   1.446 -15.773
  182    H    VAL  25           H        VAL  25  11.756   0.778 -10.585
  183    HA   VAL  25           HA       VAL  25  12.087   3.367  -9.336
  184    HB   VAL  25           HB       VAL  25  10.285   1.871  -8.573
  185   1HG1  VAL  25          1HG1      VAL  25  11.389  -0.272  -8.935
  186   2HG1  VAL  25          2HG1      VAL  25  10.776  -0.129  -7.286
  187   3HG1  VAL  25          3HG1      VAL  25  12.500   0.071  -7.607
  188   1HG2  VAL  25          1HG2      VAL  25  12.410   2.416  -6.525
  189   2HG2  VAL  25          2HG2      VAL  25  10.715   2.099  -6.179
  190   3HG2  VAL  25          3HG2      VAL  25  11.177   3.545  -7.076
  191    H    ILE  26           H        ILE  26  13.895   4.062  -8.437
  192    HA   ILE  26           HA       ILE  26  16.253   2.393  -8.469
  193    HB   ILE  26           HB       ILE  26  16.003   5.249  -7.526
  194   1HG1  ILE  26          2HG1      ILE  26  15.235   5.052  -9.845
  195   2HG1  ILE  26          1HG1      ILE  26  16.787   5.880  -9.779
  196   1HG2  ILE  26          1HG2      ILE  26  18.028   4.140  -6.762
  197   2HG2  ILE  26          2HG2      ILE  26  18.408   5.356  -7.981
  198   3HG2  ILE  26          3HG2      ILE  26  18.398   3.646  -8.414
  199   1HD1  ILE  26          1HD1      ILE  26  17.907   3.796 -10.432
  200   2HD1  ILE  26          2HD1      ILE  26  16.723   4.328 -11.629
  201   3HD1  ILE  26          3HD1      ILE  26  16.335   3.000 -10.536
  202    H    ASP  27           H        ASP  27  13.939   3.395  -6.127
  203    HA   ASP  27           HA       ASP  27  15.743   2.760  -3.912
  204   1HB   ASP  27          2HB       ASP  27  13.161   4.304  -3.720
  205   2HB   ASP  27          1HB       ASP  27  14.438   4.183  -2.518
  206    H    GLY  28           H        GLY  28  13.708   1.302  -5.751
  207   1HA   GLY  28          2HA       GLY  28  11.691   0.420  -3.888
  208   2HA   GLY  28          1HA       GLY  28  11.877  -0.111  -5.555
  209    H    SER  29           H        SER  29  14.834  -0.208  -4.222
  210    HA   SER  29           HA       SER  29  14.790  -3.058  -3.791
  211   1HB   SER  29          2HB       SER  29  16.767  -1.795  -4.685
  212   2HB   SER  29          1HB       SER  29  16.967  -1.115  -3.073
  213    HG   SER  29           HG       SER  29  18.289  -2.872  -3.115
  214    H    ILE  30           H        ILE  30  14.916  -0.162  -1.877
  215    HA   ILE  30           HA       ILE  30  15.117  -1.482   0.654
  216    HB   ILE  30           HB       ILE  30  13.748   1.075   0.857
  217   1HG1  ILE  30          2HG1      ILE  30  14.937   1.539  -1.299
  218   2HG1  ILE  30          1HG1      ILE  30  15.454   2.566   0.028
  219   1HG2  ILE  30          1HG2      ILE  30  15.614   1.608   2.322
  220   2HG2  ILE  30          2HG2      ILE  30  16.442   0.144   1.790
  221   3HG2  ILE  30          3HG2      ILE  30  14.919   0.025   2.671
  222   1HD1  ILE  30          1HD1      ILE  30  16.940   0.147  -0.961
  223   2HD1  ILE  30          2HD1      ILE  30  17.471   1.264   0.296
  224   3HD1  ILE  30          3HD1      ILE  30  17.318   1.819  -1.375
  225    H    TRP  31           H        TRP  31  12.659  -0.361  -1.501
  226    HA   TRP  31           HA       TRP  31  10.508  -0.721   0.336
  227   1HB   TRP  31          2HB       TRP  31  10.583  -0.149  -2.641
  228   2HB   TRP  31          1HB       TRP  31   9.089  -0.298  -1.708
  229    HD1  TRP  31           HD       TRP  31  10.921   2.414  -3.009
  230    HE1  TRP  31           1HE      TRP  31  10.842   4.516  -1.478
  231    HE3  TRP  31           3HE      TRP  31   9.419   0.209   1.308
  232    HZ2  TRP  31           2HZ      TRP  31  10.241   5.105   1.186
  233    HZ3  TRP  31           3HZ      TRP  31   9.127   1.589   3.321
  234    HH2  TRP  31           HH       TRP  31   9.534   3.993   3.258
  235    H    ASP  32           H        ASP  32  11.932  -2.596  -2.278
  236    HA   ASP  32           HA       ASP  32   9.940  -4.641  -2.066
  237   1HB   ASP  32          2HB       ASP  32  10.950  -4.274  -4.198
  238   2HB   ASP  32          1HB       ASP  32  12.576  -4.495  -3.527
  239    H    ALA  33           H        ALA  33  13.204  -4.093  -0.732
  240    HA   ALA  33           HA       ALA  33  13.423  -6.696   0.348
  241   1HB   ALA  33          1HB       ALA  33  15.372  -5.262   0.090
  242   2HB   ALA  33          2HB       ALA  33  15.192  -5.790   1.765
  243   3HB   ALA  33          3HB       ALA  33  14.724  -4.154   1.300
  244    H    ILE  34           H        ILE  34  12.044  -3.675   1.573
  245    HA   ILE  34           HA       ILE  34  11.373  -4.677   4.144
  246    HB   ILE  34           HB       ILE  34  10.141  -2.480   2.498
  247   1HG1  ILE  34          2HG1      ILE  34  11.900  -2.399   4.962
  248   2HG1  ILE  34          1HG1      ILE  34  12.465  -2.139   3.316
  249   1HG2  ILE  34          1HG2      ILE  34   9.560  -3.207   5.368
  250   2HG2  ILE  34          2HG2      ILE  34   8.449  -3.372   4.009
  251   3HG2  ILE  34          3HG2      ILE  34   8.968  -1.770   4.535
  252   1HD1  ILE  34          1HD1      ILE  34  11.038  -0.161   3.150
  253   2HD1  ILE  34          2HD1      ILE  34  12.186  -0.040   4.482
  254   3HD1  ILE  34          3HD1      ILE  34  10.496  -0.422   4.807
  255    H    ALA  35           H        ALA  35   9.537  -4.461   1.103
  256    HA   ALA  35           HA       ALA  35   7.190  -5.705   1.956
  257   1HB   ALA  35          1HB       ALA  35   6.813  -6.239  -0.398
  258   2HB   ALA  35          2HB       ALA  35   8.497  -5.857  -0.755
  259   3HB   ALA  35          3HB       ALA  35   7.405  -4.588  -0.202
  260    H    GLY  36           H        GLY  36  10.271  -7.018   0.973
  261   1HA   GLY  36          2HA       GLY  36   9.354  -9.764   0.966
  262   2HA   GLY  36          1HA       GLY  36  11.013  -9.214   0.787
  263    H    CYS  37           H        CYS  37  10.190  -7.567   3.346
  264    HA   CYS  37           HA       CYS  37  11.262  -9.587   5.152
  265   1HB   CYS  37          2HB       CYS  37  12.514  -7.518   5.022
  266   2HB   CYS  37          1HB       CYS  37  11.065  -6.584   5.375
  267    H    GLU  38           H        GLU  38   8.655  -7.158   5.038
  268    HA   GLU  38           HA       GLU  38   7.589  -8.206   7.533
  269   1HB   GLU  38          2HB       GLU  38   6.547  -5.934   5.831
  270   2HB   GLU  38          1HB       GLU  38   6.017  -6.348   7.458
  271   1HG   GLU  38          2HG       GLU  38   8.558  -6.027   8.015
  272   2HG   GLU  38          1HG       GLU  38   8.531  -5.053   6.549
  273    H    ALA  39           H        ALA  39   6.927  -8.205   4.117
  274    HA   ALA  39           HA       ALA  39   4.407  -9.579   4.621
  275   1HB   ALA  39          1HB       ALA  39   3.814  -9.104   2.317
  276   2HB   ALA  39          2HB       ALA  39   5.402  -8.383   2.054
  277   3HB   ALA  39          3HB       ALA  39   4.266  -7.629   3.173
  278    H    GLY  40           H        GLY  40   7.577 -10.268   3.890
  279   1HA   GLY  40          2HA       GLY  40   8.570 -12.319   3.435
  280   2HA   GLY  40          1HA       GLY  40   6.961 -13.017   3.261
  281    H    GLY  41           H        GLY  41   7.296 -10.174   1.608
  282   1HA   GLY  41          2HA       GLY  41   7.709  -9.625  -0.571
  283   2HA   GLY  41          1HA       GLY  41   8.230 -11.282  -0.897
  284    H    ASN  42           H        ASN  42   5.284  -9.561   0.112
  285    HA   ASN  42           HA       ASN  42   3.778 -10.999  -1.932
  286   1HB   ASN  42          2HB       ASN  42   3.753 -11.965   0.596
  287   2HB   ASN  42          1HB       ASN  42   2.464 -10.772   0.716
  288   1HD2  ASN  42          1HD2      ASN  42   0.567 -11.076  -0.476
  289   2HD2  ASN  42          2HD2      ASN  42   0.181 -12.594  -1.211
  290    H    TRP  43           H        TRP  43   3.571  -9.069  -3.019
  291    HA   TRP  43           HA       TRP  43   2.770  -6.643  -1.708
  292   1HB   TRP  43          2HB       TRP  43   2.857  -7.331  -4.647
  293   2HB   TRP  43          1HB       TRP  43   2.693  -5.713  -3.976
  294    HD1  TRP  43           HD       TRP  43   5.259  -8.604  -4.028
  295    HE1  TRP  43           1HE      TRP  43   7.629  -7.552  -3.962
  296    HE3  TRP  43           3HE      TRP  43   3.955  -3.724  -3.446
  297    HZ2  TRP  43           2HZ      TRP  43   8.778  -4.961  -3.665
  298    HZ3  TRP  43           3HZ      TRP  43   5.691  -2.008  -3.281
  299    HH2  TRP  43           HH       TRP  43   8.077  -2.638  -3.407
  300    H    ALA  44           H        ALA  44   1.201  -9.366  -2.624
  301    HA   ALA  44           HA       ALA  44  -1.359  -8.010  -3.137
  302   1HB   ALA  44          1HB       ALA  44  -0.662  -9.662  -4.799
  303   2HB   ALA  44          2HB       ALA  44  -2.150 -10.150  -3.985
  304   3HB   ALA  44          3HB       ALA  44  -0.615 -10.901  -3.545
  305    H    ILE  45           H        ILE  45   0.186  -8.810  -0.498
  306    HA   ILE  45           HA       ILE  45  -1.561 -10.631   0.793
  307    HB   ILE  45           HB       ILE  45   0.934 -10.201   1.270
  308   1HG1  ILE  45          2HG1      ILE  45  -1.008 -10.347   3.575
  309   2HG1  ILE  45          1HG1      ILE  45  -0.533 -11.702   2.558
  310   1HG2  ILE  45          1HG2      ILE  45   1.398  -8.585   3.054
  311   2HG2  ILE  45          2HG2      ILE  45  -0.265  -8.005   2.958
  312   3HG2  ILE  45          3HG2      ILE  45   0.822  -7.795   1.584
  313   1HD1  ILE  45          1HD1      ILE  45   0.680 -11.769   4.634
  314   2HD1  ILE  45          2HD1      ILE  45   1.252 -10.120   4.389
  315   3HD1  ILE  45          3HD1      ILE  45   1.795 -11.408   3.314
  316    H    ASN  46           H        ASN  46  -3.123 -10.212   2.309
  317    HA   ASN  46           HA       ASN  46  -3.713  -7.465   3.066
  318   1HB   ASN  46          2HB       ASN  46  -4.958  -7.956   0.892
  319   2HB   ASN  46          1HB       ASN  46  -5.885  -9.150   1.799
  320   1HD2  ASN  46          1HD2      ASN  46  -5.327  -5.801   1.211
  321   2HD2  ASN  46          2HD2      ASN  46  -6.657  -5.201   2.137
  322    H    THR  47           H        THR  47  -3.167  -8.130   5.097
  323    HA   THR  47           HA       THR  47  -4.328 -10.383   6.370
  324    HB   THR  47           HB       THR  47  -3.416  -9.142   8.459
  325    HG1  THR  47           1HG      THR  47  -2.047  -7.434   8.005
  326   1HG2  THR  47          1HG2      THR  47  -1.556  -9.946   6.214
  327   2HG2  THR  47          2HG2      THR  47  -2.277 -11.037   7.398
  328   3HG2  THR  47          3HG2      THR  47  -1.114  -9.814   7.915
  329    H    GLY  48           H        GLY  48  -5.269  -7.086   5.919
  330   1HA   GLY  48          2HA       GLY  48  -7.511  -6.363   6.158
  331   2HA   GLY  48          1HA       GLY  48  -7.759  -7.624   7.360
  332    H    ASN  49           H        ASN  49  -4.859  -5.840   7.603
  333    HA   ASN  49           HA       ASN  49  -5.659  -4.916  10.217
  334   1HB   ASN  49          2HB       ASN  49  -3.063  -4.423   8.743
  335   2HB   ASN  49          1HB       ASN  49  -3.352  -4.118  10.448
  336   1HD2  ASN  49          1HD2      ASN  49  -4.886  -6.595  10.801
  337   2HD2  ASN  49          2HD2      ASN  49  -3.712  -7.872  10.785
  338    H    GLY  50           H        GLY  50  -6.442  -3.706   7.384
  339   1HA   GLY  50          2HA       GLY  50  -7.044  -1.554   6.710
  340   2HA   GLY  50          1HA       GLY  50  -6.273  -0.915   8.164
  341    H    TYR  51           H        TYR  51  -4.142  -2.994   7.065
  342    HA   TYR  51           HA       TYR  51  -2.678  -1.064   5.416
  343   1HB   TYR  51          2HB       TYR  51  -1.481  -3.434   6.875
  344   2HB   TYR  51          1HB       TYR  51  -0.628  -2.096   6.143
  345    HD1  TYR  51           1HD      TYR  51  -3.356  -0.727   7.877
  346    HD2  TYR  51           2HD      TYR  51   0.464  -2.483   8.521
  347    HE1  TYR  51           1HE      TYR  51  -3.239   0.338  10.093
  348    HE2  TYR  51           2HE      TYR  51   0.589  -1.415  10.733
  349    HH   TYR  51           HH       TYR  51  -2.066  -0.104  12.277
  350    H    TYR  52           H        TYR  52  -1.406  -2.100   3.636
  351    HA   TYR  52           HA       TYR  52  -2.876  -4.444   2.640
  352   1HB   TYR  52          2HB       TYR  52  -2.307  -1.973   1.015
  353   2HB   TYR  52          1HB       TYR  52  -3.159  -3.414   0.459
  354    HD1  TYR  52           1HD      TYR  52  -3.309  -0.522   2.719
  355    HD2  TYR  52           2HD      TYR  52  -5.460  -3.732   0.970
  356    HE1  TYR  52           1HE      TYR  52  -5.397   0.472   3.515
  357    HE2  TYR  52           2HE      TYR  52  -7.578  -2.759   1.763
  358    HH   TYR  52           HH       TYR  52  -7.833   0.398   2.894
  359    H    GLY  53           H        GLY  53  -1.920  -5.157   0.469
  360   1HA   GLY  53          2HA       GLY  53   0.338  -6.546   1.070
  361   2HA   GLY  53          1HA       GLY  53  -0.225  -6.266  -0.562
  362    H    GLY  54           H        GLY  54   2.429  -6.619   0.381
  363   1HA   GLY  54          2HA       GLY  54   4.330  -5.800  -0.752
  364   2HA   GLY  54          1HA       GLY  54   3.571  -4.215  -0.838
  365    H    VAL  55           H        VAL  55   4.203  -2.733   0.567
  366    HA   VAL  55           HA       VAL  55   6.064  -3.459   2.667
  367    HB   VAL  55           HB       VAL  55   5.994  -0.910   3.092
  368   1HG1  VAL  55          1HG1      VAL  55   7.867  -2.073   2.066
  369   2HG1  VAL  55          2HG1      VAL  55   7.582  -0.527   1.262
  370   3HG1  VAL  55          3HG1      VAL  55   7.048  -2.026   0.503
  371   1HG2  VAL  55          1HG2      VAL  55   5.266   0.466   1.276
  372   2HG2  VAL  55          2HG2      VAL  55   3.917  -0.556   1.777
  373   3HG2  VAL  55          3HG2      VAL  55   4.831  -0.950   0.321
  374    H    GLN  56           H        GLN  56   2.824  -3.235   2.358
  375    HA   GLN  56           HA       GLN  56   1.100  -3.533   3.766
  376   1HB   GLN  56          2HB       GLN  56   2.750  -5.366   4.391
  377   2HB   GLN  56          1HB       GLN  56   3.120  -4.400   5.813
  378   1HG   GLN  56          2HG       GLN  56   0.920  -4.616   6.647
  379   2HG   GLN  56          1HG       GLN  56   0.333  -5.281   5.122
  380   1HE2  GLN  56          1HE2      GLN  56   2.696  -6.943   4.789
  381   2HE2  GLN  56          2HE2      GLN  56   2.513  -8.268   5.889
  382    H    PHE  57           H        PHE  57   1.633  -0.859   3.751
  383    HA   PHE  57           HA       PHE  57   1.266  -0.237   6.587
  384   1HB   PHE  57          2HB       PHE  57   1.850   2.054   6.170
  385   2HB   PHE  57          1HB       PHE  57   3.143   0.981   5.677
  386    HD1  PHE  57           1HD      PHE  57   2.787   0.271   3.000
  387    HD2  PHE  57           2HD      PHE  57   1.623   3.912   4.887
  388    HE1  PHE  57           1HE      PHE  57   2.976   1.446   0.848
  389    HE2  PHE  57           2HE      PHE  57   1.803   5.081   2.734
  390    HZ   PHE  57           HZ       PHE  57   2.500   3.856   0.707
  391    H    ASP  58           H        ASP  58  -0.088   2.008   6.708
  392    HA   ASP  58           HA       ASP  58  -2.628   0.704   6.440
  393   1HB   ASP  58          2HB       ASP  58  -3.443   2.366   7.979
  394   2HB   ASP  58          1HB       ASP  58  -1.897   1.749   8.545
  395    H    GLN  59           H        GLN  59  -4.541   1.647   5.830
  396    HA   GLN  59           HA       GLN  59  -4.707   2.718   3.292
  397   1HB   GLN  59          2HB       GLN  59  -6.501   1.476   4.372
  398   2HB   GLN  59          1HB       GLN  59  -6.658   2.713   5.597
  399   1HG   GLN  59          2HG       GLN  59  -8.432   3.108   4.194
  400   2HG   GLN  59          1HG       GLN  59  -7.229   4.286   3.687
  401   1HE2  GLN  59          1HE2      GLN  59  -5.640   2.295   2.204
  402   2HE2  GLN  59          2HE2      GLN  59  -6.542   1.948   0.762
  403    H    GLY  60           H        GLY  60  -4.710   4.304   6.421
  404   1HA   GLY  60          2HA       GLY  60  -5.745   6.755   5.559
  405   2HA   GLY  60          1HA       GLY  60  -4.920   6.478   7.080
  406    H    THR  61           H        THR  61  -2.455   5.747   6.371
  407    HA   THR  61           HA       THR  61  -1.186   8.119   5.547
  408    HB   THR  61           HB       THR  61  -0.116   5.334   5.686
  409    HG1  THR  61           1HG      THR  61  -0.322   5.627   7.752
  410   1HG2  THR  61          1HG2      THR  61   1.355   7.969   5.727
  411   2HG2  THR  61          2HG2      THR  61   1.339   6.824   4.383
  412   3HG2  THR  61          3HG2      THR  61   2.087   6.378   5.918
  413    H    TRP  62           H        TRP  62  -1.887   5.092   3.933
  414    HA   TRP  62           HA       TRP  62  -0.621   5.487   1.500
  415   1HB   TRP  62          2HB       TRP  62  -1.619   3.367   2.170
  416   2HB   TRP  62          1HB       TRP  62  -3.217   4.108   2.188
  417    HD1  TRP  62           HD       TRP  62  -4.409   4.514  -0.113
  418    HE1  TRP  62           1HE      TRP  62  -4.034   3.522  -2.466
  419    HE3  TRP  62           3HE      TRP  62   0.217   2.499   0.598
  420    HZ2  TRP  62           2HZ      TRP  62  -2.056   2.093  -3.855
  421    HZ3  TRP  62           3HZ      TRP  62   1.296   1.323  -1.266
  422    HH2  TRP  62           HH       TRP  62   0.210   1.099  -3.437
  423    H    GLU  63           H        GLU  63  -3.887   6.298   2.525
  424    HA   GLU  63           HA       GLU  63  -4.699   7.491   0.099
  425   1HB   GLU  63          2HB       GLU  63  -6.391   6.715   1.501
  426   2HB   GLU  63          1HB       GLU  63  -5.716   7.496   2.920
  427   1HG   GLU  63          2HG       GLU  63  -6.322   9.694   1.871
  428   2HG   GLU  63          1HG       GLU  63  -7.180   8.781   0.630
  429    H    ALA  64           H        ALA  64  -3.200   8.683   3.026
  430    HA   ALA  64           HA       ALA  64  -3.628  11.447   2.608
  431   1HB   ALA  64          1HB       ALA  64  -1.885  11.781   4.286
  432   2HB   ALA  64          2HB       ALA  64  -1.436  10.080   4.166
  433   3HB   ALA  64          3HB       ALA  64  -3.024  10.533   4.788
  434    H    ASN  65           H        ASN  65  -0.939   9.294   1.755
  435    HA   ASN  65           HA       ASN  65   0.493  11.435   0.467
  436   1HB   ASN  65          2HB       ASN  65   1.020   8.458   0.323
  437   2HB   ASN  65          1HB       ASN  65   2.140   9.747  -0.104
  438   1HD2  ASN  65          1HD2      ASN  65   1.289  11.395   2.196
  439   2HD2  ASN  65          2HD2      ASN  65   2.021  10.658   3.587
  440    H    GLY  66           H        GLY  66  -1.957   9.194  -0.357
  441   1HA   GLY  66          2HA       GLY  66  -3.410   9.724  -2.150
  442   2HA   GLY  66          1HA       GLY  66  -2.066  10.485  -2.984
  443    H    GLY  67           H        GLY  67  -2.406   7.198  -1.593
  444   1HA   GLY  67          2HA       GLY  67  -1.201   6.103  -3.971
  445   2HA   GLY  67          1HA       GLY  67  -1.722   5.203  -2.548
  446    H    LEU  68           H        LEU  68  -4.321   6.673  -2.712
  447    HA   LEU  68           HA       LEU  68  -5.845   4.659  -3.781
  448   1HB   LEU  68          2HB       LEU  68  -6.736   7.522  -3.666
  449   2HB   LEU  68          1HB       LEU  68  -7.731   6.091  -3.506
  450    HG   LEU  68           HG       LEU  68  -5.788   7.193  -1.476
  451   1HD1  LEU  68          1HD1      LEU  68  -7.833   7.417  -0.125
  452   2HD1  LEU  68          2HD1      LEU  68  -8.782   6.873  -1.508
  453   3HD1  LEU  68          3HD1      LEU  68  -7.881   8.386  -1.597
  454   1HD2  LEU  68          1HD2      LEU  68  -7.444   4.680  -1.337
  455   2HD2  LEU  68          2HD2      LEU  68  -6.491   5.374  -0.024
  456   3HD2  LEU  68          3HD2      LEU  68  -5.685   4.763  -1.470
  457    H    ARG  69           H        ARG  69  -4.283   7.276  -5.299
  458    HA   ARG  69           HA       ARG  69  -5.996   7.513  -7.550
  459   1HB   ARG  69          2HB       ARG  69  -4.507   9.139  -8.324
  460   2HB   ARG  69          1HB       ARG  69  -4.395   9.270  -6.575
  461   1HG   ARG  69          2HG       ARG  69  -2.390   7.761  -6.702
  462   2HG   ARG  69          1HG       ARG  69  -2.448   7.983  -8.453
  463   1HD   ARG  69          2HD       ARG  69  -1.945  10.040  -6.323
  464   2HD   ARG  69          1HD       ARG  69  -0.914   9.586  -7.681
  465    HE   ARG  69           HE       ARG  69  -3.227  10.539  -8.825
  466   1HH1  ARG  69          1HH1      ARG  69  -0.723  11.815  -6.716
  467   2HH1  ARG  69          2HH1      ARG  69  -1.039  13.466  -7.150
  468   1HH2  ARG  69          1HH2      ARG  69  -3.635  12.690  -9.376
  469   2HH2  ARG  69          2HH2      ARG  69  -2.703  13.970  -8.653
  470    H    TYR  70           H        TYR  70  -3.255   5.570  -6.643
  471    HA   TYR  70           HA       TYR  70  -2.972   4.606  -9.403
  472   1HB   TYR  70          2HB       TYR  70  -1.555   3.623  -6.950
  473   2HB   TYR  70          1HB       TYR  70  -1.008   3.519  -8.614
  474    HD1  TYR  70           1HD      TYR  70  -0.951   5.330  -5.534
  475    HD2  TYR  70           2HD      TYR  70  -0.226   5.693  -9.724
  476    HE1  TYR  70           1HE      TYR  70   0.404   7.331  -5.132
  477    HE2  TYR  70           2HE      TYR  70   1.145   7.697  -9.316
  478    HH   TYR  70           HH       TYR  70   2.246   8.575  -6.235
  479    H    ALA  71           H        ALA  71  -4.047   3.913  -6.207
  480    HA   ALA  71           HA       ALA  71  -5.974   1.996  -6.858
  481   1HB   ALA  71          1HB       ALA  71  -4.962  -0.039  -5.975
  482   2HB   ALA  71          2HB       ALA  71  -3.436   0.810  -5.727
  483   3HB   ALA  71          3HB       ALA  71  -4.041   0.545  -7.361
  484    HA   PRO  72           HA       PRO  72  -6.846   3.718  -2.825
  485   1HB   PRO  72          2HB       PRO  72  -9.072   1.887  -2.729
  486   2HB   PRO  72          1HB       PRO  72  -9.061   3.642  -2.761
  487   1HG   PRO  72          2HG       PRO  72  -9.839   2.037  -4.853
  488   2HG   PRO  72          1HG       PRO  72  -9.328   3.723  -4.996
  489   1HD   PRO  72          2HD       PRO  72  -7.912   1.268  -5.759
  490   2HD   PRO  72          1HD       PRO  72  -7.667   2.940  -6.302
  491    H    ARG  73           H        ARG  73  -5.767   0.706  -3.538
  492    HA   ARG  73           HA       ARG  73  -5.123   0.231  -0.756
  493   1HB   ARG  73          2HB       ARG  73  -5.892  -2.073  -0.724
  494   2HB   ARG  73          1HB       ARG  73  -7.253  -1.025  -1.109
  495   1HG   ARG  73          2HG       ARG  73  -6.803  -1.541  -3.527
  496   2HG   ARG  73          1HG       ARG  73  -5.674  -2.774  -2.961
  497   1HD   ARG  73          2HD       ARG  73  -8.550  -2.682  -2.075
  498   2HD   ARG  73          1HD       ARG  73  -8.044  -3.531  -3.534
  499    HE   ARG  73           HE       ARG  73  -6.409  -4.496  -1.552
  500   1HH1  ARG  73          1HH1      ARG  73  -9.888  -4.301  -2.001
  501   2HH1  ARG  73          2HH1      ARG  73 -10.198  -5.819  -1.206
  502   1HH2  ARG  73          1HH2      ARG  73  -6.814  -6.495  -0.575
  503   2HH2  ARG  73          2HH2      ARG  73  -8.443  -7.078  -0.396
  504    H    ALA  74           H        ALA  74  -3.177  -0.755  -0.551
  505    HA   ALA  74           HA       ALA  74  -1.359  -0.431  -2.618
  506   1HB   ALA  74          1HB       ALA  74   0.302  -1.228  -1.172
  507   2HB   ALA  74          2HB       ALA  74  -0.829  -2.238  -0.284
  508   3HB   ALA  74          3HB       ALA  74  -0.896  -0.481  -0.116
  509    H    ASP  75           H        ASP  75  -3.251  -3.220  -1.786
  510    HA   ASP  75           HA       ASP  75  -1.534  -4.967  -3.323
  511   1HB   ASP  75          2HB       ASP  75  -3.035  -6.777  -2.628
  512   2HB   ASP  75          1HB       ASP  75  -2.446  -5.860  -1.255
  513    H    LEU  76           H        LEU  76  -3.512  -2.732  -4.269
  514    HA   LEU  76           HA       LEU  76  -4.813  -4.330  -6.354
  515   1HB   LEU  76          2HB       LEU  76  -6.182  -2.692  -5.086
  516   2HB   LEU  76          1HB       LEU  76  -5.161  -1.405  -5.698
  517    HG   LEU  76           HG       LEU  76  -5.882  -1.952  -8.001
  518   1HD1  LEU  76          1HD1      LEU  76  -6.390  -4.323  -7.611
  519   2HD1  LEU  76          2HD1      LEU  76  -7.736  -3.465  -8.360
  520   3HD1  LEU  76          3HD1      LEU  76  -7.786  -3.850  -6.640
  521   1HD2  LEU  76          1HD2      LEU  76  -8.166  -1.457  -6.096
  522   2HD2  LEU  76          2HD2      LEU  76  -8.121  -1.041  -7.811
  523   3HD2  LEU  76          3HD2      LEU  76  -7.038  -0.231  -6.676
  524    H    ALA  77           H        ALA  77  -2.557  -1.612  -5.877
  525    HA   ALA  77           HA       ALA  77  -1.820  -1.829  -8.699
  526   1HB   ALA  77          1HB       ALA  77  -0.685   0.306  -8.409
  527   2HB   ALA  77          2HB       ALA  77  -1.171   0.333  -6.710
  528   3HB   ALA  77          3HB       ALA  77  -2.394   0.409  -7.984
  529    H    THR  78           H        THR  78   0.631  -1.297  -8.975
  530    HA   THR  78           HA       THR  78   1.785  -3.691  -7.805
  531    HB   THR  78           HB       THR  78   3.317  -3.638  -9.673
  532    HG1  THR  78           1HG      THR  78   3.831  -1.679 -10.323
  533   1HG2  THR  78          1HG2      THR  78   0.493  -2.911 -10.417
  534   2HG2  THR  78          2HG2      THR  78   1.118  -4.533 -10.113
  535   3HG2  THR  78          3HG2      THR  78   1.664  -3.626 -11.526
  536    H    ARG  79           H        ARG  79   4.384  -3.437  -7.977
  537    HA   ARG  79           HA       ARG  79   5.153  -2.524  -5.517
  538   1HB   ARG  79          2HB       ARG  79   6.953  -2.690  -7.927
  539   2HB   ARG  79          1HB       ARG  79   7.418  -2.854  -6.238
  540   1HG   ARG  79          2HG       ARG  79   6.188  -4.921  -6.060
  541   2HG   ARG  79          1HG       ARG  79   5.594  -4.737  -7.711
  542   1HD   ARG  79          2HD       ARG  79   7.356  -5.930  -8.343
  543   2HD   ARG  79          1HD       ARG  79   8.330  -4.510  -7.975
  544    HE   ARG  79           HE       ARG  79   8.703  -5.497  -5.751
  545   1HH1  ARG  79          1HH1      ARG  79   7.430  -7.530  -8.308
  546   2HH1  ARG  79          2HH1      ARG  79   8.155  -8.988  -7.698
  547   1HH2  ARG  79          1HH2      ARG  79   9.673  -7.457  -4.935
  548   2HH2  ARG  79          2HH2      ARG  79   9.425  -8.949  -5.814
  549    H    GLU  80           H        GLU  80   5.581  -0.918  -8.633
  550    HA   GLU  80           HA       GLU  80   7.092   1.238  -7.685
  551   1HB   GLU  80          2HB       GLU  80   6.298   2.364  -9.832
  552   2HB   GLU  80          1HB       GLU  80   7.194   0.861  -9.979
  553   1HG   GLU  80          2HG       GLU  80   4.255   0.641  -9.875
  554   2HG   GLU  80          1HG       GLU  80   4.956   1.356 -11.329
  555    H    GLU  81           H        GLU  81   3.605   0.734  -7.789
  556    HA   GLU  81           HA       GLU  81   2.960   3.443  -7.170
  557   1HB   GLU  81          2HB       GLU  81   0.936   2.670  -7.658
  558   2HB   GLU  81          1HB       GLU  81   1.581   1.042  -7.763
  559   1HG   GLU  81          2HG       GLU  81   0.163   0.592  -6.153
  560   2HG   GLU  81          1HG       GLU  81   1.330   1.362  -5.096
  561    H    GLN  82           H        GLN  82   3.220   0.462  -5.187
  562    HA   GLN  82           HA       GLN  82   2.637   1.674  -2.717
  563   1HB   GLN  82          2HB       GLN  82   4.292  -0.750  -3.404
  564   2HB   GLN  82          1HB       GLN  82   4.066  -0.218  -1.746
  565   1HG   GLN  82          2HG       GLN  82   2.153  -1.302  -1.637
  566   2HG   GLN  82          1HG       GLN  82   1.521  -0.375  -3.000
  567   1HE2  GLN  82          1HE2      GLN  82   1.335  -3.278  -2.175
  568   2HE2  GLN  82          2HE2      GLN  82   1.776  -4.121  -3.629
  569    H    ILE  83           H        ILE  83   5.568   1.320  -4.550
  570    HA   ILE  83           HA       ILE  83   7.395   2.354  -2.694
  571    HB   ILE  83           HB       ILE  83   7.359   2.294  -5.700
  572   1HG1  ILE  83          2HG1      ILE  83   9.387   0.991  -3.920
  573   2HG1  ILE  83          1HG1      ILE  83   7.788   0.271  -4.051
  574   1HG2  ILE  83          1HG2      ILE  83   9.558   3.378  -3.942
  575   2HG2  ILE  83          2HG2      ILE  83   8.564   4.309  -5.061
  576   3HG2  ILE  83          3HG2      ILE  83   9.678   3.090  -5.678
  577   1HD1  ILE  83          1HD1      ILE  83   9.670   0.814  -6.329
  578   2HD1  ILE  83          2HD1      ILE  83   8.080   0.061  -6.453
  579   3HD1  ILE  83          3HD1      ILE  83   9.377  -0.753  -5.575
  580    H    ALA  84           H        ALA  84   5.396   3.998  -5.162
  581    HA   ALA  84           HA       ALA  84   6.519   6.556  -4.817
  582   1HB   ALA  84          1HB       ALA  84   4.521   7.382  -5.961
  583   2HB   ALA  84          2HB       ALA  84   3.737   5.819  -5.725
  584   3HB   ALA  84          3HB       ALA  84   5.164   5.943  -6.753
  585    H    VAL  85           H        VAL  85   3.704   5.033  -3.303
  586    HA   VAL  85           HA       VAL  85   2.952   7.297  -1.762
  587    HB   VAL  85           HB       VAL  85   2.416   4.404  -1.132
  588   1HG1  VAL  85          1HG1      VAL  85   0.377   5.287  -0.086
  589   2HG1  VAL  85          2HG1      VAL  85   0.912   6.927  -0.448
  590   3HG1  VAL  85          3HG1      VAL  85   1.838   5.924   0.668
  591   1HG2  VAL  85          1HG2      VAL  85   1.796   4.835  -3.434
  592   2HG2  VAL  85          2HG2      VAL  85   0.885   6.266  -2.942
  593   3HG2  VAL  85          3HG2      VAL  85   0.349   4.660  -2.440
  594    H    ALA  86           H        ALA  86   4.701   4.306  -0.928
  595    HA   ALA  86           HA       ALA  86   5.461   4.961   1.657
  596   1HB   ALA  86          1HB       ALA  86   5.728   2.736   0.661
  597   2HB   ALA  86          2HB       ALA  86   7.222   3.319   1.398
  598   3HB   ALA  86          3HB       ALA  86   7.028   3.359  -0.356
  599    H    GLU  87           H        GLU  87   6.673   6.023  -1.406
  600    HA   GLU  87           HA       GLU  87   9.164   7.075  -0.626
  601   1HB   GLU  87          2HB       GLU  87   7.230   7.823  -2.806
  602   2HB   GLU  87          1HB       GLU  87   8.655   8.808  -2.516
  603   1HG   GLU  87          2HG       GLU  87   8.652   5.881  -3.209
  604   2HG   GLU  87          1HG       GLU  87   8.979   7.207  -4.324
  605    H    VAL  88           H        VAL  88   5.932   8.560  -0.693
  606    HA   VAL  88           HA       VAL  88   6.803  10.992   0.505
  607    HB   VAL  88           HB       VAL  88   4.013   9.815   0.601
  608   1HG1  VAL  88          1HG1      VAL  88   4.978  12.659   0.912
  609   2HG1  VAL  88          2HG1      VAL  88   4.453  11.603   2.227
  610   3HG1  VAL  88          3HG1      VAL  88   3.304  12.105   0.983
  611   1HG2  VAL  88          1HG2      VAL  88   5.275  11.669  -1.422
  612   2HG2  VAL  88          2HG2      VAL  88   3.565  11.242  -1.352
  613   3HG2  VAL  88          3HG2      VAL  88   4.769  10.000  -1.701
  614    H    THR  89           H        THR  89   5.446   7.981   1.766
  615    HA   THR  89           HA       THR  89   5.140   8.791   4.426
  616    HB   THR  89           HB       THR  89   5.972   5.998   3.694
  617    HG1  THR  89           1HG      THR  89   3.614   7.377   2.968
  618   1HG2  THR  89          1HG2      THR  89   4.516   5.363   5.468
  619   2HG2  THR  89          2HG2      THR  89   3.839   6.988   5.574
  620   3HG2  THR  89          3HG2      THR  89   5.506   6.695   6.063
  621    H    ARG  90           H        ARG  90   7.927   7.264   2.819
  622    HA   ARG  90           HA       ARG  90   9.447   6.940   5.177
  623   1HB   ARG  90          2HB       ARG  90  11.244   6.272   3.804
  624   2HB   ARG  90          1HB       ARG  90   9.793   5.726   2.981
  625   1HG   ARG  90          2HG       ARG  90  10.052   7.187   1.248
  626   2HG   ARG  90          1HG       ARG  90  10.941   8.362   2.224
  627   1HD   ARG  90          2HD       ARG  90  12.933   7.230   2.019
  628   2HD   ARG  90          1HD       ARG  90  12.148   5.685   1.706
  629    HE   ARG  90           HE       ARG  90  11.491   6.958  -0.498
  630   1HH1  ARG  90          1HH1      ARG  90  14.571   7.038   1.173
  631   2HH1  ARG  90          2HH1      ARG  90  15.505   7.142  -0.286
  632   1HH2  ARG  90          1HH2      ARG  90  12.690   7.097  -2.394
  633   2HH2  ARG  90          2HH2      ARG  90  14.430   7.159  -2.324
  634    H    LEU  91           H        LEU  91   9.111   9.563   2.941
  635    HA   LEU  91           HA       LEU  91  11.548  10.840   3.683
  636   1HB   LEU  91          2HB       LEU  91  10.815  12.744   2.366
  637   2HB   LEU  91          1HB       LEU  91  10.636  11.244   1.488
  638    HG   LEU  91           HG       LEU  91   8.135  11.393   2.227
  639   1HD1  LEU  91          1HD1      LEU  91   8.432  13.247   3.798
  640   2HD1  LEU  91          2HD1      LEU  91   7.319  13.668   2.496
  641   3HD1  LEU  91          3HD1      LEU  91   8.974  14.279   2.476
  642   1HD2  LEU  91          1HD2      LEU  91   8.934  11.555  -0.069
  643   2HD2  LEU  91          2HD2      LEU  91   9.307  13.263   0.171
  644   3HD2  LEU  91          3HD2      LEU  91   7.634  12.708   0.233
  645    H    ARG  92           H        ARG  92   8.437  10.730   5.076
  646    HA   ARG  92           HA       ARG  92   8.717  13.227   6.499
  647   1HB   ARG  92          2HB       ARG  92   6.704  11.097   7.119
  648   2HB   ARG  92          1HB       ARG  92   6.583  12.827   7.386
  649   1HG   ARG  92          2HG       ARG  92   6.072  13.268   5.179
  650   2HG   ARG  92          1HG       ARG  92   6.772  11.746   4.616
  651   1HD   ARG  92          2HD       ARG  92   4.154  12.225   5.985
  652   2HD   ARG  92          1HD       ARG  92   4.486  11.345   4.486
  653    HE   ARG  92           HE       ARG  92   5.830   9.926   6.342
  654   1HH1  ARG  92          1HH1      ARG  92   2.484  10.975   6.103
  655   2HH1  ARG  92          2HH1      ARG  92   1.889   9.701   7.133
  656   1HH2  ARG  92          1HH2      ARG  92   5.035   8.298   7.727
  657   2HH2  ARG  92          2HH2      ARG  92   3.337   8.185   8.065
  658    H    GLN  93           H        GLN  93   8.630   9.752   7.242
  659    HA   GLN  93           HA       GLN  93   9.281  10.465   9.976
  660   1HB   GLN  93          2HB       GLN  93   8.153   8.652  10.722
  661   2HB   GLN  93          1HB       GLN  93   7.349   8.859   9.175
  662   1HG   GLN  93          2HG       GLN  93   9.639   6.963   9.619
  663   2HG   GLN  93          1HG       GLN  93   7.945   6.513   9.792
  664   1HE2  GLN  93          1HE2      GLN  93   6.679   6.292   7.957
  665   2HE2  GLN  93          2HE2      GLN  93   7.374   6.209   6.368
  666    H    GLY  94           H        GLY  94  10.774   8.820   7.293
  667   1HA   GLY  94          2HA       GLY  94  13.065   8.431   7.039
  668   2HA   GLY  94          1HA       GLY  94  13.296   8.879   8.729
  669    H    TRP  95           H        TRP  95  11.306   6.441   7.143
  670    HA   TRP  95           HA       TRP  95  11.112   4.207   7.374
  671   1HB   TRP  95          2HB       TRP  95  13.980   3.940   8.187
  672   2HB   TRP  95          1HB       TRP  95  13.024   2.925   7.105
  673    HD1  TRP  95           HD       TRP  95  14.727   6.382   7.119
  674    HE1  TRP  95           1HE      TRP  95  15.428   6.939   4.724
  675    HE3  TRP  95           3HE      TRP  95  12.680   2.353   4.743
  676    HZ2  TRP  95           2HZ      TRP  95  15.204   5.803   2.181
  677    HZ3  TRP  95           3HZ      TRP  95  12.972   2.165   2.305
  678    HH2  TRP  95           HH       TRP  95  14.201   3.859   1.048
  679    H    GLY  96           H        GLY  96  10.798   5.986   9.673
  680   1HA   GLY  96          2HA       GLY  96  11.462   4.367  11.971
  681   2HA   GLY  96          1HA       GLY  96  10.496   5.836  11.971
  682    H    ALA  97           H        ALA  97   8.787   4.717   9.801
  683    HA   ALA  97           HA       ALA  97   6.926   3.267  11.457
  684   1HB   ALA  97          1HB       ALA  97   5.447   3.339   9.520
  685   2HB   ALA  97          2HB       ALA  97   6.764   3.956   8.523
  686   3HB   ALA  97          3HB       ALA  97   6.124   4.937   9.841
  687    H    TRP  98           H        TRP  98   9.344   2.593   9.108
  688    HA   TRP  98           HA       TRP  98   8.560  -0.221   8.959
  689   1HB   TRP  98          2HB       TRP  98  10.576   1.409   7.395
  690   2HB   TRP  98          1HB       TRP  98  10.361  -0.330   7.208
  691    HD1  TRP  98           HD       TRP  98   7.989  -1.159   6.187
  692    HE1  TRP  98           1HE      TRP  98   6.356   0.020   4.575
  693    HE3  TRP  98           3HE      TRP  98   9.658   3.665   6.690
  694    HZ2  TRP  98           2HZ      TRP  98   5.867   2.658   3.612
  695    HZ3  TRP  98           3HZ      TRP  98   8.573   5.432   5.394
  696    HH2  TRP  98           HH       TRP  98   6.714   4.938   3.893
  697    HA   PRO  99           HA       PRO  99  11.384  -0.541  12.407
  698   1HB   PRO  99          2HB       PRO  99  10.584  -3.394  12.113
  699   2HB   PRO  99          1HB       PRO  99  10.547  -2.356  13.544
  700   1HG   PRO  99          2HG       PRO  99   8.291  -2.928  12.321
  701   2HG   PRO  99          1HG       PRO  99   8.610  -1.257  12.840
  702   1HD   PRO  99          2HD       PRO  99   8.922  -2.457  10.097
  703   2HD   PRO  99          1HD       PRO  99   8.106  -0.948  10.572
  704    H    VAL 100           H        VAL 100  12.309  -3.533  12.376
  705    HA   VAL 100           HA       VAL 100  14.941  -3.037  11.667
  706    HB   VAL 100           HB       VAL 100  13.596  -5.743  11.686
  707   1HG1  VAL 100          1HG1      VAL 100  15.816  -6.594  12.277
  708   2HG1  VAL 100          2HG1      VAL 100  16.480  -4.968  12.126
  709   3HG1  VAL 100          3HG1      VAL 100  15.827  -5.790  10.709
  710   1HG2  VAL 100          1HG2      VAL 100  14.860  -4.229  13.967
  711   2HG2  VAL 100          2HG2      VAL 100  14.223  -5.872  14.039
  712   3HG2  VAL 100          3HG2      VAL 100  13.136  -4.515  13.745
  713    H    CYS 101           H        CYS 101  12.284  -3.949   9.659
  714    HA   CYS 101           HA       CYS 101  13.699  -5.150   7.542
  715   1HB   CYS 101          2HB       CYS 101  11.046  -3.690   7.503
  716   2HB   CYS 101          1HB       CYS 101  11.664  -4.729   6.215
  717    H    ALA 102           H        ALA 102  13.235  -1.812   8.419
  718    HA   ALA 102           HA       ALA 102  13.887  -0.686   5.886
  719   1HB   ALA 102          1HB       ALA 102  14.178   0.499   8.646
  720   2HB   ALA 102          2HB       ALA 102  12.746   0.605   7.621
  721   3HB   ALA 102          3HB       ALA 102  14.246   1.389   7.126
  722    H    ALA 103           H        ALA 103  15.774  -1.455   8.789
  723    HA   ALA 103           HA       ALA 103  18.252  -0.531   7.765
  724   1HB   ALA 103          1HB       ALA 103  17.855  -0.843  10.163
  725   2HB   ALA 103          2HB       ALA 103  19.261  -1.755   9.620
  726   3HB   ALA 103          3HB       ALA 103  17.734  -2.585   9.917
  727    H    ARG 104           H        ARG 104  16.584  -3.604   7.733
  728    HA   ARG 104           HA       ARG 104  18.600  -5.182   6.570
  729   1HB   ARG 104          2HB       ARG 104  15.585  -5.407   6.479
  730   2HB   ARG 104          1HB       ARG 104  16.677  -6.648   5.879
  731   1HG   ARG 104          2HG       ARG 104  16.613  -5.665   8.725
  732   2HG   ARG 104          1HG       ARG 104  15.783  -7.108   8.137
  733   1HD   ARG 104          2HD       ARG 104  18.752  -6.596   8.141
  734   2HD   ARG 104          1HD       ARG 104  17.874  -7.750   9.148
  735    HE   ARG 104           HE       ARG 104  17.885  -7.997   6.211
  736   1HH1  ARG 104          1HH1      ARG 104  18.544  -9.332   9.382
  737   2HH1  ARG 104          2HH1      ARG 104  18.885 -10.925   8.785
  738   1HH2  ARG 104          1HH2      ARG 104  18.304 -10.076   5.421
  739   2HH2  ARG 104          2HH2      ARG 104  18.735 -11.358   6.515
  740    H    ALA 105           H        ALA 105  16.277  -2.953   5.225
  741    HA   ALA 105           HA       ALA 105  16.700  -3.861   2.494
  742   1HB   ALA 105          1HB       ALA 105  14.472  -3.238   3.301
  743   2HB   ALA 105          2HB       ALA 105  14.992  -2.257   1.930
  744   3HB   ALA 105          3HB       ALA 105  15.043  -1.588   3.562
  745    H    GLY 106           H        GLY 106  17.883  -1.413   4.628
  746   1HA   GLY 106          2HA       GLY 106  19.885  -0.189   4.106
  747   2HA   GLY 106          1HA       GLY 106  19.422  -0.234   2.411
  748    H    ALA 107           H        ALA 107  18.299   1.039   5.539
  749    HA   ALA 107           HA       ALA 107  16.453   2.862   4.490
  750   1HB   ALA 107          1HB       ALA 107  17.849   2.900   7.161
  751   2HB   ALA 107          2HB       ALA 107  16.371   2.009   6.791
  752   3HB   ALA 107          3HB       ALA 107  16.376   3.773   6.741
  753    H    ARG 108           H        ARG 108  16.540   5.135   4.429
  754    HA   ARG 108           HA       ARG 108  17.416   7.158   3.971
  755   1HB   ARG 108          2HB       ARG 108  19.945   6.184   5.291
  756   2HB   ARG 108          1HB       ARG 108  19.361   7.842   5.168
  757   1HG   ARG 108          2HG       ARG 108  17.790   5.715   6.574
  758   2HG   ARG 108          1HG       ARG 108  19.067   6.635   7.403
  759   1HD   ARG 108          2HD       ARG 108  17.907   8.740   6.733
  760   2HD   ARG 108          1HD       ARG 108  16.600   7.758   6.069
  761    HE   ARG 108           HE       ARG 108  16.829   6.911   8.656
  762   1HH1  ARG 108          1HH1      ARG 108  16.302   9.995   7.090
  763   2HH1  ARG 108          2HH1      ARG 108  15.396  10.671   8.412
  764   1HH2  ARG 108          1HH2      ARG 108  15.663   7.798  10.421
  765   2HH2  ARG 108          2HH2      ARG 108  15.044   9.426  10.314
  Start of MODEL   18
    1   1H    ASN   1          1HT       ASN   1  10.729 -41.063 -25.436
    2   2H    ASN   1          2HT       ASN   1  10.116 -42.596 -25.807
    3   3H    ASN   1          3HT       ASN   1   9.090 -41.406 -25.177
    4    HA   ASN   1           HA       ASN   1   8.954 -41.859 -27.622
    5   1HB   ASN   1          2HB       ASN   1   8.631 -39.510 -28.185
    6   2HB   ASN   1          1HB       ASN   1   7.941 -39.885 -26.614
    7   1HD2  ASN   1          1HD2      ASN   1   8.799 -37.350 -27.805
    8   2HD2  ASN   1          2HD2      ASN   1   9.964 -36.675 -26.721
    9    H    VAL   2           H        VAL   2  10.467 -42.805 -28.781
   10    HA   VAL   2           HA       VAL   2  13.052 -41.673 -29.291
   11    HB   VAL   2           HB       VAL   2  11.575 -43.760 -30.921
   12   1HG1  VAL   2          1HG1      VAL   2  13.420 -42.718 -32.130
   13   2HG1  VAL   2          2HG1      VAL   2  13.799 -44.394 -31.727
   14   3HG1  VAL   2          3HG1      VAL   2  14.514 -43.078 -30.794
   15   1HG2  VAL   2          1HG2      VAL   2  11.800 -44.510 -28.630
   16   2HG2  VAL   2          2HG2      VAL   2  13.517 -44.107 -28.637
   17   3HG2  VAL   2          3HG2      VAL   2  12.912 -45.406 -29.665
   18    H    VAL   3           H        VAL   3  10.066 -42.012 -31.144
   19    HA   VAL   3           HA       VAL   3  10.832 -39.812 -32.851
   20    HB   VAL   3           HB       VAL   3   8.396 -41.593 -32.988
   21   1HG1  VAL   3          1HG1      VAL   3   7.982 -39.443 -34.017
   22   2HG1  VAL   3          2HG1      VAL   3   8.125 -40.688 -35.260
   23   3HG1  VAL   3          3HG1      VAL   3   9.463 -39.579 -34.962
   24   1HG2  VAL   3          1HG2      VAL   3  10.954 -41.690 -34.582
   25   2HG2  VAL   3          2HG2      VAL   3   9.516 -42.655 -34.903
   26   3HG2  VAL   3          3HG2      VAL   3  10.407 -42.877 -33.399
   27    H    VAL   4           H        VAL   4   9.922 -37.817 -32.661
   28    HA   VAL   4           HA       VAL   4   8.289 -37.349 -30.301
   29    HB   VAL   4           HB       VAL   4   9.131 -35.270 -32.298
   30   1HG1  VAL   4          1HG1      VAL   4   9.053 -33.781 -30.339
   31   2HG1  VAL   4          2HG1      VAL   4   8.485 -35.136 -29.365
   32   3HG1  VAL   4          3HG1      VAL   4   7.497 -34.531 -30.693
   33   1HG2  VAL   4          1HG2      VAL   4  11.144 -34.884 -30.944
   34   2HG2  VAL   4          2HG2      VAL   4  11.139 -36.492 -31.672
   35   3HG2  VAL   4          3HG2      VAL   4  10.741 -36.294 -29.965
   36    H    THR   5           H        THR   5   6.227 -36.566 -30.304
   37    HA   THR   5           HA       THR   5   4.764 -36.812 -32.834
   38    HB   THR   5           HB       THR   5   2.736 -36.960 -31.267
   39    HG1  THR   5           1HG      THR   5   3.588 -36.335 -29.314
   40   1HG2  THR   5          1HG2      THR   5   3.609 -38.892 -32.466
   41   2HG2  THR   5          2HG2      THR   5   3.112 -39.355 -30.835
   42   3HG2  THR   5          3HG2      THR   5   4.822 -39.141 -31.211
   43    HA   PRO   6           HA       PRO   6   4.120 -32.408 -32.185
   44   1HB   PRO   6          2HB       PRO   6   3.979 -31.882 -34.894
   45   2HB   PRO   6          1HB       PRO   6   5.465 -31.892 -33.945
   46   1HG   PRO   6          2HG       PRO   6   4.700 -33.698 -36.010
   47   2HG   PRO   6          1HG       PRO   6   6.164 -33.742 -35.018
   48   1HD   PRO   6          2HD       PRO   6   3.639 -35.261 -34.729
   49   2HD   PRO   6          1HD       PRO   6   5.282 -35.692 -34.206
   50    H    ALA   7           H        ALA   7   2.456 -30.987 -32.705
   51    HA   ALA   7           HA       ALA   7   0.254 -30.408 -32.676
   52   1HB   ALA   7          1HB       ALA   7   0.126 -32.258 -35.055
   53   2HB   ALA   7          2HB       ALA   7   0.706 -30.592 -35.096
   54   3HB   ALA   7          3HB       ALA   7  -0.977 -30.928 -34.687
   55    H    HIS   8           H        HIS   8  -1.970 -32.029 -33.613
   56    HA   HIS   8           HA       HIS   8  -3.589 -33.305 -32.704
   57   1HB   HIS   8          2HB       HIS   8  -2.009 -35.156 -32.782
   58   2HB   HIS   8          1HB       HIS   8  -1.306 -34.657 -31.251
   59    HD1  HIS   8           1HD      HIS   8  -4.504 -36.147 -32.647
   60    HD2  HIS   8           2HD      HIS   8  -2.554 -35.604 -29.018
   61    HE1  HIS   8           1HE      HIS   8  -5.803 -37.480 -30.940
   62    H    GLU   9           H        GLU   9  -1.378 -31.520 -30.784
   63    HA   GLU   9           HA       GLU   9  -3.280 -31.469 -28.559
   64   1HB   GLU   9          2HB       GLU   9  -1.441 -30.535 -27.236
   65   2HB   GLU   9          1HB       GLU   9  -1.030 -32.089 -27.942
   66   1HG   GLU   9          2HG       GLU   9   0.254 -30.955 -29.687
   67   2HG   GLU   9          1HG       GLU   9  -0.132 -29.401 -28.945
   68    H    ALA  10           H        ALA  10  -3.977 -29.525 -27.695
   69    HA   ALA  10           HA       ALA  10  -3.698 -27.197 -29.454
   70   1HB   ALA  10          1HB       ALA  10  -5.862 -28.277 -29.880
   71   2HB   ALA  10          2HB       ALA  10  -6.068 -26.688 -29.142
   72   3HB   ALA  10          3HB       ALA  10  -6.262 -28.145 -28.167
   73    H    VAL  11           H        VAL  11  -2.078 -26.753 -27.895
   74    HA   VAL  11           HA       VAL  11  -2.499 -26.249 -25.191
   75    HB   VAL  11           HB       VAL  11  -0.581 -24.875 -27.031
   76   1HG1  VAL  11          1HG1      VAL  11  -0.814 -23.727 -24.898
   77   2HG1  VAL  11          2HG1      VAL  11   0.767 -24.499 -25.028
   78   3HG1  VAL  11          3HG1      VAL  11  -0.500 -25.240 -24.047
   79   1HG2  VAL  11          1HG2      VAL  11  -0.311 -27.265 -27.187
   80   2HG2  VAL  11          2HG2      VAL  11  -0.264 -27.397 -25.430
   81   3HG2  VAL  11          3HG2      VAL  11   1.037 -26.571 -26.287
   82    H    VAL  12           H        VAL  12  -2.387 -23.937 -27.879
   83    HA   VAL  12           HA       VAL  12  -2.840 -21.734 -27.955
   84    HB   VAL  12           HB       VAL  12  -4.702 -22.712 -28.970
   85   1HG1  VAL  12          1HG1      VAL  12  -5.991 -22.950 -26.263
   86   2HG1  VAL  12          2HG1      VAL  12  -5.375 -24.276 -27.250
   87   3HG1  VAL  12          3HG1      VAL  12  -6.759 -23.332 -27.805
   88   1HG2  VAL  12          1HG2      VAL  12  -4.820 -20.311 -28.658
   89   2HG2  VAL  12          2HG2      VAL  12  -5.653 -20.539 -27.120
   90   3HG2  VAL  12          3HG2      VAL  12  -6.435 -21.022 -28.625
   91    H    ARG  13           H        ARG  13  -1.741 -20.796 -26.391
   92    HA   ARG  13           HA       ARG  13  -3.174 -20.154 -23.931
   93   1HB   ARG  13          2HB       ARG  13  -0.245 -20.326 -24.430
   94   2HB   ARG  13          1HB       ARG  13  -0.928 -19.615 -22.982
   95   1HG   ARG  13          2HG       ARG  13  -2.014 -21.764 -22.476
   96   2HG   ARG  13          1HG       ARG  13  -1.249 -22.466 -23.901
   97   1HD   ARG  13          2HD       ARG  13   0.220 -21.255 -21.567
   98   2HD   ARG  13          1HD       ARG  13  -0.061 -22.979 -21.798
   99    HE   ARG  13           HE       ARG  13   1.468 -21.380 -23.753
  100   1HH1  ARG  13          1HH1      ARG  13   1.104 -24.210 -21.716
  101   2HH1  ARG  13          2HH1      ARG  13   2.619 -24.912 -22.205
  102   1HH2  ARG  13          1HH2      ARG  13   3.441 -22.299 -24.408
  103   2HH2  ARG  13          2HH2      ARG  13   3.950 -23.819 -23.741
  104    H    VAL  14           H        VAL  14  -4.033 -18.265 -24.019
  105    HA   VAL  14           HA       VAL  14  -2.646 -16.047 -25.323
  106    HB   VAL  14           HB       VAL  14  -5.565 -16.067 -24.643
  107   1HG1  VAL  14          1HG1      VAL  14  -3.937 -14.563 -26.680
  108   2HG1  VAL  14          2HG1      VAL  14  -4.652 -13.915 -25.202
  109   3HG1  VAL  14          3HG1      VAL  14  -5.690 -14.457 -26.521
  110   1HG2  VAL  14          1HG2      VAL  14  -5.215 -18.051 -26.006
  111   2HG2  VAL  14          2HG2      VAL  14  -4.359 -17.090 -27.211
  112   3HG2  VAL  14          3HG2      VAL  14  -6.078 -16.818 -26.926
  113    H    GLY  15           H        GLY  15  -3.086 -13.969 -24.275
  114   1HA   GLY  15          2HA       GLY  15  -4.079 -13.161 -22.034
  115   2HA   GLY  15          1HA       GLY  15  -2.855 -14.234 -21.381
  116    H    THR  16           H        THR  16  -3.512 -11.218 -22.902
  117    HA   THR  16           HA       THR  16  -0.908 -10.377 -23.486
  118    HB   THR  16           HB       THR  16  -2.989  -8.439 -22.609
  119    HG1  THR  16           1HG      THR  16  -3.146 -10.196 -24.854
  120   1HG2  THR  16          1HG2      THR  16  -1.141  -8.591 -24.988
  121   2HG2  THR  16          2HG2      THR  16  -0.876  -7.638 -23.527
  122   3HG2  THR  16          3HG2      THR  16  -2.215  -7.245 -24.608
  123    H    LYS  17           H        LYS  17  -2.982  -9.258 -20.942
  124    HA   LYS  17           HA       LYS  17  -2.548  -8.163 -18.970
  125   1HB   LYS  17          2HB       LYS  17  -1.322 -10.886 -18.693
  126   2HB   LYS  17          1HB       LYS  17  -1.609  -9.823 -17.322
  127   1HG   LYS  17          2HG       LYS  17  -3.635 -11.075 -19.159
  128   2HG   LYS  17          1HG       LYS  17  -3.410 -11.365 -17.433
  129   1HD   LYS  17          2HD       LYS  17  -4.052  -9.015 -16.996
  130   2HD   LYS  17          1HD       LYS  17  -4.362  -8.807 -18.719
  131   1HE   LYS  17          2HE       LYS  17  -5.797 -10.633 -16.804
  132   2HE   LYS  17          1HE       LYS  17  -6.448  -9.218 -17.630
  133   1HZ   LYS  17          1HZ       LYS  17  -5.956 -10.465 -19.756
  134   2HZ   LYS  17          2HZ       LYS  17  -7.227 -11.062 -18.812
  135   3HZ   LYS  17          3HZ       LYS  17  -5.721 -11.842 -18.791
  136    HA   PRO  18           HA       PRO  18   1.812  -6.793 -19.593
  137   1HB   PRO  18          2HB       PRO  18   0.733  -4.101 -19.454
  138   2HB   PRO  18          1HB       PRO  18   1.625  -4.872 -20.769
  139   1HG   PRO  18          2HG       PRO  18  -0.989  -4.225 -20.958
  140   2HG   PRO  18          1HG       PRO  18  -0.274  -5.606 -21.803
  141   1HD   PRO  18          2HD       PRO  18  -1.842  -5.565 -19.248
  142   2HD   PRO  18          1HD       PRO  18  -1.983  -6.680 -20.626
  143    H    GLY  19           H        GLY  19   3.058  -5.438 -18.249
  144   1HA   GLY  19          2HA       GLY  19   3.806  -4.731 -16.186
  145   2HA   GLY  19          1HA       GLY  19   2.131  -4.383 -15.773
  146    H    THR  20           H        THR  20   3.688  -7.374 -16.691
  147    HA   THR  20           HA       THR  20   2.296  -8.970 -14.863
  148    HB   THR  20           HB       THR  20   4.983  -9.796 -15.892
  149    HG1  THR  20           1HG      THR  20   3.453 -10.317 -17.865
  150   1HG2  THR  20          1HG2      THR  20   3.797 -11.896 -16.301
  151   2HG2  THR  20          2HG2      THR  20   2.287 -11.147 -15.784
  152   3HG2  THR  20          3HG2      THR  20   3.598 -11.377 -14.627
  153    H    GLU  21           H        GLU  21   5.655  -7.825 -14.813
  154    HA   GLU  21           HA       GLU  21   5.606  -7.821 -11.922
  155   1HB   GLU  21          2HB       GLU  21   7.746  -9.159 -13.589
  156   2HB   GLU  21          1HB       GLU  21   7.931  -8.777 -11.884
  157   1HG   GLU  21          2HG       GLU  21   6.011 -10.235 -11.373
  158   2HG   GLU  21          1HG       GLU  21   5.903 -10.654 -13.079
  159    H    VAL  22           H        VAL  22   6.676  -6.121 -11.077
  160    HA   VAL  22           HA       VAL  22   7.510  -4.102 -13.017
  161    HB   VAL  22           HB       VAL  22   6.926  -3.798 -10.064
  162   1HG1  VAL  22          1HG1      VAL  22   6.900  -1.405 -10.508
  163   2HG1  VAL  22          2HG1      VAL  22   7.322  -1.701 -12.194
  164   3HG1  VAL  22          3HG1      VAL  22   8.471  -2.098 -10.918
  165   1HG2  VAL  22          1HG2      VAL  22   4.948  -4.440 -11.349
  166   2HG2  VAL  22          2HG2      VAL  22   5.241  -3.109 -12.471
  167   3HG2  VAL  22          3HG2      VAL  22   4.832  -2.773 -10.788
  168    HA   PRO  23           HA       PRO  23  11.836  -4.918 -12.148
  169   1HB   PRO  23          2HB       PRO  23  12.006  -2.267 -13.488
  170   2HB   PRO  23          1HB       PRO  23  12.889  -3.758 -13.832
  171   1HG   PRO  23          2HG       PRO  23  10.898  -2.943 -15.411
  172   2HG   PRO  23          1HG       PRO  23  11.148  -4.663 -15.058
  173   1HD   PRO  23          2HD       PRO  23   9.115  -2.777 -13.994
  174   2HD   PRO  23          1HD       PRO  23   8.968  -4.503 -14.364
  175    HA   PRO  24           HA       PRO  24  12.413  -2.725  -8.369
  176   1HB   PRO  24          2HB       PRO  24  15.202  -2.616  -8.501
  177   2HB   PRO  24          1HB       PRO  24  14.238  -3.925  -7.809
  178   1HG   PRO  24          2HG       PRO  24  15.444  -3.693 -10.531
  179   2HG   PRO  24          1HG       PRO  24  15.323  -5.112  -9.471
  180   1HD   PRO  24          2HD       PRO  24  13.670  -4.850 -11.525
  181   2HD   PRO  24          1HD       PRO  24  13.065  -5.420  -9.956
  182    H    VAL  25           H        VAL  25  12.855  -0.794  -7.579
  183    HA   VAL  25           HA       VAL  25  13.564   1.359  -9.442
  184    HB   VAL  25           HB       VAL  25  11.772   1.452  -7.000
  185   1HG1  VAL  25          1HG1      VAL  25  12.888   3.578  -7.281
  186   2HG1  VAL  25          2HG1      VAL  25  11.194   3.727  -7.757
  187   3HG1  VAL  25          3HG1      VAL  25  12.451   3.611  -8.988
  188   1HG2  VAL  25          1HG2      VAL  25   9.963   1.855  -8.619
  189   2HG2  VAL  25          2HG2      VAL  25  10.718   0.274  -8.834
  190   3HG2  VAL  25          3HG2      VAL  25  11.107   1.596  -9.937
  191    H    ILE  26           H        ILE  26  14.709   3.211  -8.429
  192    HA   ILE  26           HA       ILE  26  17.024   2.373  -7.166
  193    HB   ILE  26           HB       ILE  26  15.861   5.155  -7.198
  194   1HG1  ILE  26          2HG1      ILE  26  16.205   4.270  -9.438
  195   2HG1  ILE  26          1HG1      ILE  26  17.417   5.499  -9.097
  196   1HG2  ILE  26          1HG2      ILE  26  18.158   5.934  -6.801
  197   2HG2  ILE  26          2HG2      ILE  26  18.682   4.262  -6.604
  198   3HG2  ILE  26          3HG2      ILE  26  17.542   4.971  -5.457
  199   1HD1  ILE  26          1HD1      ILE  26  17.842   2.523  -8.988
  200   2HD1  ILE  26          2HD1      ILE  26  19.055   3.751  -8.638
  201   3HD1  ILE  26          3HD1      ILE  26  18.388   3.610 -10.264
  202    H    ASP  27           H        ASP  27  14.086   3.652  -5.699
  203    HA   ASP  27           HA       ASP  27  15.257   3.107  -3.073
  204   1HB   ASP  27          2HB       ASP  27  12.657   4.518  -3.628
  205   2HB   ASP  27          1HB       ASP  27  13.447   4.352  -2.074
  206    H    GLY  28           H        GLY  28  13.412   1.904  -5.423
  207   1HA   GLY  28          2HA       GLY  28  11.334   0.599  -3.957
  208   2HA   GLY  28          1HA       GLY  28  11.768   0.298  -5.635
  209    H    SER  29           H        SER  29  14.566   0.113  -4.105
  210    HA   SER  29           HA       SER  29  14.610  -2.767  -3.979
  211   1HB   SER  29          2HB       SER  29  16.947  -2.268  -3.079
  212   2HB   SER  29          1HB       SER  29  16.600  -1.763  -4.731
  213    HG   SER  29           HG       SER  29  17.578  -0.241  -2.947
  214    H    ILE  30           H        ILE  30  14.981  -0.116  -1.802
  215    HA   ILE  30           HA       ILE  30  15.033  -1.513   0.643
  216    HB   ILE  30           HB       ILE  30  13.718   1.124   0.764
  217   1HG1  ILE  30          2HG1      ILE  30  16.400   0.819  -0.609
  218   2HG1  ILE  30          1HG1      ILE  30  14.982   1.702  -1.175
  219   1HG2  ILE  30          1HG2      ILE  30  14.614   0.071   2.720
  220   2HG2  ILE  30          2HG2      ILE  30  15.495   1.563   2.391
  221   3HG2  ILE  30          3HG2      ILE  30  16.218   0.004   1.993
  222   1HD1  ILE  30          1HD1      ILE  30  16.686   2.476   1.172
  223   2HD1  ILE  30          2HD1      ILE  30  15.301   3.366   0.541
  224   3HD1  ILE  30          3HD1      ILE  30  16.756   3.188  -0.438
  225    H    TRP  31           H        TRP  31  12.586  -0.328  -1.474
  226    HA   TRP  31           HA       TRP  31  10.405  -0.730   0.333
  227   1HB   TRP  31          2HB       TRP  31  10.542  -0.130  -2.623
  228   2HB   TRP  31          1HB       TRP  31   9.018  -0.383  -1.779
  229    HD1  TRP  31           HD       TRP  31  10.835   2.432  -2.924
  230    HE1  TRP  31           1HE      TRP  31  10.483   4.515  -1.424
  231    HE3  TRP  31           3HE      TRP  31   9.025   0.116   1.199
  232    HZ2  TRP  31           2HZ      TRP  31   9.583   5.043   1.200
  233    HZ3  TRP  31           3HZ      TRP  31   8.452   1.449   3.179
  234    HH2  TRP  31           HH       TRP  31   8.730   3.872   3.173
  235    H    ASP  32           H        ASP  32  11.926  -2.588  -2.215
  236    HA   ASP  32           HA       ASP  32   9.905  -4.631  -2.164
  237   1HB   ASP  32          2HB       ASP  32  10.895  -4.411  -4.253
  238   2HB   ASP  32          1HB       ASP  32  12.529  -4.265  -3.572
  239    H    ALA  33           H        ALA  33  13.100  -4.117  -0.705
  240    HA   ALA  33           HA       ALA  33  13.279  -6.725   0.385
  241   1HB   ALA  33          1HB       ALA  33  15.244  -5.313   0.125
  242   2HB   ALA  33          2HB       ALA  33  15.039  -5.802   1.807
  243   3HB   ALA  33          3HB       ALA  33  14.592  -4.174   1.301
  244    H    ILE  34           H        ILE  34  11.897  -3.676   1.509
  245    HA   ILE  34           HA       ILE  34  11.108  -4.570   4.078
  246    HB   ILE  34           HB       ILE  34   9.964  -2.486   2.238
  247   1HG1  ILE  34          2HG1      ILE  34  11.483  -2.294   4.851
  248   2HG1  ILE  34          1HG1      ILE  34  12.159  -2.013   3.249
  249   1HG2  ILE  34          1HG2      ILE  34   9.072  -3.125   5.050
  250   2HG2  ILE  34          2HG2      ILE  34   8.119  -3.322   3.577
  251   3HG2  ILE  34          3HG2      ILE  34   8.578  -1.708   4.123
  252   1HD1  ILE  34          1HD1      ILE  34  11.711   0.076   4.365
  253   2HD1  ILE  34          2HD1      ILE  34  10.024  -0.379   4.596
  254   3HD1  ILE  34          3HD1      ILE  34  10.647  -0.102   2.970
  255    H    ALA  35           H        ALA  35   9.467  -4.572   0.933
  256    HA   ALA  35           HA       ALA  35   7.082  -5.786   1.700
  257   1HB   ALA  35          1HB       ALA  35   6.848  -6.457  -0.625
  258   2HB   ALA  35          2HB       ALA  35   8.560  -6.141  -0.906
  259   3HB   ALA  35          3HB       ALA  35   7.468  -4.810  -0.521
  260    H    GLY  36           H        GLY  36  10.225  -7.129   0.951
  261   1HA   GLY  36          2HA       GLY  36   9.378  -9.872   1.045
  262   2HA   GLY  36          1HA       GLY  36  11.040  -9.294   1.081
  263    H    CYS  37           H        CYS  37  10.153  -7.541   3.413
  264    HA   CYS  37           HA       CYS  37  10.829  -9.518   5.438
  265   1HB   CYS  37          2HB       CYS  37  12.238  -7.589   5.405
  266   2HB   CYS  37          1HB       CYS  37  10.852  -6.505   5.388
  267    H    GLU  38           H        GLU  38   8.450  -6.930   4.934
  268    HA   GLU  38           HA       GLU  38   7.111  -7.620   7.416
  269   1HB   GLU  38          2HB       GLU  38   7.591  -5.237   6.662
  270   2HB   GLU  38          1HB       GLU  38   6.360  -5.470   5.430
  271   1HG   GLU  38          2HG       GLU  38   5.404  -4.303   7.284
  272   2HG   GLU  38          1HG       GLU  38   4.713  -5.924   7.210
  273    H    ALA  39           H        ALA  39   6.691  -7.850   3.969
  274    HA   ALA  39           HA       ALA  39   3.989  -8.863   4.350
  275   1HB   ALA  39          1HB       ALA  39   4.243  -7.060   2.715
  276   2HB   ALA  39          2HB       ALA  39   3.645  -8.548   1.978
  277   3HB   ALA  39          3HB       ALA  39   5.334  -8.086   1.783
  278    H    GLY  40           H        GLY  40   7.126  -9.955   3.871
  279   1HA   GLY  40          2HA       GLY  40   7.897 -12.148   3.678
  280   2HA   GLY  40          1HA       GLY  40   6.230 -12.679   3.460
  281    H    GLY  41           H        GLY  41   7.083 -10.050   1.601
  282   1HA   GLY  41          2HA       GLY  41   7.635  -9.747  -0.574
  283   2HA   GLY  41          1HA       GLY  41   8.058 -11.455  -0.707
  284    H    ASN  42           H        ASN  42   5.163  -9.473  -0.121
  285    HA   ASN  42           HA       ASN  42   3.803 -10.726  -2.345
  286   1HB   ASN  42          2HB       ASN  42   3.508 -12.055  -0.030
  287   2HB   ASN  42          1HB       ASN  42   2.291 -10.805   0.223
  288   1HD2  ASN  42          1HD2      ASN  42   0.485 -10.733  -1.157
  289   2HD2  ASN  42          2HD2      ASN  42   0.031 -12.089  -2.122
  290    H    TRP  43           H        TRP  43   3.479  -8.785  -3.286
  291    HA   TRP  43           HA       TRP  43   2.809  -6.440  -1.772
  292   1HB   TRP  43          2HB       TRP  43   2.846  -6.940  -4.746
  293   2HB   TRP  43          1HB       TRP  43   2.647  -5.364  -3.983
  294    HD1  TRP  43           HD       TRP  43   5.277  -8.213  -4.088
  295    HE1  TRP  43           1HE      TRP  43   7.620  -7.124  -3.956
  296    HE3  TRP  43           3HE      TRP  43   3.860  -3.361  -3.499
  297    HZ2  TRP  43           2HZ      TRP  43   8.699  -4.518  -3.633
  298    HZ3  TRP  43           3HZ      TRP  43   5.569  -1.620  -3.289
  299    HH2  TRP  43           HH       TRP  43   7.952  -2.184  -3.365
  300    H    ALA  44           H        ALA  44   1.127  -8.992  -3.137
  301    HA   ALA  44           HA       ALA  44  -1.394  -7.489  -3.281
  302   1HB   ALA  44          1HB       ALA  44  -2.295  -9.411  -4.473
  303   2HB   ALA  44          2HB       ALA  44  -0.783 -10.284  -4.230
  304   3HB   ALA  44          3HB       ALA  44  -0.814  -8.840  -5.241
  305    H    ILE  45           H        ILE  45   0.155  -8.631  -0.853
  306    HA   ILE  45           HA       ILE  45  -1.601 -10.613   0.201
  307    HB   ILE  45           HB       ILE  45   0.948 -10.258   0.695
  308   1HG1  ILE  45          2HG1      ILE  45  -1.041 -10.913   2.869
  309   2HG1  ILE  45          1HG1      ILE  45  -0.461 -12.015   1.629
  310   1HG2  ILE  45          1HG2      ILE  45  -0.292  -8.465   2.782
  311   2HG2  ILE  45          2HG2      ILE  45   0.828  -7.980   1.509
  312   3HG2  ILE  45          3HG2      ILE  45   1.372  -9.053   2.799
  313   1HD1  ILE  45          1HD1      ILE  45   1.807 -11.831   2.546
  314   2HD1  ILE  45          2HD1      ILE  45   0.651 -12.444   3.729
  315   3HD1  ILE  45          3HD1      ILE  45   1.191 -10.768   3.811
  316    H    ASN  46           H        ASN  46  -3.112 -10.341   1.792
  317    HA   ASN  46           HA       ASN  46  -3.593  -7.666   2.852
  318   1HB   ASN  46          2HB       ASN  46  -4.897  -7.979   0.666
  319   2HB   ASN  46          1HB       ASN  46  -5.853  -9.172   1.540
  320   1HD2  ASN  46          1HD2      ASN  46  -6.321  -6.401   0.383
  321   2HD2  ASN  46          2HD2      ASN  46  -7.122  -5.550   1.673
  322    H    THR  47           H        THR  47  -2.986  -8.459   4.744
  323    HA   THR  47           HA       THR  47  -3.913 -10.839   5.920
  324    HB   THR  47           HB       THR  47  -3.045  -9.589   8.045
  325    HG1  THR  47           1HG      THR  47  -1.913  -7.736   7.620
  326   1HG2  THR  47          1HG2      THR  47  -0.731 -10.078   7.418
  327   2HG2  THR  47          2HG2      THR  47  -1.197 -10.154   5.718
  328   3HG2  THR  47          3HG2      THR  47  -1.808 -11.356   6.854
  329    H    GLY  48           H        GLY  48  -5.211  -7.658   5.671
  330   1HA   GLY  48          2HA       GLY  48  -7.455  -7.109   6.049
  331   2HA   GLY  48          1HA       GLY  48  -7.607  -8.539   7.065
  332    H    ASN  49           H        ASN  49  -4.897  -6.436   7.480
  333    HA   ASN  49           HA       ASN  49  -6.035  -5.745  10.082
  334   1HB   ASN  49          2HB       ASN  49  -3.648  -5.194  10.747
  335   2HB   ASN  49          1HB       ASN  49  -4.018  -6.884  10.457
  336   1HD2  ASN  49          1HD2      ASN  49  -3.477  -4.531   7.903
  337   2HD2  ASN  49          2HD2      ASN  49  -1.994  -5.218   7.342
  338    H    GLY  50           H        GLY  50  -6.304  -4.296   7.373
  339   1HA   GLY  50          2HA       GLY  50  -7.046  -2.072   7.152
  340   2HA   GLY  50          1HA       GLY  50  -6.117  -1.643   8.584
  341    H    TYR  51           H        TYR  51  -4.049  -3.432   7.061
  342    HA   TYR  51           HA       TYR  51  -2.884  -1.258   5.485
  343   1HB   TYR  51          2HB       TYR  51  -1.101  -3.316   6.720
  344   2HB   TYR  51          1HB       TYR  51  -0.768  -1.640   6.349
  345    HD1  TYR  51           1HD      TYR  51  -3.405  -0.769   7.965
  346    HD2  TYR  51           2HD      TYR  51   0.055  -3.071   8.841
  347    HE1  TYR  51           1HE      TYR  51  -3.621  -0.181  10.357
  348    HE2  TYR  51           2HE      TYR  51  -0.157  -2.513  11.229
  349    HH   TYR  51           HH       TYR  51  -2.949  -1.153  12.568
  350    H    TYR  52           H        TYR  52  -1.645  -2.042   3.649
  351    HA   TYR  52           HA       TYR  52  -2.766  -4.623   2.802
  352   1HB   TYR  52          2HB       TYR  52  -2.446  -2.257   0.968
  353   2HB   TYR  52          1HB       TYR  52  -3.322  -3.756   0.668
  354    HD1  TYR  52           1HD      TYR  52  -5.378  -4.243   2.059
  355    HD2  TYR  52           2HD      TYR  52  -3.480  -0.446   2.019
  356    HE1  TYR  52           1HE      TYR  52  -7.421  -3.230   2.977
  357    HE2  TYR  52           2HE      TYR  52  -5.509   0.590   2.951
  358    HH   TYR  52           HH       TYR  52  -8.094  -1.269   4.219
  359    H    GLY  53           H        GLY  53  -1.718  -5.285   0.595
  360   1HA   GLY  53          2HA       GLY  53   0.630  -6.415   1.526
  361   2HA   GLY  53          1HA       GLY  53   0.052  -6.510  -0.121
  362    H    GLY  54           H        GLY  54   2.642  -6.610   0.388
  363   1HA   GLY  54          2HA       GLY  54   4.471  -5.778  -0.762
  364   2HA   GLY  54          1HA       GLY  54   3.584  -4.286  -1.055
  365    H    VAL  55           H        VAL  55   3.877  -2.592   0.254
  366    HA   VAL  55           HA       VAL  55   6.047  -2.751   2.168
  367    HB   VAL  55           HB       VAL  55   5.575  -0.244   2.375
  368   1HG1  VAL  55          1HG1      VAL  55   7.444  -1.208   1.111
  369   2HG1  VAL  55          2HG1      VAL  55   6.798   0.229   0.318
  370   3HG1  VAL  55          3HG1      VAL  55   6.396  -1.375  -0.299
  371   1HG2  VAL  55          1HG2      VAL  55   3.297  -0.386   1.405
  372   2HG2  VAL  55          2HG2      VAL  55   4.033  -0.763  -0.156
  373   3HG2  VAL  55          3HG2      VAL  55   4.338   0.795   0.611
  374    H    GLN  56           H        GLN  56   2.743  -3.103   2.283
  375    HA   GLN  56           HA       GLN  56   1.322  -3.524   3.985
  376   1HB   GLN  56          2HB       GLN  56   3.136  -5.144   4.426
  377   2HB   GLN  56          1HB       GLN  56   3.872  -3.993   5.530
  378   1HG   GLN  56          2HG       GLN  56   2.650  -5.662   6.760
  379   2HG   GLN  56          1HG       GLN  56   1.877  -4.092   6.947
  380   1HE2  GLN  56          1HE2      GLN  56   1.588  -6.058   4.076
  381   2HE2  GLN  56          2HE2      GLN  56  -0.083  -6.442   4.275
  382    H    PHE  57           H        PHE  57   1.435  -0.819   3.747
  383    HA   PHE  57           HA       PHE  57   1.184  -0.144   6.582
  384   1HB   PHE  57          2HB       PHE  57   1.634   2.180   6.158
  385   2HB   PHE  57          1HB       PHE  57   2.979   1.188   5.640
  386    HD1  PHE  57           1HD      PHE  57   1.366   4.048   4.911
  387    HD2  PHE  57           2HD      PHE  57   2.535   0.451   2.963
  388    HE1  PHE  57           1HE      PHE  57   1.458   5.244   2.761
  389    HE2  PHE  57           2HE      PHE  57   2.621   1.642   0.817
  390    HZ   PHE  57           HZ       PHE  57   2.108   4.041   0.701
  391    H    ASP  58           H        ASP  58  -0.372   1.723   6.931
  392    HA   ASP  58           HA       ASP  58  -2.826   0.381   6.409
  393   1HB   ASP  58          2HB       ASP  58  -3.217   1.153   8.450
  394   2HB   ASP  58          1HB       ASP  58  -1.746   2.095   8.369
  395    H    GLN  59           H        GLN  59  -4.765   1.273   5.759
  396    HA   GLN  59           HA       GLN  59  -4.857   2.444   3.281
  397   1HB   GLN  59          2HB       GLN  59  -6.650   1.130   4.197
  398   2HB   GLN  59          1HB       GLN  59  -6.876   2.268   5.509
  399   1HG   GLN  59          2HG       GLN  59  -8.639   2.647   4.042
  400   2HG   GLN  59          1HG       GLN  59  -7.509   3.965   3.771
  401   1HE2  GLN  59          1HE2      GLN  59  -5.681   2.379   2.144
  402   2HE2  GLN  59          2HE2      GLN  59  -6.473   2.109   0.623
  403    H    GLY  60           H        GLY  60  -5.090   3.951   6.445
  404   1HA   GLY  60          2HA       GLY  60  -5.997   6.496   5.531
  405   2HA   GLY  60          1HA       GLY  60  -5.322   6.141   7.114
  406    H    THR  61           H        THR  61  -2.839   5.335   6.636
  407    HA   THR  61           HA       THR  61  -1.393   7.663   5.971
  408    HB   THR  61           HB       THR  61  -0.423   4.837   6.112
  409    HG1  THR  61           1HG      THR  61  -1.463   5.363   8.038
  410   1HG2  THR  61          1HG2      THR  61   1.733   5.859   6.758
  411   2HG2  THR  61          2HG2      THR  61   1.034   7.454   6.483
  412   3HG2  THR  61          3HG2      THR  61   1.231   6.333   5.137
  413    H    TRP  62           H        TRP  62  -2.133   4.718   4.227
  414    HA   TRP  62           HA       TRP  62  -0.723   5.126   1.869
  415   1HB   TRP  62          2HB       TRP  62  -1.879   3.059   2.365
  416   2HB   TRP  62          1HB       TRP  62  -3.426   3.894   2.423
  417    HD1  TRP  62           HD       TRP  62  -4.551   4.532   0.079
  418    HE1  TRP  62           1HE      TRP  62  -4.150   3.649  -2.320
  419    HE3  TRP  62           3HE      TRP  62  -0.101   2.178   0.835
  420    HZ2  TRP  62           2HZ      TRP  62  -2.206   2.133  -3.719
  421    HZ3  TRP  62           3HZ      TRP  62   0.978   1.033  -1.044
  422    HH2  TRP  62           HH       TRP  62  -0.033   0.996  -3.256
  423    H    GLU  63           H        GLU  63  -3.977   6.113   2.800
  424    HA   GLU  63           HA       GLU  63  -4.558   7.530   0.445
  425   1HB   GLU  63          2HB       GLU  63  -6.372   6.811   1.744
  426   2HB   GLU  63          1HB       GLU  63  -5.723   7.513   3.216
  427   1HG   GLU  63          2HG       GLU  63  -6.140   9.756   2.320
  428   2HG   GLU  63          1HG       GLU  63  -6.800   9.039   0.854
  429    H    ALA  64           H        ALA  64  -3.025   8.394   3.461
  430    HA   ALA  64           HA       ALA  64  -3.208  11.193   3.265
  431   1HB   ALA  64          1HB       ALA  64  -1.072   9.558   4.632
  432   2HB   ALA  64          2HB       ALA  64  -2.622  10.028   5.335
  433   3HB   ALA  64          3HB       ALA  64  -1.430  11.262   4.924
  434    H    ASN  65           H        ASN  65  -0.683   8.943   2.134
  435    HA   ASN  65           HA       ASN  65   0.779  11.130   0.932
  436   1HB   ASN  65          2HB       ASN  65   1.265   8.146   0.786
  437   2HB   ASN  65          1HB       ASN  65   2.369   9.396   0.223
  438   1HD2  ASN  65          1HD2      ASN  65   1.025   7.790   2.979
  439   2HD2  ASN  65          2HD2      ASN  65   2.131   8.439   4.147
  440    H    GLY  66           H        GLY  66  -1.772   9.061   0.084
  441   1HA   GLY  66          2HA       GLY  66  -3.190   9.620  -1.703
  442   2HA   GLY  66          1HA       GLY  66  -1.839  10.393  -2.509
  443    H    GLY  67           H        GLY  67  -2.425   7.064  -1.305
  444   1HA   GLY  67          2HA       GLY  67  -1.160   5.989  -3.649
  445   2HA   GLY  67          1HA       GLY  67  -1.854   5.076  -2.318
  446    H    LEU  68           H        LEU  68  -4.399   6.680  -2.651
  447    HA   LEU  68           HA       LEU  68  -5.733   4.591  -3.879
  448   1HB   LEU  68          2HB       LEU  68  -6.858   7.349  -3.544
  449   2HB   LEU  68          1HB       LEU  68  -7.752   5.848  -3.650
  450    HG   LEU  68           HG       LEU  68  -6.195   5.398  -1.459
  451   1HD1  LEU  68          1HD1      LEU  68  -6.355   7.401  -0.077
  452   2HD1  LEU  68          2HD1      LEU  68  -6.962   8.309  -1.463
  453   3HD1  LEU  68          3HD1      LEU  68  -5.323   7.661  -1.481
  454   1HD2  LEU  68          1HD2      LEU  68  -8.927   6.673  -1.547
  455   2HD2  LEU  68          2HD2      LEU  68  -8.228   5.829  -0.167
  456   3HD2  LEU  68          3HD2      LEU  68  -8.579   4.947  -1.653
  457    H    ARG  69           H        ARG  69  -4.255   7.318  -5.239
  458    HA   ARG  69           HA       ARG  69  -5.882   7.556  -7.549
  459   1HB   ARG  69          2HB       ARG  69  -4.059   9.009  -8.360
  460   2HB   ARG  69          1HB       ARG  69  -4.617   9.448  -6.752
  461   1HG   ARG  69          2HG       ARG  69  -2.718   8.092  -5.844
  462   2HG   ARG  69          1HG       ARG  69  -2.111   7.997  -7.493
  463   1HD   ARG  69          2HD       ARG  69  -1.007   9.816  -6.370
  464   2HD   ARG  69          1HD       ARG  69  -2.102  10.483  -7.583
  465    HE   ARG  69           HE       ARG  69  -3.615  10.474  -5.342
  466   1HH1  ARG  69          1HH1      ARG  69  -0.417  11.714  -6.048
  467   2HH1  ARG  69          2HH1      ARG  69  -0.513  13.000  -4.886
  468   1HH2  ARG  69          1HH2      ARG  69  -3.739  12.138  -3.789
  469   2HH2  ARG  69          2HH2      ARG  69  -2.400  13.225  -3.575
  470    H    TYR  70           H        TYR  70  -3.139   5.656  -6.567
  471    HA   TYR  70           HA       TYR  70  -2.721   4.700  -9.303
  472   1HB   TYR  70          2HB       TYR  70  -1.442   3.709  -6.773
  473   2HB   TYR  70          1HB       TYR  70  -0.793   3.627  -8.402
  474    HD1  TYR  70           1HD      TYR  70  -0.010   5.835  -9.463
  475    HD2  TYR  70           2HD      TYR  70  -0.922   5.422  -5.311
  476    HE1  TYR  70           1HE      TYR  70   1.280   7.877  -8.980
  477    HE2  TYR  70           2HE      TYR  70   0.349   7.460  -4.841
  478    HH   TYR  70           HH       TYR  70   1.975   8.876  -5.699
  479    H    ALA  71           H        ALA  71  -3.948   3.977  -6.177
  480    HA   ALA  71           HA       ALA  71  -5.950   2.204  -6.900
  481   1HB   ALA  71          1HB       ALA  71  -4.157   0.617  -7.486
  482   2HB   ALA  71          2HB       ALA  71  -5.100   0.050  -6.105
  483   3HB   ALA  71          3HB       ALA  71  -3.506   0.762  -5.851
  484    HA   PRO  72           HA       PRO  72  -6.764   3.753  -2.825
  485   1HB   PRO  72          2HB       PRO  72  -8.999   1.968  -2.657
  486   2HB   PRO  72          1HB       PRO  72  -8.973   3.719  -2.786
  487   1HG   PRO  72          2HG       PRO  72  -9.749   1.953  -4.783
  488   2HG   PRO  72          1HG       PRO  72  -9.352   3.661  -4.998
  489   1HD   PRO  72          2HD       PRO  72  -7.833   1.287  -5.761
  490   2HD   PRO  72          1HD       PRO  72  -7.652   2.971  -6.294
  491    H    ARG  73           H        ARG  73  -5.620   0.783  -3.525
  492    HA   ARG  73           HA       ARG  73  -5.065   0.229  -0.741
  493   1HB   ARG  73          2HB       ARG  73  -5.936  -2.020  -0.740
  494   2HB   ARG  73          1HB       ARG  73  -7.245  -0.946  -1.234
  495   1HG   ARG  73          2HG       ARG  73  -6.543  -1.479  -3.616
  496   2HG   ARG  73          1HG       ARG  73  -5.604  -2.790  -2.912
  497   1HD   ARG  73          2HD       ARG  73  -8.580  -2.397  -2.704
  498   2HD   ARG  73          1HD       ARG  73  -7.741  -3.590  -3.691
  499    HE   ARG  73           HE       ARG  73  -6.907  -4.484  -1.480
  500   1HH1  ARG  73          1HH1      ARG  73  -9.932  -2.755  -1.809
  501   2HH1  ARG  73          2HH1      ARG  73 -10.749  -3.669  -0.576
  502   1HH2  ARG  73          1HH2      ARG  73  -8.001  -5.730   0.113
  503   2HH2  ARG  73          2HH2      ARG  73  -9.642  -5.343   0.533
  504    H    ALA  74           H        ALA  74  -3.164  -0.912  -0.516
  505    HA   ALA  74           HA       ALA  74  -1.294  -0.705  -2.578
  506   1HB   ALA  74          1HB       ALA  74  -1.033  -2.445  -0.135
  507   2HB   ALA  74          2HB       ALA  74  -0.787  -0.700  -0.139
  508   3HB   ALA  74          3HB       ALA  74   0.267  -1.742  -1.095
  509    H    ASP  75           H        ASP  75  -3.409  -3.325  -1.722
  510    HA   ASP  75           HA       ASP  75  -1.800  -5.260  -3.157
  511   1HB   ASP  75          2HB       ASP  75  -3.513  -6.901  -2.440
  512   2HB   ASP  75          1HB       ASP  75  -2.759  -6.031  -1.114
  513    H    LEU  76           H        LEU  76  -3.513  -2.912  -4.242
  514    HA   LEU  76           HA       LEU  76  -4.796  -4.473  -6.372
  515   1HB   LEU  76          2HB       LEU  76  -6.235  -2.864  -5.141
  516   2HB   LEU  76          1HB       LEU  76  -5.192  -1.561  -5.677
  517    HG   LEU  76           HG       LEU  76  -5.800  -2.062  -8.026
  518   1HD1  LEU  76          1HD1      LEU  76  -6.314  -4.425  -7.801
  519   2HD1  LEU  76          2HD1      LEU  76  -7.691  -3.556  -8.478
  520   3HD1  LEU  76          3HD1      LEU  76  -7.703  -4.042  -6.783
  521   1HD2  LEU  76          1HD2      LEU  76  -7.021  -0.357  -6.764
  522   2HD2  LEU  76          2HD2      LEU  76  -8.159  -1.585  -6.205
  523   3HD2  LEU  76          3HD2      LEU  76  -8.071  -1.181  -7.920
  524    H    ALA  77           H        ALA  77  -2.608  -1.681  -5.771
  525    HA   ALA  77           HA       ALA  77  -1.828  -1.815  -8.584
  526   1HB   ALA  77          1HB       ALA  77  -1.147   0.251  -6.511
  527   2HB   ALA  77          2HB       ALA  77  -2.392   0.386  -7.753
  528   3HB   ALA  77          3HB       ALA  77  -0.693   0.298  -8.215
  529    H    THR  78           H        THR  78   0.576  -1.292  -8.886
  530    HA   THR  78           HA       THR  78   1.795  -3.699  -7.814
  531    HB   THR  78           HB       THR  78   3.206  -3.647  -9.748
  532    HG1  THR  78           1HG      THR  78   2.677  -1.668 -11.209
  533   1HG2  THR  78          1HG2      THR  78   0.962  -4.419 -10.163
  534   2HG2  THR  78          2HG2      THR  78   1.505  -3.474 -11.554
  535   3HG2  THR  78          3HG2      THR  78   0.398  -2.761 -10.376
  536    H    ARG  79           H        ARG  79   4.329  -3.528  -7.930
  537    HA   ARG  79           HA       ARG  79   5.242  -2.460  -5.612
  538   1HB   ARG  79          2HB       ARG  79   6.841  -2.758  -8.159
  539   2HB   ARG  79          1HB       ARG  79   7.517  -2.627  -6.542
  540   1HG   ARG  79          2HG       ARG  79   6.496  -4.722  -5.912
  541   2HG   ARG  79          1HG       ARG  79   5.715  -4.833  -7.491
  542   1HD   ARG  79          2HD       ARG  79   7.750  -6.219  -7.304
  543   2HD   ARG  79          1HD       ARG  79   7.839  -5.023  -8.592
  544    HE   ARG  79           HE       ARG  79   9.011  -3.885  -6.364
  545   1HH1  ARG  79          1HH1      ARG  79   9.526  -6.661  -8.416
  546   2HH1  ARG  79          2HH1      ARG  79  11.231  -6.736  -8.123
  547   1HH2  ARG  79          1HH2      ARG  79  11.282  -3.934  -6.009
  548   2HH2  ARG  79          2HH2      ARG  79  12.233  -5.169  -6.762
  549    H    GLU  80           H        GLU  80   5.305  -0.899  -8.757
  550    HA   GLU  80           HA       GLU  80   6.871   1.313  -8.117
  551   1HB   GLU  80          2HB       GLU  80   5.939   2.386 -10.089
  552   2HB   GLU  80          1HB       GLU  80   6.268   0.692 -10.422
  553   1HG   GLU  80          2HG       GLU  80   3.991   0.129 -10.387
  554   2HG   GLU  80          1HG       GLU  80   3.541   1.655  -9.629
  555    H    GLU  81           H        GLU  81   3.410   0.760  -7.683
  556    HA   GLU  81           HA       GLU  81   2.854   3.466  -6.968
  557   1HB   GLU  81          2HB       GLU  81   0.813   2.715  -7.365
  558   2HB   GLU  81          1HB       GLU  81   1.409   1.067  -7.457
  559   1HG   GLU  81          2HG       GLU  81   0.235   0.608  -5.669
  560   2HG   GLU  81          1HG       GLU  81   1.284   1.676  -4.748
  561    H    GLN  82           H        GLN  82   3.282   0.447  -5.072
  562    HA   GLN  82           HA       GLN  82   2.885   1.696  -2.567
  563   1HB   GLN  82          2HB       GLN  82   4.380  -0.795  -3.338
  564   2HB   GLN  82          1HB       GLN  82   4.308  -0.235  -1.674
  565   1HG   GLN  82          2HG       GLN  82   2.440  -1.390  -1.469
  566   2HG   GLN  82          1HG       GLN  82   1.676  -0.211  -2.536
  567   1HE2  GLN  82          1HE2      GLN  82   1.333  -3.169  -2.163
  568   2HE2  GLN  82          2HE2      GLN  82   1.465  -3.794  -3.777
  569    H    ILE  83           H        ILE  83   5.654   1.376  -4.634
  570    HA   ILE  83           HA       ILE  83   7.600   2.292  -2.810
  571    HB   ILE  83           HB       ILE  83   7.460   2.276  -5.820
  572   1HG1  ILE  83          2HG1      ILE  83   9.460   0.889  -4.051
  573   2HG1  ILE  83          1HG1      ILE  83   7.868   0.192  -4.327
  574   1HG2  ILE  83          1HG2      ILE  83   9.812   2.993  -5.872
  575   2HG2  ILE  83          2HG2      ILE  83   9.742   3.302  -4.135
  576   3HG2  ILE  83          3HG2      ILE  83   8.745   4.247  -5.240
  577   1HD1  ILE  83          1HD1      ILE  83   9.914   0.842  -6.440
  578   2HD1  ILE  83          2HD1      ILE  83   8.314   0.157  -6.733
  579   3HD1  ILE  83          3HD1      ILE  83   9.512  -0.764  -5.826
  580    H    ALA  84           H        ALA  84   5.496   3.972  -5.136
  581    HA   ALA  84           HA       ALA  84   6.661   6.529  -4.745
  582   1HB   ALA  84          1HB       ALA  84   4.702   7.382  -5.925
  583   2HB   ALA  84          2HB       ALA  84   3.904   5.817  -5.741
  584   3HB   ALA  84          3HB       ALA  84   5.357   5.955  -6.732
  585    H    VAL  85           H        VAL  85   3.759   5.003  -3.371
  586    HA   VAL  85           HA       VAL  85   2.919   7.306  -1.941
  587    HB   VAL  85           HB       VAL  85   2.243   4.411  -1.470
  588   1HG1  VAL  85          1HG1      VAL  85   0.732   6.923  -0.735
  589   2HG1  VAL  85          2HG1      VAL  85   1.600   5.880   0.392
  590   3HG1  VAL  85          3HG1      VAL  85   0.185   5.270  -0.463
  591   1HG2  VAL  85          1HG2      VAL  85   0.305   4.847  -2.898
  592   2HG2  VAL  85          2HG2      VAL  85   1.827   5.061  -3.762
  593   3HG2  VAL  85          3HG2      VAL  85   0.916   6.469  -3.217
  594    H    ALA  86           H        ALA  86   4.558   4.308  -0.911
  595    HA   ALA  86           HA       ALA  86   4.760   5.060   1.797
  596   1HB   ALA  86          1HB       ALA  86   6.324   3.210   1.991
  597   2HB   ALA  86          2HB       ALA  86   6.443   3.110   0.235
  598   3HB   ALA  86          3HB       ALA  86   4.917   2.738   1.039
  599    H    GLU  87           H        GLU  87   6.636   5.734  -1.039
  600    HA   GLU  87           HA       GLU  87   8.993   6.471   0.402
  601   1HB   GLU  87          2HB       GLU  87  10.036   6.905  -1.584
  602   2HB   GLU  87          1HB       GLU  87   8.802   5.763  -2.084
  603   1HG   GLU  87          2HG       GLU  87   8.527   7.245  -3.719
  604   2HG   GLU  87          1HG       GLU  87   7.482   8.027  -2.534
  605    H    VAL  88           H        VAL  88   6.148   8.256  -0.656
  606    HA   VAL  88           HA       VAL  88   7.079  10.813   0.063
  607    HB   VAL  88           HB       VAL  88   4.263   9.740   0.491
  608   1HG1  VAL  88          1HG1      VAL  88   3.595  12.069   0.475
  609   2HG1  VAL  88          2HG1      VAL  88   5.262  12.578   0.214
  610   3HG1  VAL  88          3HG1      VAL  88   4.808  11.802   1.735
  611   1HG2  VAL  88          1HG2      VAL  88   5.431  11.206  -1.882
  612   2HG2  VAL  88          2HG2      VAL  88   3.743  10.741  -1.674
  613   3HG2  VAL  88          3HG2      VAL  88   4.985   9.500  -1.842
  614    H    THR  89           H        THR  89   5.675   8.174   1.915
  615    HA   THR  89           HA       THR  89   5.574   9.534   4.392
  616    HB   THR  89           HB       THR  89   5.964   6.587   4.337
  617    HG1  THR  89           1HG      THR  89   3.986   7.983   2.909
  618   1HG2  THR  89          1HG2      THR  89   5.373   7.836   6.372
  619   2HG2  THR  89          2HG2      THR  89   4.136   6.658   5.923
  620   3HG2  THR  89          3HG2      THR  89   3.885   8.373   5.589
  621    H    ARG  90           H        ARG  90   7.961   7.393   2.884
  622    HA   ARG  90           HA       ARG  90   9.680   7.173   5.105
  623   1HB   ARG  90          2HB       ARG  90  11.171   6.076   3.698
  624   2HB   ARG  90          1HB       ARG  90   9.620   5.775   2.938
  625   1HG   ARG  90          2HG       ARG  90  10.798   6.336   1.088
  626   2HG   ARG  90          1HG       ARG  90  10.298   7.954   1.572
  627   1HD   ARG  90          2HD       ARG  90  12.480   8.149   2.803
  628   2HD   ARG  90          1HD       ARG  90  12.958   6.621   2.057
  629    HE   ARG  90           HE       ARG  90  12.339   8.010  -0.105
  630   1HH1  ARG  90          1HH1      ARG  90  14.188   8.940   2.715
  631   2HH1  ARG  90          2HH1      ARG  90  15.162  10.102   1.872
  632   1HH2  ARG  90          1HH2      ARG  90  13.601   9.554  -1.240
  633   2HH2  ARG  90          2HH2      ARG  90  14.807  10.474  -0.382
  634    H    LEU  91           H        LEU  91   9.336   9.614   2.654
  635    HA   LEU  91           HA       LEU  91  11.999  10.629   3.002
  636   1HB   LEU  91          2HB       LEU  91  11.407  12.405   1.464
  637   2HB   LEU  91          1HB       LEU  91  10.940  10.844   0.836
  638    HG   LEU  91           HG       LEU  91   8.562  11.450   1.694
  639   1HD1  LEU  91          1HD1      LEU  91   8.092  13.848   1.709
  640   2HD1  LEU  91          2HD1      LEU  91   9.815  14.194   1.556
  641   3HD1  LEU  91          3HD1      LEU  91   9.199  13.407   3.009
  642   1HD2  LEU  91          1HD2      LEU  91   9.841  12.866  -0.645
  643   2HD2  LEU  91          2HD2      LEU  91   8.107  12.645  -0.408
  644   3HD2  LEU  91          3HD2      LEU  91   9.150  11.243  -0.649
  645    H    ARG  92           H        ARG  92   9.013  11.134   4.555
  646    HA   ARG  92           HA       ARG  92   9.686  13.737   5.613
  647   1HB   ARG  92          2HB       ARG  92   7.483  11.989   6.637
  648   2HB   ARG  92          1HB       ARG  92   7.566  13.744   6.601
  649   1HG   ARG  92          2HG       ARG  92   6.984  13.860   4.377
  650   2HG   ARG  92          1HG       ARG  92   7.511  12.206   4.051
  651   1HD   ARG  92          2HD       ARG  92   4.995  13.175   5.336
  652   2HD   ARG  92          1HD       ARG  92   5.218  11.979   4.052
  653    HE   ARG  92           HE       ARG  92   6.426  10.795   6.125
  654   1HH1  ARG  92          1HH1      ARG  92   3.245  12.201   5.707
  655   2HH1  ARG  92          2HH1      ARG  92   2.539  11.351   7.059
  656   1HH2  ARG  92          1HH2      ARG  92   5.498   9.667   7.910
  657   2HH2  ARG  92          2HH2      ARG  92   3.824   9.899   8.306
  658    H    GLN  93           H        GLN  93   9.338  10.422   6.726
  659    HA   GLN  93           HA       GLN  93  10.116  11.255   9.400
  660   1HB   GLN  93          2HB       GLN  93   9.159   9.161  10.150
  661   2HB   GLN  93          1HB       GLN  93   8.032  10.003   9.086
  662   1HG   GLN  93          2HG       GLN  93   8.989   8.569   7.215
  663   2HG   GLN  93          1HG       GLN  93   9.696   7.587   8.496
  664   1HE2  GLN  93          1HE2      GLN  93   7.645   7.012   6.482
  665   2HE2  GLN  93          2HE2      GLN  93   6.274   6.445   7.378
  666    H    GLY  94           H        GLY  94  11.265   9.173   6.804
  667   1HA   GLY  94          2HA       GLY  94  13.568   8.716   6.503
  668   2HA   GLY  94          1HA       GLY  94  13.833   9.041   8.212
  669    H    TRP  95           H        TRP  95  11.395   6.955   6.785
  670    HA   TRP  95           HA       TRP  95  11.000   4.754   6.815
  671   1HB   TRP  95          2HB       TRP  95  13.895   4.335   7.576
  672   2HB   TRP  95          1HB       TRP  95  12.800   3.148   6.862
  673    HD1  TRP  95           HD       TRP  95  14.697   6.352   5.938
  674    HE1  TRP  95           1HE      TRP  95  15.019   6.400   3.393
  675    HE3  TRP  95           3HE      TRP  95  11.904   2.264   4.728
  676    HZ2  TRP  95           2HZ      TRP  95  14.165   4.899   1.158
  677    HZ3  TRP  95           3HZ      TRP  95  11.700   1.639   2.360
  678    HH2  TRP  95           HH       TRP  95  12.809   2.930   0.613
  679    H    GLY  96           H        GLY  96  11.354   6.611   9.280
  680   1HA   GLY  96          2HA       GLY  96  11.758   5.071  11.558
  681   2HA   GLY  96          1HA       GLY  96  10.750   6.505  11.484
  682    H    ALA  97           H        ALA  97   8.896   5.266   9.532
  683    HA   ALA  97           HA       ALA  97   7.242   3.865  11.433
  684   1HB   ALA  97          1HB       ALA  97   6.734   4.439   8.516
  685   2HB   ALA  97          2HB       ALA  97   6.239   5.457   9.867
  686   3HB   ALA  97          3HB       ALA  97   5.551   3.845   9.682
  687    H    TRP  98           H        TRP  98   9.540   3.018   9.065
  688    HA   TRP  98           HA       TRP  98   8.523   0.262   8.966
  689   1HB   TRP  98          2HB       TRP  98  10.486   1.739   7.203
  690   2HB   TRP  98          1HB       TRP  98  10.176   0.010   7.081
  691    HD1  TRP  98           HD       TRP  98   7.774  -0.747   6.152
  692    HE1  TRP  98           1HE      TRP  98   6.059   0.471   4.672
  693    HE3  TRP  98           3HE      TRP  98   9.488   4.067   6.686
  694    HZ2  TRP  98           2HZ      TRP  98   5.512   3.116   3.821
  695    HZ3  TRP  98           3HZ      TRP  98   8.315   5.857   5.503
  696    HH2  TRP  98           HH       TRP  98   6.368   5.394   4.111
  697    HA   PRO  99           HA       PRO  99  11.564  -0.311  12.187
  698   1HB   PRO  99          2HB       PRO  99  10.504  -3.083  11.971
  699   2HB   PRO  99          1HB       PRO  99  10.649  -2.041  13.393
  700   1HG   PRO  99          2HG       PRO  99   8.280  -2.432  12.321
  701   2HG   PRO  99          1HG       PRO  99   8.765  -0.796  12.820
  702   1HD   PRO  99          2HD       PRO  99   8.795  -2.003  10.061
  703   2HD   PRO  99          1HD       PRO  99   8.137  -0.437  10.591
  704    H    VAL 100           H        VAL 100  12.226  -3.323  12.175
  705    HA   VAL 100           HA       VAL 100  14.806  -3.164  11.219
  706    HB   VAL 100           HB       VAL 100  14.698  -5.705  11.136
  707   1HG1  VAL 100          1HG1      VAL 100  15.534  -4.527  13.072
  708   2HG1  VAL 100          2HG1      VAL 100  14.539  -5.887  13.598
  709   3HG1  VAL 100          3HG1      VAL 100  13.890  -4.247  13.646
  710   1HG2  VAL 100          1HG2      VAL 100  12.759  -6.748  12.209
  711   2HG2  VAL 100          2HG2      VAL 100  12.324  -5.957  10.695
  712   3HG2  VAL 100          3HG2      VAL 100  11.940  -5.186  12.234
  713    H    CYS 101           H        CYS 101  11.921  -3.925   9.495
  714    HA   CYS 101           HA       CYS 101  12.981  -5.194   7.244
  715   1HB   CYS 101          2HB       CYS 101  10.553  -3.402   7.454
  716   2HB   CYS 101          1HB       CYS 101  10.913  -4.463   6.092
  717    H    ALA 102           H        ALA 102  12.550  -1.736   7.951
  718    HA   ALA 102           HA       ALA 102  13.506  -0.876   5.398
  719   1HB   ALA 102          1HB       ALA 102  13.609   1.343   6.383
  720   2HB   ALA 102          2HB       ALA 102  13.375   0.657   7.991
  721   3HB   ALA 102          3HB       ALA 102  12.086   0.557   6.792
  722    H    ALA 103           H        ALA 103  14.924  -1.317   8.586
  723    HA   ALA 103           HA       ALA 103  17.473  -0.308   8.074
  724   1HB   ALA 103          1HB       ALA 103  16.693  -0.820  10.320
  725   2HB   ALA 103          2HB       ALA 103  18.201  -1.671   9.983
  726   3HB   ALA 103          3HB       ALA 103  16.666  -2.540   9.933
  727    H    ARG 104           H        ARG 104  16.204  -3.587   7.721
  728    HA   ARG 104           HA       ARG 104  18.654  -4.656   6.739
  729   1HB   ARG 104          2HB       ARG 104  15.969  -5.664   7.286
  730   2HB   ARG 104          1HB       ARG 104  16.778  -6.449   5.928
  731   1HG   ARG 104          2HG       ARG 104  17.887  -7.704   7.382
  732   2HG   ARG 104          1HG       ARG 104  18.716  -6.249   7.942
  733   1HD   ARG 104          2HD       ARG 104  17.684  -7.429   9.797
  734   2HD   ARG 104          1HD       ARG 104  16.916  -5.859   9.553
  735    HE   ARG 104           HE       ARG 104  15.388  -7.501   8.080
  736   1HH1  ARG 104          1HH1      ARG 104  16.492  -7.581  11.400
  737   2HH1  ARG 104          2HH1      ARG 104  15.143  -8.529  11.966
  738   1HH2  ARG 104          1HH2      ARG 104  13.596  -8.745   8.820
  739   2HH2  ARG 104          2HH2      ARG 104  13.483  -9.162  10.502
  740    H    ALA 105           H        ALA 105  16.024  -2.990   5.310
  741    HA   ALA 105           HA       ALA 105  16.520  -3.914   2.616
  742   1HB   ALA 105          1HB       ALA 105  14.279  -3.334   3.320
  743   2HB   ALA 105          2HB       ALA 105  14.813  -2.285   2.005
  744   3HB   ALA 105          3HB       ALA 105  14.795  -1.682   3.662
  745    H    GLY 106           H        GLY 106  17.697  -1.423   4.692
  746   1HA   GLY 106          2HA       GLY 106  19.729  -0.254   4.126
  747   2HA   GLY 106          1HA       GLY 106  19.227  -0.289   2.442
  748    H    ALA 107           H        ALA 107  17.947   0.874   5.550
  749    HA   ALA 107           HA       ALA 107  16.288   2.854   4.439
  750   1HB   ALA 107          1HB       ALA 107  17.408   2.676   7.230
  751   2HB   ALA 107          2HB       ALA 107  15.929   1.903   6.657
  752   3HB   ALA 107          3HB       ALA 107  16.036   3.662   6.723
  753    H    ARG 108           H        ARG 108  16.497   5.038   4.187
  754    HA   ARG 108           HA       ARG 108  18.702   6.577   4.972
  755   1HB   ARG 108          2HB       ARG 108  19.489   6.958   2.483
  756   2HB   ARG 108          1HB       ARG 108  20.176   5.675   3.464
  757   1HG   ARG 108          2HG       ARG 108  19.773   4.702   1.381
  758   2HG   ARG 108          1HG       ARG 108  18.452   4.138   2.409
  759   1HD   ARG 108          2HD       ARG 108  17.471   4.725   0.354
  760   2HD   ARG 108          1HD       ARG 108  17.088   6.046   1.455
  761    HE   ARG 108           HE       ARG 108  19.448   6.404  -0.192
  762   1HH1  ARG 108          1HH1      ARG 108  16.066   7.055   0.305
  763   2HH1  ARG 108          2HH1      ARG 108  15.989   8.304  -0.892
  764   1HH2  ARG 108          1HH2      ARG 108  19.389   8.053  -1.767
  765   2HH2  ARG 108          2HH2      ARG 108  17.889   8.878  -2.076
  Start of MODEL   19
    1   1H    ASN   1          1HT       ASN   1   2.288  53.144 -18.787
    2   2H    ASN   1          2HT       ASN   1   0.987  53.926 -19.545
    3   3H    ASN   1          3HT       ASN   1   2.349  53.470 -20.449
    4    HA   ASN   1           HA       ASN   1   0.555  51.592 -19.050
    5   1HB   ASN   1          2HB       ASN   1   0.556  52.609 -21.872
    6   2HB   ASN   1          1HB       ASN   1   0.005  50.972 -21.526
    7   1HD2  ASN   1          1HD2      ASN   1  -1.476  53.323 -22.498
    8   2HD2  ASN   1          2HD2      ASN   1  -2.765  53.558 -21.362
    9    H    VAL   2           H        VAL   2   1.222  49.575 -19.005
   10    HA   VAL   2           HA       VAL   2   3.706  48.888 -20.393
   11    HB   VAL   2           HB       VAL   2   2.713  47.725 -17.775
   12   1HG1  VAL   2          1HG1      VAL   2   4.041  46.162 -19.105
   13   2HG1  VAL   2          2HG1      VAL   2   4.912  46.667 -17.658
   14   3HG1  VAL   2          3HG1      VAL   2   5.333  47.355 -19.226
   15   1HG2  VAL   2          1HG2      VAL   2   4.570  48.923 -16.720
   16   2HG2  VAL   2          2HG2      VAL   2   3.426  50.037 -17.466
   17   3HG2  VAL   2          3HG2      VAL   2   4.958  49.682 -18.263
   18    H    VAL   3           H        VAL   3   2.367  48.348 -22.138
   19    HA   VAL   3           HA       VAL   3   0.284  46.823 -22.573
   20    HB   VAL   3           HB       VAL   3   1.656  47.565 -24.408
   21   1HG1  VAL   3          1HG1      VAL   3   3.867  47.119 -23.499
   22   2HG1  VAL   3          2HG1      VAL   3   3.692  46.383 -25.091
   23   3HG1  VAL   3          3HG1      VAL   3   3.592  45.384 -23.641
   24   1HG2  VAL   3          1HG2      VAL   3   1.272  44.574 -24.465
   25   2HG2  VAL   3          2HG2      VAL   3   1.518  45.602 -25.878
   26   3HG2  VAL   3          3HG2      VAL   3   0.071  45.795 -24.890
   27    H    VAL   4           H        VAL   4  -0.561  44.966 -22.025
   28    HA   VAL   4           HA       VAL   4   1.065  43.086 -20.502
   29    HB   VAL   4           HB       VAL   4  -1.893  42.885 -21.000
   30   1HG1  VAL   4          1HG1      VAL   4  -1.886  41.722 -18.839
   31   2HG1  VAL   4          2HG1      VAL   4  -0.133  41.904 -18.764
   32   3HG1  VAL   4          3HG1      VAL   4  -0.864  40.925 -20.034
   33   1HG2  VAL   4          1HG2      VAL   4  -0.528  44.462 -18.824
   34   2HG2  VAL   4          2HG2      VAL   4  -2.260  44.150 -18.937
   35   3HG2  VAL   4          3HG2      VAL   4  -1.458  45.129 -20.166
   36    H    THR   5           H        THR   5   1.229  40.924 -20.988
   37    HA   THR   5           HA       THR   5   1.071  40.328 -23.820
   38    HB   THR   5           HB       THR   5   2.307  38.211 -23.081
   39    HG1  THR   5           1HG      THR   5   1.679  38.558 -20.797
   40   1HG2  THR   5          1HG2      THR   5   3.579  40.903 -22.582
   41   2HG2  THR   5          2HG2      THR   5   3.430  40.098 -24.145
   42   3HG2  THR   5          3HG2      THR   5   4.444  39.395 -22.882
   43    HA   PRO   6           HA       PRO   6  -2.459  37.708 -23.045
   44   1HB   PRO   6          2HB       PRO   6  -3.102  37.400 -25.673
   45   2HB   PRO   6          1HB       PRO   6  -3.527  38.832 -24.736
   46   1HG   PRO   6          2HG       PRO   6  -1.598  38.553 -26.883
   47   2HG   PRO   6          1HG       PRO   6  -2.242  40.024 -26.142
   48   1HD   PRO   6          2HD       PRO   6   0.299  38.687 -25.652
   49   2HD   PRO   6          1HD       PRO   6  -0.243  40.282 -25.098
   50    H    ALA   7           H        ALA   7  -3.008  35.576 -23.512
   51    HA   ALA   7           HA       ALA   7  -2.437  33.360 -23.354
   52   1HB   ALA   7          1HB       ALA   7  -2.695  33.652 -25.783
   53   2HB   ALA   7          2HB       ALA   7  -1.524  32.399 -25.370
   54   3HB   ALA   7          3HB       ALA   7  -0.970  33.985 -25.903
   55    H    HIS   8           H        HIS   8  -0.982  34.880 -21.784
   56    HA   HIS   8           HA       HIS   8   1.813  34.270 -21.923
   57   1HB   HIS   8          2HB       HIS   8   0.984  36.291 -20.776
   58   2HB   HIS   8          1HB       HIS   8   0.089  35.285 -19.647
   59    HD1  HIS   8           1HD      HIS   8   1.394  34.285 -17.673
   60    HD2  HIS   8           2HD      HIS   8   3.772  36.361 -20.373
   61    HE1  HIS   8           1HE      HIS   8   3.650  34.539 -16.572
   62    H    GLU   9           H        GLU   9  -0.935  32.535 -21.294
   63    HA   GLU   9           HA       GLU   9  -0.366  31.068 -19.001
   64   1HB   GLU   9          2HB       GLU   9  -2.108  30.694 -21.326
   65   2HB   GLU   9          1HB       GLU   9  -1.625  29.205 -20.525
   66   1HG   GLU   9          2HG       GLU   9  -3.258  31.462 -19.510
   67   2HG   GLU   9          1HG       GLU   9  -3.541  29.724 -19.419
   68    H    ALA  10           H        ALA  10   0.774  29.378 -18.495
   69    HA   ALA  10           HA       ALA  10   2.218  27.960 -20.623
   70   1HB   ALA  10          1HB       ALA  10   3.211  28.494 -17.816
   71   2HB   ALA  10          2HB       ALA  10   3.783  29.302 -19.276
   72   3HB   ALA  10          3HB       ALA  10   4.062  27.575 -19.059
   73    H    VAL  11           H        VAL  11  -0.030  27.059 -20.360
   74    HA   VAL  11           HA       VAL  11  -0.711  25.371 -18.238
   75    HB   VAL  11           HB       VAL  11  -1.503  25.148 -21.117
   76   1HG1  VAL  11          1HG1      VAL  11  -3.457  23.910 -20.295
   77   2HG1  VAL  11          2HG1      VAL  11  -2.786  23.962 -18.664
   78   3HG1  VAL  11          3HG1      VAL  11  -1.947  23.073 -19.936
   79   1HG2  VAL  11          1HG2      VAL  11  -2.066  27.312 -20.200
   80   2HG2  VAL  11          2HG2      VAL  11  -2.842  26.545 -18.815
   81   3HG2  VAL  11          3HG2      VAL  11  -3.529  26.355 -20.428
   82    H    VAL  12           H        VAL  12   0.960  24.761 -21.262
   83    HA   VAL  12           HA       VAL  12   1.737  22.878 -22.213
   84    HB   VAL  12           HB       VAL  12   3.642  23.885 -21.294
   85   1HG1  VAL  12          1HG1      VAL  12   3.131  22.391 -18.732
   86   2HG1  VAL  12          2HG1      VAL  12   2.968  24.130 -18.982
   87   3HG1  VAL  12          3HG1      VAL  12   4.558  23.368 -19.084
   88   1HG2  VAL  12          1HG2      VAL  12   5.139  21.961 -21.007
   89   2HG2  VAL  12          2HG2      VAL  12   4.003  21.744 -22.340
   90   3HG2  VAL  12          3HG2      VAL  12   3.729  20.921 -20.806
   91    H    ARG  13           H        ARG  13   0.049  21.577 -22.251
   92    HA   ARG  13           HA       ARG  13  -1.186  19.741 -22.025
   93   1HB   ARG  13          2HB       ARG  13   1.417  19.052 -21.065
   94   2HB   ARG  13          1HB       ARG  13   0.176  18.014 -20.387
   95   1HG   ARG  13          2HG       ARG  13   0.971  18.412 -23.240
   96   2HG   ARG  13          1HG       ARG  13   0.882  16.916 -22.314
   97   1HD   ARG  13          2HD       ARG  13  -1.402  18.577 -23.344
   98   2HD   ARG  13          1HD       ARG  13  -0.953  16.947 -23.835
   99    HE   ARG  13           HE       ARG  13  -1.617  17.212 -21.041
  100   1HH1  ARG  13          1HH1      ARG  13  -2.796  16.560 -24.266
  101   2HH1  ARG  13          2HH1      ARG  13  -4.244  15.754 -23.726
  102   1HH2  ARG  13          1HH2      ARG  13  -3.513  16.151 -20.304
  103   2HH2  ARG  13          2HH2      ARG  13  -4.655  15.517 -21.463
  104    H    VAL  14           H        VAL  14  -2.923  19.240 -20.875
  105    HA   VAL  14           HA       VAL  14  -3.131  20.143 -18.139
  106    HB   VAL  14           HB       VAL  14  -5.283  18.682 -19.604
  107   1HG1  VAL  14          1HG1      VAL  14  -5.692  19.183 -17.285
  108   2HG1  VAL  14          2HG1      VAL  14  -6.750  20.169 -18.294
  109   3HG1  VAL  14          3HG1      VAL  14  -5.317  20.885 -17.555
  110   1HG2  VAL  14          1HG2      VAL  14  -6.098  20.798 -20.556
  111   2HG2  VAL  14          2HG2      VAL  14  -4.519  20.351 -21.201
  112   3HG2  VAL  14          3HG2      VAL  14  -4.643  21.607 -19.970
  113    H    GLY  15           H        GLY  15  -3.988  18.697 -16.562
  114   1HA   GLY  15          2HA       GLY  15  -3.817  15.901 -16.914
  115   2HA   GLY  15          1HA       GLY  15  -2.441  16.552 -16.046
  116    H    THR  16           H        THR  16  -5.906  16.145 -16.029
  117    HA   THR  16           HA       THR  16  -6.456  17.114 -13.467
  118    HB   THR  16           HB       THR  16  -7.913  14.814 -14.738
  119    HG1  THR  16           1HG      THR  16  -8.875  17.278 -15.429
  120   1HG2  THR  16          1HG2      THR  16  -8.657  15.537 -12.536
  121   2HG2  THR  16          2HG2      THR  16  -9.866  15.924 -13.761
  122   3HG2  THR  16          3HG2      THR  16  -8.818  17.190 -13.124
  123    H    LYS  17           H        LYS  17  -5.464  14.032 -14.668
  124    HA   LYS  17           HA       LYS  17  -4.856  13.164 -11.923
  125   1HB   LYS  17          2HB       LYS  17  -5.398  11.226 -14.162
  126   2HB   LYS  17          1HB       LYS  17  -5.354  10.909 -12.438
  127   1HG   LYS  17          2HG       LYS  17  -7.602  10.818 -12.865
  128   2HG   LYS  17          1HG       LYS  17  -7.413  12.504 -12.376
  129   1HD   LYS  17          2HD       LYS  17  -8.818  12.219 -14.397
  130   2HD   LYS  17          1HD       LYS  17  -7.390  13.221 -14.669
  131   1HE   LYS  17          2HE       LYS  17  -7.769  11.653 -16.517
  132   2HE   LYS  17          1HE       LYS  17  -6.241  11.344 -15.700
  133   1HZ   LYS  17          1HZ       LYS  17  -8.754   9.843 -15.209
  134   2HZ   LYS  17          2HZ       LYS  17  -7.236   9.502 -14.539
  135   3HZ   LYS  17          3HZ       LYS  17  -7.491   9.309 -16.206
  136    HA   PRO  18           HA       PRO  18  -0.858  13.466 -14.245
  137   1HB   PRO  18          2HB       PRO  18  -0.007  13.842 -11.417
  138   2HB   PRO  18          1HB       PRO  18   0.490  14.719 -12.874
  139   1HG   PRO  18          2HG       PRO  18  -1.175  15.894 -11.233
  140   2HG   PRO  18          1HG       PRO  18  -1.509  15.917 -12.979
  141   1HD   PRO  18          2HD       PRO  18  -2.675  14.088 -10.888
  142   2HD   PRO  18          1HD       PRO  18  -3.528  15.068 -12.104
  143    H    GLY  19           H        GLY  19  -0.216  11.641 -14.791
  144   1HA   GLY  19          2HA       GLY  19   1.468   9.965 -13.753
  145   2HA   GLY  19          1HA       GLY  19   0.044   9.446 -12.868
  146    H    THR  20           H        THR  20   0.597  10.357 -16.251
  147    HA   THR  20           HA       THR  20  -0.740   8.073 -17.293
  148    HB   THR  20           HB       THR  20   1.300   9.839 -18.669
  149    HG1  THR  20           1HG      THR  20  -0.233  11.291 -18.860
  150   1HG2  THR  20          1HG2      THR  20  -0.886   8.080 -19.779
  151   2HG2  THR  20          2HG2      THR  20   0.846   7.762 -19.864
  152   3HG2  THR  20          3HG2      THR  20   0.159   9.140 -20.724
  153    H    GLU  21           H        GLU  21   2.527   8.889 -16.417
  154    HA   GLU  21           HA       GLU  21   3.317   6.117 -16.823
  155   1HB   GLU  21          2HB       GLU  21   5.021   8.587 -17.185
  156   2HB   GLU  21          1HB       GLU  21   5.639   6.939 -17.198
  157   1HG   GLU  21          2HG       GLU  21   4.261   6.439 -19.152
  158   2HG   GLU  21          1HG       GLU  21   3.640   8.089 -19.135
  159    H    VAL  22           H        VAL  22   3.920   5.148 -15.050
  160    HA   VAL  22           HA       VAL  22   3.742   6.466 -12.536
  161    HB   VAL  22           HB       VAL  22   4.803   3.693 -13.106
  162   1HG1  VAL  22          1HG1      VAL  22   5.270   4.483 -10.840
  163   2HG1  VAL  22          2HG1      VAL  22   4.074   3.186 -10.830
  164   3HG1  VAL  22          3HG1      VAL  22   3.561   4.859 -10.616
  165   1HG2  VAL  22          1HG2      VAL  22   2.516   2.907 -12.736
  166   2HG2  VAL  22          2HG2      VAL  22   2.609   3.990 -14.127
  167   3HG2  VAL  22          3HG2      VAL  22   1.967   4.576 -12.592
  168    HA   PRO  23           HA       PRO  23   7.835   8.095 -12.187
  169   1HB   PRO  23          2HB       PRO  23   7.381   7.578  -9.288
  170   2HB   PRO  23          1HB       PRO  23   7.878   9.065 -10.102
  171   1HG   PRO  23          2HG       PRO  23   5.389   8.757  -9.198
  172   2HG   PRO  23          1HG       PRO  23   5.719   9.611 -10.715
  173   1HD   PRO  23          2HD       PRO  23   4.635   6.883 -10.263
  174   2HD   PRO  23          1HD       PRO  23   4.265   8.046 -11.550
  175    HA   PRO  24           HA       PRO  24  10.268   4.383 -12.208
  176   1HB   PRO  24          2HB       PRO  24  12.683   5.746 -11.957
  177   2HB   PRO  24          1HB       PRO  24  11.862   5.369 -13.477
  178   1HG   PRO  24          2HG       PRO  24  11.801   7.892 -11.862
  179   2HG   PRO  24          1HG       PRO  24  11.886   7.685 -13.625
  180   1HD   PRO  24          2HD       PRO  24   9.579   8.324 -12.493
  181   2HD   PRO  24          1HD       PRO  24   9.631   7.100 -13.780
  182    H    VAL  25           H        VAL  25  11.104   3.102 -10.745
  183    HA   VAL  25           HA       VAL  25  11.113   3.868  -7.991
  184    HB   VAL  25           HB       VAL  25  10.259   1.724  -8.381
  185   1HG1  VAL  25          1HG1      VAL  25  11.513  -0.040  -9.628
  186   2HG1  VAL  25          2HG1      VAL  25  12.680   1.196 -10.102
  187   3HG1  VAL  25          3HG1      VAL  25  10.999   1.318 -10.627
  188   1HG2  VAL  25          1HG2      VAL  25  11.797   0.175  -7.288
  189   2HG2  VAL  25          2HG2      VAL  25  11.759   1.745  -6.485
  190   3HG2  VAL  25          3HG2      VAL  25  13.112   1.322  -7.535
  191    H    ILE  26           H        ILE  26  12.755   4.751  -6.998
  192    HA   ILE  26           HA       ILE  26  15.451   4.523  -8.033
  193    HB   ILE  26           HB       ILE  26  14.494   6.102  -5.646
  194   1HG1  ILE  26          2HG1      ILE  26  13.400   6.876  -7.697
  195   2HG1  ILE  26          1HG1      ILE  26  14.573   8.061  -7.140
  196   1HG2  ILE  26          1HG2      ILE  26  17.062   6.262  -7.226
  197   2HG2  ILE  26          2HG2      ILE  26  16.884   5.638  -5.585
  198   3HG2  ILE  26          3HG2      ILE  26  16.592   7.346  -5.915
  199   1HD1  ILE  26          1HD1      ILE  26  16.164   7.267  -8.821
  200   2HD1  ILE  26          2HD1      ILE  26  14.657   7.826  -9.547
  201   3HD1  ILE  26          3HD1      ILE  26  14.971   6.100  -9.387
  202    H    ASP  27           H        ASP  27  13.765   3.870  -5.035
  203    HA   ASP  27           HA       ASP  27  15.954   2.167  -4.131
  204   1HB   ASP  27          2HB       ASP  27  14.432   4.167  -2.436
  205   2HB   ASP  27          1HB       ASP  27  15.643   3.037  -1.844
  206    H    GLY  28           H        GLY  28  13.531   1.530  -5.439
  207   1HA   GLY  28          2HA       GLY  28  11.594   0.609  -3.551
  208   2HA   GLY  28          1HA       GLY  28  11.693   0.147  -5.247
  209    H    SER  29           H        SER  29  14.663  -0.302  -4.226
  210    HA   SER  29           HA       SER  29  14.480  -3.128  -3.887
  211   1HB   SER  29          2HB       SER  29  16.767  -1.312  -3.143
  212   2HB   SER  29          1HB       SER  29  16.854  -3.042  -3.476
  213    HG   SER  29           HG       SER  29  16.997  -2.602  -5.512
  214    H    ILE  30           H        ILE  30  14.782  -0.397  -1.776
  215    HA   ILE  30           HA       ILE  30  15.015  -1.863   0.668
  216    HB   ILE  30           HB       ILE  30  13.653   0.746   0.919
  217   1HG1  ILE  30          2HG1      ILE  30  15.011   1.244  -1.090
  218   2HG1  ILE  30          1HG1      ILE  30  15.565   2.138   0.317
  219   1HG2  ILE  30          1HG2      ILE  30  16.210  -0.332   2.068
  220   2HG2  ILE  30          2HG2      ILE  30  14.609  -0.400   2.805
  221   3HG2  ILE  30          3HG2      ILE  30  15.401   1.156   2.556
  222   1HD1  ILE  30          1HD1      ILE  30  17.405   0.562   0.597
  223   2HD1  ILE  30          2HD1      ILE  30  17.426   1.316  -0.996
  224   3HD1  ILE  30          3HD1      ILE  30  16.846  -0.339  -0.812
  225    H    TRP  31           H        TRP  31  12.509  -0.633  -1.364
  226    HA   TRP  31           HA       TRP  31  10.384  -1.047   0.479
  227   1HB   TRP  31          2HB       TRP  31  10.377  -0.525  -2.514
  228   2HB   TRP  31          1HB       TRP  31   8.921  -0.633  -1.517
  229    HD1  TRP  31           HD       TRP  31  10.800   1.969  -2.955
  230    HE1  TRP  31           1HE      TRP  31  10.784   4.145  -1.555
  231    HE3  TRP  31           3HE      TRP  31   9.260   0.030   1.455
  232    HZ2  TRP  31           2HZ      TRP  31  10.195   4.893   1.080
  233    HZ3  TRP  31           3HZ      TRP  31   9.006   1.519   3.391
  234    HH2  TRP  31           HH       TRP  31   9.469   3.903   3.202
  235    H    ASP  32           H        ASP  32  11.812  -2.931  -2.112
  236    HA   ASP  32           HA       ASP  32   9.875  -5.016  -1.953
  237   1HB   ASP  32          2HB       ASP  32  11.038  -4.657  -4.020
  238   2HB   ASP  32          1HB       ASP  32  12.606  -4.865  -3.230
  239    H    ALA  33           H        ALA  33  13.045  -4.393  -0.479
  240    HA   ALA  33           HA       ALA  33  13.251  -6.981   0.650
  241   1HB   ALA  33          1HB       ALA  33  14.549  -4.421   1.554
  242   2HB   ALA  33          2HB       ALA  33  15.201  -5.540   0.357
  243   3HB   ALA  33          3HB       ALA  33  15.017  -6.050   2.037
  244    H    ILE  34           H        ILE  34  11.841  -3.937   1.687
  245    HA   ILE  34           HA       ILE  34  11.027  -4.776   4.276
  246    HB   ILE  34           HB       ILE  34   9.982  -2.688   2.388
  247   1HG1  ILE  34          2HG1      ILE  34  11.503  -2.515   5.000
  248   2HG1  ILE  34          1HG1      ILE  34  12.193  -2.292   3.400
  249   1HG2  ILE  34          1HG2      ILE  34   8.614  -1.811   4.234
  250   2HG2  ILE  34          2HG2      ILE  34   9.051  -3.213   5.210
  251   3HG2  ILE  34          3HG2      ILE  34   8.100  -3.424   3.740
  252   1HD1  ILE  34          1HD1      ILE  34  10.805  -0.305   3.084
  253   2HD1  ILE  34          2HD1      ILE  34  11.847  -0.169   4.500
  254   3HD1  ILE  34          3HD1      ILE  34  10.133  -0.529   4.700
  255    H    ALA  35           H        ALA  35   9.457  -4.837   1.096
  256    HA   ALA  35           HA       ALA  35   7.050  -6.050   1.820
  257   1HB   ALA  35          1HB       ALA  35   7.495  -5.145  -0.409
  258   2HB   ALA  35          2HB       ALA  35   6.928  -6.812  -0.487
  259   3HB   ALA  35          3HB       ALA  35   8.639  -6.453  -0.708
  260    H    GLY  36           H        GLY  36  10.219  -7.370   1.158
  261   1HA   GLY  36          2HA       GLY  36   9.391 -10.123   1.346
  262   2HA   GLY  36          1HA       GLY  36  11.049  -9.530   1.323
  263    H    CYS  37           H        CYS  37   9.856  -7.690   3.567
  264    HA   CYS  37           HA       CYS  37  10.786  -9.397   5.707
  265   1HB   CYS  37          2HB       CYS  37  11.797  -7.251   5.643
  266   2HB   CYS  37          1HB       CYS  37  10.243  -6.448   5.472
  267    H    GLU  38           H        GLU  38   8.010  -7.133   5.357
  268    HA   GLU  38           HA       GLU  38   6.759  -8.589   7.565
  269   1HB   GLU  38          2HB       GLU  38   6.052  -5.967   6.253
  270   2HB   GLU  38          1HB       GLU  38   5.014  -6.752   7.435
  271   1HG   GLU  38          2HG       GLU  38   6.988  -6.729   9.001
  272   2HG   GLU  38          1HG       GLU  38   7.786  -5.676   7.835
  273    H    ALA  39           H        ALA  39   6.348  -7.959   4.162
  274    HA   ALA  39           HA       ALA  39   3.722  -9.112   4.143
  275   1HB   ALA  39          1HB       ALA  39   5.420  -8.228   1.831
  276   2HB   ALA  39          2HB       ALA  39   4.228  -7.236   2.671
  277   3HB   ALA  39          3HB       ALA  39   3.711  -8.657   1.762
  278    H    GLY  40           H        GLY  40   6.916 -10.218   3.858
  279   1HA   GLY  40          2HA       GLY  40   7.667 -12.418   3.661
  280   2HA   GLY  40          1HA       GLY  40   6.007 -12.921   3.340
  281    H    GLY  41           H        GLY  41   6.978 -10.254   1.606
  282   1HA   GLY  41          2HA       GLY  41   7.656  -9.907  -0.536
  283   2HA   GLY  41          1HA       GLY  41   8.012 -11.626  -0.705
  284    H    ASN  42           H        ASN  42   5.198  -9.490  -0.218
  285    HA   ASN  42           HA       ASN  42   3.897 -10.582  -2.527
  286   1HB   ASN  42          2HB       ASN  42   3.333 -12.214  -0.680
  287   2HB   ASN  42          1HB       ASN  42   2.540 -10.878   0.157
  288   1HD2  ASN  42          1HD2      ASN  42   1.373 -13.325  -0.842
  289   2HD2  ASN  42          2HD2      ASN  42   0.138 -12.833  -1.959
  290    H    TRP  43           H        TRP  43   2.844  -9.000  -3.432
  291    HA   TRP  43           HA       TRP  43   2.625  -6.498  -1.919
  292   1HB   TRP  43          2HB       TRP  43   2.559  -7.024  -4.885
  293   2HB   TRP  43          1HB       TRP  43   2.472  -5.431  -4.135
  294    HD1  TRP  43           HD       TRP  43   4.873  -8.454  -4.230
  295    HE1  TRP  43           1HE      TRP  43   7.282  -7.573  -4.089
  296    HE3  TRP  43           3HE      TRP  43   3.871  -3.485  -3.694
  297    HZ2  TRP  43           2HZ      TRP  43   8.606  -5.063  -3.772
  298    HZ3  TRP  43           3HZ      TRP  43   5.731  -1.898  -3.499
  299    HH2  TRP  43           HH       TRP  43   8.063  -2.694  -3.557
  300    H    ALA  44           H        ALA  44   0.769  -9.012  -2.973
  301    HA   ALA  44           HA       ALA  44  -1.691  -7.386  -3.036
  302   1HB   ALA  44          1HB       ALA  44  -1.306  -8.698  -5.058
  303   2HB   ALA  44          2HB       ALA  44  -2.742  -9.258  -4.199
  304   3HB   ALA  44          3HB       ALA  44  -1.236 -10.172  -4.093
  305    H    ILE  45           H        ILE  45   0.017  -8.844  -0.812
  306    HA   ILE  45           HA       ILE  45  -1.775 -10.698   0.334
  307    HB   ILE  45           HB       ILE  45   0.763 -10.637   0.617
  308   1HG1  ILE  45          2HG1      ILE  45  -0.951 -10.856   3.094
  309   2HG1  ILE  45          1HG1      ILE  45  -0.750 -12.108   1.876
  310   1HG2  ILE  45          1HG2      ILE  45   1.615  -9.344   2.514
  311   2HG2  ILE  45          2HG2      ILE  45   0.042  -8.566   2.683
  312   3HG2  ILE  45          3HG2      ILE  45   1.004  -8.304   1.228
  313   1HD1  ILE  45          1HD1      ILE  45   0.615 -12.553   3.834
  314   2HD1  ILE  45          2HD1      ILE  45   1.424 -10.999   3.632
  315   3HD1  ILE  45          3HD1      ILE  45   1.622 -12.262   2.414
  316    H    ASN  46           H        ASN  46  -3.109 -10.469   2.067
  317    HA   ASN  46           HA       ASN  46  -3.525  -7.781   3.188
  318   1HB   ASN  46          2HB       ASN  46  -5.425  -9.341   1.565
  319   2HB   ASN  46          1HB       ASN  46  -6.080  -8.796   3.103
  320   1HD2  ASN  46          1HD2      ASN  46  -3.631  -7.024   1.346
  321   2HD2  ASN  46          2HD2      ASN  46  -4.651  -5.693   0.892
  322    H    THR  47           H        THR  47  -2.646  -8.324   5.098
  323    HA   THR  47           HA       THR  47  -3.210 -10.789   6.390
  324    HB   THR  47           HB       THR  47  -2.132  -9.456   8.388
  325    HG1  THR  47           1HG      THR  47  -0.890  -7.691   7.607
  326   1HG2  THR  47          1HG2      THR  47  -0.602 -10.122   5.864
  327   2HG2  THR  47          2HG2      THR  47  -1.005 -11.248   7.160
  328   3HG2  THR  47          3HG2      THR  47   0.106  -9.914   7.467
  329    H    GLY  48           H        GLY  48  -4.859  -7.841   6.137
  330   1HA   GLY  48          2HA       GLY  48  -7.080  -7.521   6.744
  331   2HA   GLY  48          1HA       GLY  48  -6.954  -8.890   7.842
  332    H    ASN  49           H        ASN  49  -4.517  -6.459   7.861
  333    HA   ASN  49           HA       ASN  49  -5.420  -5.775  10.561
  334   1HB   ASN  49          2HB       ASN  49  -3.125  -5.199  11.087
  335   2HB   ASN  49          1HB       ASN  49  -3.185  -6.812  10.386
  336   1HD2  ASN  49          1HD2      ASN  49  -0.930  -5.057  10.556
  337   2HD2  ASN  49          2HD2      ASN  49  -0.415  -4.739   8.937
  338    H    GLY  50           H        GLY  50  -5.979  -4.530   7.741
  339   1HA   GLY  50          2HA       GLY  50  -6.761  -2.381   7.249
  340   2HA   GLY  50          1HA       GLY  50  -5.983  -1.785   8.709
  341    H    TYR  51           H        TYR  51  -3.736  -3.619   7.278
  342    HA   TYR  51           HA       TYR  51  -2.648  -1.399   5.697
  343   1HB   TYR  51          2HB       TYR  51  -0.923  -3.492   7.036
  344   2HB   TYR  51          1HB       TYR  51  -0.415  -1.999   6.293
  345    HD1  TYR  51           1HD      TYR  51   0.880  -2.281   8.602
  346    HD2  TYR  51           2HD      TYR  51  -3.199  -1.145   8.215
  347    HE1  TYR  51           1HE      TYR  51   0.976  -1.228  10.820
  348    HE2  TYR  51           2HE      TYR  51  -3.114  -0.092  10.444
  349    HH   TYR  51           HH       TYR  51  -1.762  -0.323  12.540
  350    H    TYR  52           H        TYR  52  -1.514  -2.073   3.792
  351    HA   TYR  52           HA       TYR  52  -2.651  -4.635   2.905
  352   1HB   TYR  52          2HB       TYR  52  -2.274  -2.147   1.250
  353   2HB   TYR  52          1HB       TYR  52  -3.074  -3.637   0.745
  354    HD1  TYR  52           1HD      TYR  52  -3.554  -0.436   2.101
  355    HD2  TYR  52           2HD      TYR  52  -5.046  -4.405   2.315
  356    HE1  TYR  52           1HE      TYR  52  -5.646   0.415   3.066
  357    HE2  TYR  52           2HE      TYR  52  -7.159  -3.576   3.248
  358    HH   TYR  52           HH       TYR  52  -8.029  -0.316   3.204
  359    H    GLY  53           H        GLY  53  -1.592  -5.483   0.875
  360   1HA   GLY  53          2HA       GLY  53   0.874  -6.384   1.810
  361   2HA   GLY  53          1HA       GLY  53   0.196  -6.732   0.231
  362    H    GLY  54           H        GLY  54   2.712  -6.699   0.180
  363   1HA   GLY  54          2HA       GLY  54   4.358  -5.770  -1.157
  364   2HA   GLY  54          1HA       GLY  54   3.424  -4.281  -1.251
  365    H    VAL  55           H        VAL  55   4.061  -2.607  -0.050
  366    HA   VAL  55           HA       VAL  55   6.325  -2.971   1.723
  367    HB   VAL  55           HB       VAL  55   5.915  -0.397   2.037
  368   1HG1  VAL  55          1HG1      VAL  55   7.333   0.012   0.104
  369   2HG1  VAL  55          2HG1      VAL  55   6.926  -1.581  -0.539
  370   3HG1  VAL  55          3HG1      VAL  55   7.842  -1.441   0.961
  371   1HG2  VAL  55          1HG2      VAL  55   3.729  -0.439   0.853
  372   2HG2  VAL  55          2HG2      VAL  55   4.589  -0.864  -0.629
  373   3HG2  VAL  55          3HG2      VAL  55   4.898   0.683   0.156
  374    H    GLN  56           H        GLN  56   3.074  -3.179   1.969
  375    HA   GLN  56           HA       GLN  56   1.751  -3.735   3.701
  376   1HB   GLN  56          2HB       GLN  56   3.803  -5.197   4.004
  377   2HB   GLN  56          1HB       GLN  56   4.296  -4.091   5.278
  378   1HG   GLN  56          2HG       GLN  56   3.228  -5.979   6.271
  379   2HG   GLN  56          1HG       GLN  56   2.170  -4.580   6.451
  380   1HE2  GLN  56          1HE2      GLN  56   0.245  -4.512   5.347
  381   2HE2  GLN  56          2HE2      GLN  56  -0.435  -5.889   4.567
  382    H    PHE  57           H        PHE  57   1.829  -0.986   3.515
  383    HA   PHE  57           HA       PHE  57   1.673  -0.393   6.375
  384   1HB   PHE  57          2HB       PHE  57   2.020   1.973   5.974
  385   2HB   PHE  57          1HB       PHE  57   3.404   1.009   5.512
  386    HD1  PHE  57           1HD      PHE  57   1.768   3.847   4.709
  387    HD2  PHE  57           2HD      PHE  57   3.098   0.280   2.807
  388    HE1  PHE  57           1HE      PHE  57   1.922   5.054   2.567
  389    HE2  PHE  57           2HE      PHE  57   3.237   1.483   0.663
  390    HZ   PHE  57           HZ       PHE  57   2.678   3.875   0.527
  391    H    ASP  58           H        ASP  58   0.126   1.642   6.709
  392    HA   ASP  58           HA       ASP  58  -2.301   0.190   6.379
  393   1HB   ASP  58          2HB       ASP  58  -3.287   1.833   7.884
  394   2HB   ASP  58          1HB       ASP  58  -1.772   1.195   8.509
  395    H    GLN  59           H        GLN  59  -4.342   1.106   5.900
  396    HA   GLN  59           HA       GLN  59  -4.633   2.139   3.362
  397   1HB   GLN  59          2HB       GLN  59  -6.356   0.929   4.625
  398   2HB   GLN  59          1HB       GLN  59  -6.479   2.273   5.748
  399   1HG   GLN  59          2HG       GLN  59  -8.302   2.482   4.311
  400   2HG   GLN  59          1HG       GLN  59  -7.138   3.696   3.791
  401   1HE2  GLN  59          1HE2      GLN  59  -6.018   3.377   1.827
  402   2HE2  GLN  59          2HE2      GLN  59  -6.606   2.273   0.620
  403    H    GLY  60           H        GLY  60  -4.567   3.740   6.478
  404   1HA   GLY  60          2HA       GLY  60  -5.547   6.256   5.597
  405   2HA   GLY  60          1HA       GLY  60  -4.756   5.934   7.132
  406    H    THR  61           H        THR  61  -2.287   5.167   6.464
  407    HA   THR  61           HA       THR  61  -0.975   7.551   5.760
  408    HB   THR  61           HB       THR  61   0.046   4.746   5.850
  409    HG1  THR  61           1HG      THR  61  -0.132   5.016   7.924
  410   1HG2  THR  61          1HG2      THR  61   1.564   7.351   5.925
  411   2HG2  THR  61          2HG2      THR  61   1.568   6.192   4.595
  412   3HG2  THR  61          3HG2      THR  61   2.265   5.749   6.154
  413    H    TRP  62           H        TRP  62  -1.671   4.607   3.928
  414    HA   TRP  62           HA       TRP  62  -0.361   5.211   1.538
  415   1HB   TRP  62          2HB       TRP  62  -1.407   3.054   1.998
  416   2HB   TRP  62          1HB       TRP  62  -2.987   3.825   2.082
  417    HD1  TRP  62           HD       TRP  62  -4.230   4.351  -0.162
  418    HE1  TRP  62           1HE      TRP  62  -3.861   3.587  -2.583
  419    HE3  TRP  62           3HE      TRP  62   0.509   2.498   0.306
  420    HZ2  TRP  62           2HZ      TRP  62  -1.810   2.341  -4.124
  421    HZ3  TRP  62           3HZ      TRP  62   1.613   1.543  -1.670
  422    HH2  TRP  62           HH       TRP  62   0.500   1.456  -3.836
  423    H    GLU  63           H        GLU  63  -3.630   5.923   2.638
  424    HA   GLU  63           HA       GLU  63  -4.466   7.385   0.394
  425   1HB   GLU  63          2HB       GLU  63  -6.021   6.437   1.995
  426   2HB   GLU  63          1HB       GLU  63  -5.377   7.453   3.276
  427   1HG   GLU  63          2HG       GLU  63  -6.133   9.435   1.915
  428   2HG   GLU  63          1HG       GLU  63  -7.001   8.287   0.894
  429    H    ALA  64           H        ALA  64  -2.773   8.292   3.327
  430    HA   ALA  64           HA       ALA  64  -3.277  11.070   3.235
  431   1HB   ALA  64          1HB       ALA  64  -0.956   9.638   4.530
  432   2HB   ALA  64          2HB       ALA  64  -2.531   9.924   5.271
  433   3HB   ALA  64          3HB       ALA  64  -1.485  11.286   4.870
  434    H    ASN  65           H        ASN  65  -0.546   9.134   2.039
  435    HA   ASN  65           HA       ASN  65   0.717  11.435   0.867
  436   1HB   ASN  65          2HB       ASN  65   1.300   8.488   0.490
  437   2HB   ASN  65          1HB       ASN  65   2.331   9.817  -0.034
  438   1HD2  ASN  65          1HD2      ASN  65   1.193   7.967   2.676
  439   2HD2  ASN  65          2HD2      ASN  65   2.338   8.586   3.824
  440    H    GLY  66           H        GLY  66  -1.842   9.424   0.021
  441   1HA   GLY  66          2HA       GLY  66  -3.302   9.982  -1.740
  442   2HA   GLY  66          1HA       GLY  66  -1.971  10.773  -2.568
  443    H    GLY  67           H        GLY  67  -2.489   7.476  -1.315
  444   1HA   GLY  67          2HA       GLY  67  -1.091   6.397  -3.583
  445   2HA   GLY  67          1HA       GLY  67  -1.758   5.494  -2.232
  446    H    LEU  68           H        LEU  68  -4.375   6.995  -2.748
  447    HA   LEU  68           HA       LEU  68  -5.591   4.834  -3.966
  448   1HB   LEU  68          2HB       LEU  68  -6.580   7.592  -3.357
  449   2HB   LEU  68          1HB       LEU  68  -7.614   6.365  -4.060
  450    HG   LEU  68           HG       LEU  68  -6.952   4.940  -2.034
  451   1HD1  LEU  68          1HD1      LEU  68  -5.115   6.256  -1.241
  452   2HD1  LEU  68          2HD1      LEU  68  -6.395   6.223  -0.028
  453   3HD1  LEU  68          3HD1      LEU  68  -6.167   7.654  -1.031
  454   1HD2  LEU  68          1HD2      LEU  68  -9.180   5.866  -2.387
  455   2HD2  LEU  68          2HD2      LEU  68  -8.666   7.389  -1.660
  456   3HD2  LEU  68          3HD2      LEU  68  -8.731   5.922  -0.684
  457    H    ARG  69           H        ARG  69  -4.223   7.671  -5.339
  458    HA   ARG  69           HA       ARG  69  -5.617   7.635  -7.804
  459   1HB   ARG  69          2HB       ARG  69  -3.740   8.990  -8.641
  460   2HB   ARG  69          1HB       ARG  69  -4.358   9.590  -7.105
  461   1HG   ARG  69          2HG       ARG  69  -2.534   8.739  -5.915
  462   2HG   ARG  69          1HG       ARG  69  -2.011   7.743  -7.273
  463   1HD   ARG  69          2HD       ARG  69  -0.567   9.672  -7.005
  464   2HD   ARG  69          1HD       ARG  69  -1.444   9.761  -8.532
  465    HE   ARG  69           HE       ARG  69  -3.009  11.312  -7.261
  466   1HH1  ARG  69          1HH1      ARG  69   0.410  11.040  -6.542
  467   2HH1  ARG  69          2HH1      ARG  69   0.540  12.662  -5.941
  468   1HH2  ARG  69          1HH2      ARG  69  -2.827  13.455  -6.493
  469   2HH2  ARG  69          2HH2      ARG  69  -1.299  14.036  -5.905
  470    H    TYR  70           H        TYR  70  -2.848   5.955  -6.505
  471    HA   TYR  70           HA       TYR  70  -2.077   4.803  -9.046
  472   1HB   TYR  70          2HB       TYR  70  -1.278   4.097  -6.215
  473   2HB   TYR  70          1HB       TYR  70  -0.425   3.616  -7.678
  474    HD1  TYR  70           1HD      TYR  70  -0.894   6.078  -5.149
  475    HD2  TYR  70           2HD      TYR  70   0.771   5.430  -9.004
  476    HE1  TYR  70           1HE      TYR  70   0.489   8.075  -4.876
  477    HE2  TYR  70           2HE      TYR  70   2.169   7.443  -8.747
  478    HH   TYR  70           HH       TYR  70   2.654   8.981  -5.807
  479    H    ALA  71           H        ALA  71  -3.841   4.167  -6.184
  480    HA   ALA  71           HA       ALA  71  -5.694   2.366  -7.043
  481   1HB   ALA  71          1HB       ALA  71  -4.897   0.195  -6.213
  482   2HB   ALA  71          2HB       ALA  71  -3.322   0.905  -5.853
  483   3HB   ALA  71          3HB       ALA  71  -3.872   0.777  -7.526
  484    HA   PRO  72           HA       PRO  72  -6.820   3.997  -3.072
  485   1HB   PRO  72          2HB       PRO  72  -8.876   1.947  -3.067
  486   2HB   PRO  72          1HB       PRO  72  -9.017   3.692  -2.971
  487   1HG   PRO  72          2HG       PRO  72  -9.650   2.249  -5.192
  488   2HG   PRO  72          1HG       PRO  72  -9.152   3.946  -5.218
  489   1HD   PRO  72          2HD       PRO  72  -7.678   1.547  -6.055
  490   2HD   PRO  72          1HD       PRO  72  -7.442   3.245  -6.512
  491    H    ARG  73           H        ARG  73  -5.732   0.868  -3.638
  492    HA   ARG  73           HA       ARG  73  -5.064   0.587  -0.822
  493   1HB   ARG  73          2HB       ARG  73  -5.836  -1.697  -0.643
  494   2HB   ARG  73          1HB       ARG  73  -7.193  -0.691  -1.136
  495   1HG   ARG  73          2HG       ARG  73  -6.568  -1.375  -3.519
  496   2HG   ARG  73          1HG       ARG  73  -5.609  -2.641  -2.746
  497   1HD   ARG  73          2HD       ARG  73  -8.535  -2.223  -2.159
  498   2HD   ARG  73          1HD       ARG  73  -7.973  -3.255  -3.471
  499    HE   ARG  73           HE       ARG  73  -6.638  -4.145  -1.242
  500   1HH1  ARG  73          1HH1      ARG  73 -10.001  -3.715  -2.139
  501   2HH1  ARG  73          2HH1      ARG  73 -10.555  -5.077  -1.221
  502   1HH2  ARG  73          1HH2      ARG  73  -7.382  -5.938  -0.013
  503   2HH2  ARG  73          2HH2      ARG  73  -9.073  -6.333  -0.008
  504    H    ALA  74           H        ALA  74  -3.119  -0.288  -0.548
  505    HA   ALA  74           HA       ALA  74  -1.248  -0.229  -2.570
  506   1HB   ALA  74          1HB       ALA  74  -0.865  -1.846  -0.071
  507   2HB   ALA  74          2HB       ALA  74  -0.856  -0.084  -0.070
  508   3HB   ALA  74          3HB       ALA  74   0.341  -0.974  -1.014
  509    H    ASP  75           H        ASP  75  -3.202  -2.931  -1.499
  510    HA   ASP  75           HA       ASP  75  -1.481  -4.873  -2.728
  511   1HB   ASP  75          2HB       ASP  75  -3.137  -6.526  -2.069
  512   2HB   ASP  75          1HB       ASP  75  -2.767  -5.460  -0.722
  513    H    LEU  76           H        LEU  76  -3.767  -2.751  -3.850
  514    HA   LEU  76           HA       LEU  76  -4.439  -4.368  -6.188
  515   1HB   LEU  76          2HB       LEU  76  -6.196  -2.981  -5.169
  516   2HB   LEU  76          1HB       LEU  76  -5.214  -1.551  -5.412
  517    HG   LEU  76           HG       LEU  76  -5.377  -1.880  -7.863
  518   1HD1  LEU  76          1HD1      LEU  76  -7.011  -3.460  -8.749
  519   2HD1  LEU  76          2HD1      LEU  76  -7.310  -4.074  -7.123
  520   3HD1  LEU  76          3HD1      LEU  76  -5.728  -4.294  -7.872
  521   1HD2  LEU  76          1HD2      LEU  76  -6.909  -0.382  -6.688
  522   2HD2  LEU  76          2HD2      LEU  76  -8.020  -1.724  -6.414
  523   3HD2  LEU  76          3HD2      LEU  76  -7.704  -1.163  -8.056
  524    H    ALA  77           H        ALA  77  -2.505  -1.684  -5.127
  525    HA   ALA  77           HA       ALA  77  -1.483  -1.015  -7.714
  526   1HB   ALA  77          1HB       ALA  77   0.011   0.459  -6.460
  527   2HB   ALA  77          2HB       ALA  77  -0.529  -0.274  -4.951
  528   3HB   ALA  77          3HB       ALA  77  -1.662   0.651  -5.937
  529    H    THR  78           H        THR  78   0.766  -1.226  -8.285
  530    HA   THR  78           HA       THR  78   1.873  -3.761  -7.315
  531    HB   THR  78           HB       THR  78   3.127  -3.875  -9.373
  532    HG1  THR  78           1HG      THR  78   2.091  -1.251  -9.842
  533   1HG2  THR  78          1HG2      THR  78   1.266  -3.866 -11.007
  534   2HG2  THR  78          2HG2      THR  78   0.272  -3.017  -9.818
  535   3HG2  THR  78          3HG2      THR  78   0.844  -4.652  -9.485
  536    H    ARG  79           H        ARG  79   4.505  -3.484  -7.987
  537    HA   ARG  79           HA       ARG  79   5.596  -2.447  -5.671
  538   1HB   ARG  79          2HB       ARG  79   6.877  -2.879  -8.368
  539   2HB   ARG  79          1HB       ARG  79   7.775  -2.505  -6.904
  540   1HG   ARG  79          2HG       ARG  79   6.885  -4.550  -5.871
  541   2HG   ARG  79          1HG       ARG  79   6.076  -4.931  -7.392
  542   1HD   ARG  79          2HD       ARG  79   7.963  -5.609  -8.370
  543   2HD   ARG  79          1HD       ARG  79   8.922  -4.318  -7.650
  544    HE   ARG  79           HE       ARG  79   8.871  -5.735  -5.575
  545   1HH1  ARG  79          1HH1      ARG  79   8.415  -7.147  -8.750
  546   2HH1  ARG  79          2HH1      ARG  79   9.194  -8.652  -8.345
  547   1HH2  ARG  79          1HH2      ARG  79   9.909  -7.729  -5.035
  548   2HH2  ARG  79          2HH2      ARG  79  10.039  -8.977  -6.244
  549    H    GLU  80           H        GLU  80   5.580  -1.044  -8.893
  550    HA   GLU  80           HA       GLU  80   7.004   1.264  -8.288
  551   1HB   GLU  80          2HB       GLU  80   5.645   2.136 -10.375
  552   2HB   GLU  80          1HB       GLU  80   6.896   0.914 -10.526
  553   1HG   GLU  80          2HG       GLU  80   4.120  -0.005 -10.082
  554   2HG   GLU  80          1HG       GLU  80   4.534   0.655 -11.665
  555    H    GLU  81           H        GLU  81   3.417   0.877  -8.408
  556    HA   GLU  81           HA       GLU  81   2.819   3.486  -7.602
  557   1HB   GLU  81          2HB       GLU  81   1.353   0.906  -7.138
  558   2HB   GLU  81          1HB       GLU  81   0.703   2.481  -6.724
  559   1HG   GLU  81          2HG       GLU  81  -0.257   1.957  -8.746
  560   2HG   GLU  81          1HG       GLU  81   1.021   3.086  -9.167
  561    H    GLN  82           H        GLN  82   3.197   0.545  -5.630
  562    HA   GLN  82           HA       GLN  82   2.598   1.740  -3.161
  563   1HB   GLN  82          2HB       GLN  82   4.402  -0.611  -3.748
  564   2HB   GLN  82          1HB       GLN  82   3.816  -0.169  -2.153
  565   1HG   GLN  82          2HG       GLN  82   1.471  -0.429  -3.177
  566   2HG   GLN  82          1HG       GLN  82   2.304  -1.303  -4.467
  567   1HE2  GLN  82          1HE2      GLN  82   1.414  -3.296  -3.963
  568   2HE2  GLN  82          2HE2      GLN  82   1.808  -4.153  -2.506
  569    H    ILE  83           H        ILE  83   5.607   1.359  -4.919
  570    HA   ILE  83           HA       ILE  83   7.343   2.339  -2.947
  571    HB   ILE  83           HB       ILE  83   7.528   2.138  -5.939
  572   1HG1  ILE  83          2HG1      ILE  83   9.347   0.918  -3.879
  573   2HG1  ILE  83          1HG1      ILE  83   7.787   0.185  -4.227
  574   1HG2  ILE  83          1HG2      ILE  83   9.646   3.284  -4.122
  575   2HG2  ILE  83          2HG2      ILE  83   8.740   4.174  -5.346
  576   3HG2  ILE  83          3HG2      ILE  83   9.853   2.894  -5.829
  577   1HD1  ILE  83          1HD1      ILE  83   9.563  -0.884  -5.473
  578   2HD1  ILE  83          2HD1      ILE  83  10.012   0.662  -6.194
  579   3HD1  ILE  83          3HD1      ILE  83   8.449  -0.064  -6.568
  580    H    ALA  84           H        ALA  84   5.564   3.998  -5.557
  581    HA   ALA  84           HA       ALA  84   6.693   6.540  -5.196
  582   1HB   ALA  84          1HB       ALA  84   4.749   7.385  -6.396
  583   2HB   ALA  84          2HB       ALA  84   3.913   5.850  -6.145
  584   3HB   ALA  84          3HB       ALA  84   5.360   5.914  -7.151
  585    H    VAL  85           H        VAL  85   3.838   5.056  -3.707
  586    HA   VAL  85           HA       VAL  85   3.040   7.328  -2.212
  587    HB   VAL  85           HB       VAL  85   2.525   4.406  -1.683
  588   1HG1  VAL  85          1HG1      VAL  85   0.548   5.180  -0.463
  589   2HG1  VAL  85          2HG1      VAL  85   1.027   6.853  -0.751
  590   3HG1  VAL  85          3HG1      VAL  85   2.033   5.808   0.250
  591   1HG2  VAL  85          1HG2      VAL  85   0.937   6.400  -3.283
  592   2HG2  VAL  85          2HG2      VAL  85   0.409   4.766  -2.875
  593   3HG2  VAL  85          3HG2      VAL  85   1.818   5.005  -3.908
  594    H    ALA  86           H        ALA  86   4.822   4.377  -1.351
  595    HA   ALA  86           HA       ALA  86   5.448   5.032   1.289
  596   1HB   ALA  86          1HB       ALA  86   7.221   3.365   1.094
  597   2HB   ALA  86          2HB       ALA  86   7.036   3.369  -0.659
  598   3HB   ALA  86          3HB       ALA  86   5.723   2.791   0.364
  599    H    GLU  87           H        GLU  87   6.813   6.009  -1.724
  600    HA   GLU  87           HA       GLU  87   9.309   6.992  -0.883
  601   1HB   GLU  87          2HB       GLU  87   7.483   7.717  -3.160
  602   2HB   GLU  87          1HB       GLU  87   8.932   8.665  -2.861
  603   1HG   GLU  87          2HG       GLU  87   8.826   5.721  -3.455
  604   2HG   GLU  87          1HG       GLU  87   9.295   6.999  -4.577
  605    H    VAL  88           H        VAL  88   6.156   8.623  -1.146
  606    HA   VAL  88           HA       VAL  88   7.071  11.114  -0.171
  607    HB   VAL  88           HB       VAL  88   4.266  10.024   0.192
  608   1HG1  VAL  88          1HG1      VAL  88   3.640  12.393   0.192
  609   2HG1  VAL  88          2HG1      VAL  88   5.334  12.848   0.010
  610   3HG1  VAL  88          3HG1      VAL  88   4.791  12.036   1.484
  611   1HG2  VAL  88          1HG2      VAL  88   5.425  11.525  -2.166
  612   2HG2  VAL  88          2HG2      VAL  88   3.726  11.099  -1.945
  613   3HG2  VAL  88          3HG2      VAL  88   4.934   9.831  -2.161
  614    H    THR  89           H        THR  89   5.796   8.245   1.389
  615    HA   THR  89           HA       THR  89   5.498   9.396   3.956
  616    HB   THR  89           HB       THR  89   6.027   6.480   3.652
  617    HG1  THR  89           1HG      THR  89   4.082   7.933   2.285
  618   1HG2  THR  89          1HG2      THR  89   4.219   6.326   5.241
  619   2HG2  THR  89          2HG2      THR  89   3.874   8.047   5.058
  620   3HG2  THR  89          3HG2      THR  89   5.389   7.526   5.795
  621    H    ARG  90           H        ARG  90   8.080   7.442   2.482
  622    HA   ARG  90           HA       ARG  90   9.563   7.136   4.865
  623   1HB   ARG  90          2HB       ARG  90  11.301   6.218   3.547
  624   2HB   ARG  90          1HB       ARG  90   9.801   5.739   2.773
  625   1HG   ARG  90          2HG       ARG  90  10.137   7.135   0.953
  626   2HG   ARG  90          1HG       ARG  90  11.267   8.169   1.833
  627   1HD   ARG  90          2HD       ARG  90  12.979   6.553   1.735
  628   2HD   ARG  90          1HD       ARG  90  11.866   5.288   1.224
  629    HE   ARG  90           HE       ARG  90  11.669   6.928  -0.834
  630   1HH1  ARG  90          1HH1      ARG  90  14.548   5.998   0.928
  631   2HH1  ARG  90          2HH1      ARG  90  15.570   6.015  -0.468
  632   1HH2  ARG  90          1HH2      ARG  90  12.994   6.962  -2.675
  633   2HH2  ARG  90          2HH2      ARG  90  14.691   6.556  -2.535
  634    H    LEU  91           H        LEU  91   9.459   9.649   2.473
  635    HA   LEU  91           HA       LEU  91  12.057  10.682   3.109
  636   1HB   LEU  91          2HB       LEU  91  11.574  12.520   1.605
  637   2HB   LEU  91          1HB       LEU  91  11.178  10.985   0.870
  638    HG   LEU  91           HG       LEU  91   8.733  11.535   1.578
  639   1HD1  LEU  91          1HD1      LEU  91   9.266  13.471   2.991
  640   2HD1  LEU  91          2HD1      LEU  91   8.229  13.926   1.637
  641   3HD1  LEU  91          3HD1      LEU  91   9.951  14.301   1.593
  642   1HD2  LEU  91          1HD2      LEU  91  10.151  13.045  -0.618
  643   2HD2  LEU  91          2HD2      LEU  91   8.411  12.774  -0.515
  644   3HD2  LEU  91          3HD2      LEU  91   9.505  11.407  -0.723
  645    H    ARG  92           H        ARG  92   8.937  11.118   4.434
  646    HA   ARG  92           HA       ARG  92   9.511  13.673   5.642
  647   1HB   ARG  92          2HB       ARG  92   7.258  11.872   6.430
  648   2HB   ARG  92          1HB       ARG  92   7.336  13.627   6.497
  649   1HG   ARG  92          2HG       ARG  92   6.914  13.860   4.241
  650   2HG   ARG  92          1HG       ARG  92   7.427  12.207   3.876
  651   1HD   ARG  92          2HD       ARG  92   4.876  13.169   5.098
  652   2HD   ARG  92          1HD       ARG  92   5.122  12.055   3.749
  653    HE   ARG  92           HE       ARG  92   6.205  10.658   5.728
  654   1HH1  ARG  92          1HH1      ARG  92   3.216  12.472   5.615
  655   2HH1  ARG  92          2HH1      ARG  92   2.417  11.495   6.806
  656   1HH2  ARG  92          1HH2      ARG  92   5.120   9.344   7.296
  657   2HH2  ARG  92          2HH2      ARG  92   3.491   9.723   7.748
  658    H    GLN  93           H        GLN  93   9.104  10.321   6.592
  659    HA   GLN  93           HA       GLN  93   9.609  11.048   9.363
  660   1HB   GLN  93          2HB       GLN  93   8.634   8.888   9.894
  661   2HB   GLN  93          1HB       GLN  93   7.601   9.774   8.767
  662   1HG   GLN  93          2HG       GLN  93   8.646   8.495   6.914
  663   2HG   GLN  93          1HG       GLN  93   9.467   7.514   8.125
  664   1HE2  GLN  93          1HE2      GLN  93   7.461   6.893   6.072
  665   2HE2  GLN  93          2HE2      GLN  93   6.171   6.105   6.926
  666    H    GLY  94           H        GLY  94  11.047   9.075   6.807
  667   1HA   GLY  94          2HA       GLY  94  13.294   8.401   6.711
  668   2HA   GLY  94          1HA       GLY  94  13.480   8.904   8.391
  669    H    TRP  95           H        TRP  95  11.186   6.697   6.867
  670    HA   TRP  95           HA       TRP  95  10.728   4.514   7.110
  671   1HB   TRP  95          2HB       TRP  95  13.459   3.973   8.223
  672   2HB   TRP  95          1HB       TRP  95  12.476   2.966   7.159
  673    HD1  TRP  95           HD       TRP  95  14.593   6.190   7.006
  674    HE1  TRP  95           1HE      TRP  95  15.514   6.433   4.633
  675    HE3  TRP  95           3HE      TRP  95  12.220   2.233   4.805
  676    HZ2  TRP  95           2HZ      TRP  95  15.334   5.115   2.203
  677    HZ3  TRP  95           3HZ      TRP  95  12.657   1.799   2.424
  678    HH2  TRP  95           HH       TRP  95  14.177   3.215   1.141
  679    H    GLY  96           H        GLY  96  10.534   6.477   9.354
  680   1HA   GLY  96          2HA       GLY  96  10.808   5.063  11.792
  681   2HA   GLY  96          1HA       GLY  96   9.795   6.476  11.531
  682    H    ALA  97           H        ALA  97   8.343   5.036   9.332
  683    HA   ALA  97           HA       ALA  97   6.409   3.673  10.986
  684   1HB   ALA  97          1HB       ALA  97   6.456   4.062   7.995
  685   2HB   ALA  97          2HB       ALA  97   5.646   5.108   9.163
  686   3HB   ALA  97          3HB       ALA  97   5.099   3.446   8.938
  687    H    TRP  98           H        TRP  98   8.883   2.854   8.662
  688    HA   TRP  98           HA       TRP  98   8.136   0.028   8.742
  689   1HB   TRP  98          2HB       TRP  98  10.193   1.545   7.107
  690   2HB   TRP  98          1HB       TRP  98   9.867  -0.179   6.955
  691    HD1  TRP  98           HD       TRP  98   7.452  -0.874   5.947
  692    HE1  TRP  98           1HE      TRP  98   5.907   0.340   4.297
  693    HE3  TRP  98           3HE      TRP  98   9.380   3.895   6.343
  694    HZ2  TRP  98           2HZ      TRP  98   5.551   2.955   3.284
  695    HZ3  TRP  98           3HZ      TRP  98   8.369   5.668   4.987
  696    HH2  TRP  98           HH       TRP  98   6.492   5.207   3.501
  697    HA   PRO  99           HA       PRO  99  11.067   0.135  12.111
  698   1HB   PRO  99          2HB       PRO  99  10.046  -2.546  12.749
  699   2HB   PRO  99          1HB       PRO  99   9.999  -1.064  13.699
  700   1HG   PRO  99          2HG       PRO  99   7.785  -2.022  12.586
  701   2HG   PRO  99          1HG       PRO  99   8.122  -0.276  12.628
  702   1HD   PRO  99          2HD       PRO  99   8.577  -2.203  10.356
  703   2HD   PRO  99          1HD       PRO  99   7.712  -0.643  10.340
  704    H    VAL 100           H        VAL 100  11.052  -3.339  11.830
  705    HA   VAL 100           HA       VAL 100  13.904  -3.328  11.849
  706    HB   VAL 100           HB       VAL 100  12.059  -5.686  11.429
  707   1HG1  VAL 100          1HG1      VAL 100  13.905  -6.993  12.375
  708   2HG1  VAL 100          2HG1      VAL 100  14.886  -5.530  12.467
  709   3HG1  VAL 100          3HG1      VAL 100  14.385  -6.158  10.898
  710   1HG2  VAL 100          1HG2      VAL 100  13.088  -4.518  14.013
  711   2HG2  VAL 100          2HG2      VAL 100  12.191  -6.027  13.856
  712   3HG2  VAL 100          3HG2      VAL 100  11.417  -4.494  13.450
  713    H    CYS 101           H        CYS 101  11.447  -3.553   9.489
  714    HA   CYS 101           HA       CYS 101  12.830  -5.025   7.508
  715   1HB   CYS 101          2HB       CYS 101  10.572  -3.059   7.120
  716   2HB   CYS 101          1HB       CYS 101  11.043  -4.356   6.022
  717    H    ALA 102           H        ALA 102  12.643  -1.594   8.276
  718    HA   ALA 102           HA       ALA 102  13.772  -0.656   5.861
  719   1HB   ALA 102          1HB       ALA 102  14.207   1.411   7.085
  720   2HB   ALA 102          2HB       ALA 102  13.858   0.588   8.604
  721   3HB   ALA 102          3HB       ALA 102  12.582   0.808   7.407
  722    H    ALA 103           H        ALA 103  15.208  -1.492   8.998
  723    HA   ALA 103           HA       ALA 103  17.872  -0.874   8.301
  724   1HB   ALA 103          1HB       ALA 103  17.128  -1.146  10.623
  725   2HB   ALA 103          2HB       ALA 103  18.503  -2.187  10.256
  726   3HB   ALA 103          3HB       ALA 103  16.879  -2.868  10.338
  727    H    ARG 104           H        ARG 104  15.919  -3.753   7.969
  728    HA   ARG 104           HA       ARG 104  18.020  -5.458   7.082
  729   1HB   ARG 104          2HB       ARG 104  15.013  -5.644   6.955
  730   2HB   ARG 104          1HB       ARG 104  16.073  -6.909   6.345
  731   1HG   ARG 104          2HG       ARG 104  15.844  -5.944   9.188
  732   2HG   ARG 104          1HG       ARG 104  15.321  -7.500   8.540
  733   1HD   ARG 104          2HD       ARG 104  18.129  -6.480   8.896
  734   2HD   ARG 104          1HD       ARG 104  17.378  -7.894   9.639
  735    HE   ARG 104           HE       ARG 104  17.278  -8.270   6.889
  736   1HH1  ARG 104          1HH1      ARG 104  19.669  -8.038   9.438
  737   2HH1  ARG 104          2HH1      ARG 104  20.896  -8.899   8.552
  738   1HH2  ARG 104          1HH2      ARG 104  18.883  -9.406   5.710
  739   2HH2  ARG 104          2HH2      ARG 104  20.434  -9.692   6.434
  740    H    ALA 105           H        ALA 105  16.051  -3.094   5.558
  741    HA   ALA 105           HA       ALA 105  16.399  -4.253   2.893
  742   1HB   ALA 105          1HB       ALA 105  14.768  -2.624   2.186
  743   2HB   ALA 105          2HB       ALA 105  14.804  -1.863   3.777
  744   3HB   ALA 105          3HB       ALA 105  14.184  -3.506   3.598
  745    H    GLY 106           H        GLY 106  17.683  -1.724   4.880
  746   1HA   GLY 106          2HA       GLY 106  19.746  -0.637   4.264
  747   2HA   GLY 106          1HA       GLY 106  19.251  -0.750   2.580
  748    H    ALA 107           H        ALA 107  18.175   0.673   5.648
  749    HA   ALA 107           HA       ALA 107  16.467   2.583   4.398
  750   1HB   ALA 107          1HB       ALA 107  16.133   3.443   6.647
  751   2HB   ALA 107          2HB       ALA 107  17.481   2.468   7.234
  752   3HB   ALA 107          3HB       ALA 107  16.021   1.682   6.631
  753    H    ARG 108           H        ARG 108  16.657   4.831   4.384
  754    HA   ARG 108           HA       ARG 108  17.608   6.866   4.237
  755   1HB   ARG 108          2HB       ARG 108  19.976   5.829   5.781
  756   2HB   ARG 108          1HB       ARG 108  19.331   7.469   5.741
  757   1HG   ARG 108          2HG       ARG 108  17.704   5.174   6.761
  758   2HG   ARG 108          1HG       ARG 108  18.854   6.021   7.814
  759   1HD   ARG 108          2HD       ARG 108  16.549   7.268   6.322
  760   2HD   ARG 108          1HD       ARG 108  16.567   6.885   8.041
  761    HE   ARG 108           HE       ARG 108  18.693   8.641   7.197
  762   1HH1  ARG 108          1HH1      ARG 108  15.437   8.398   8.449
  763   2HH1  ARG 108          2HH1      ARG 108  15.371  10.042   9.005
  764   1HH2  ARG 108          1HH2      ARG 108  18.633  10.820   7.938
  765   2HH2  ARG 108          2HH2      ARG 108  17.191  11.422   8.710
  Start of MODEL   20
    1   1H    ASN   1          1HT       ASN   1  33.956  36.512 -39.478
    2   2H    ASN   1          2HT       ASN   1  35.630  36.452 -39.666
    3   3H    ASN   1          3HT       ASN   1  34.936  36.161 -38.145
    4    HA   ASN   1           HA       ASN   1  35.730  34.198 -39.498
    5   1HB   ASN   1          2HB       ASN   1  33.781  32.800 -38.803
    6   2HB   ASN   1          1HB       ASN   1  34.430  33.809 -37.521
    7   1HD2  ASN   1          1HD2      ASN   1  33.197  35.492 -36.706
    8   2HD2  ASN   1          2HD2      ASN   1  31.497  35.638 -37.034
    9    H    VAL   2           H        VAL   2  35.984  34.017 -41.538
   10    HA   VAL   2           HA       VAL   2  33.958  34.661 -43.469
   11    HB   VAL   2           HB       VAL   2  36.396  34.969 -43.903
   12   1HG1  VAL   2          1HG1      VAL   2  37.249  32.948 -42.877
   13   2HG1  VAL   2          2HG1      VAL   2  37.740  33.027 -44.569
   14   3HG1  VAL   2          3HG1      VAL   2  36.420  31.961 -44.083
   15   1HG2  VAL   2          1HG2      VAL   2  36.340  34.178 -46.227
   16   2HG2  VAL   2          2HG2      VAL   2  34.819  34.933 -45.749
   17   3HG2  VAL   2          3HG2      VAL   2  34.941  33.176 -45.841
   18    H    VAL   3           H        VAL   3  34.847  31.898 -41.680
   19    HA   VAL   3           HA       VAL   3  33.978  29.858 -43.347
   20    HB   VAL   3           HB       VAL   3  35.308  29.406 -41.362
   21   1HG1  VAL   3          1HG1      VAL   3  34.320  29.466 -39.119
   22   2HG1  VAL   3          2HG1      VAL   3  32.864  30.202 -39.790
   23   3HG1  VAL   3          3HG1      VAL   3  34.399  31.067 -39.851
   24   1HG2  VAL   3          1HG2      VAL   3  32.605  28.075 -41.304
   25   2HG2  VAL   3          2HG2      VAL   3  34.045  27.477 -40.479
   26   3HG2  VAL   3          3HG2      VAL   3  34.014  27.574 -42.240
   27    H    VAL   4           H        VAL   4  32.052  29.196 -43.957
   28    HA   VAL   4           HA       VAL   4  29.673  30.480 -42.820
   29    HB   VAL   4           HB       VAL   4  29.872  28.723 -45.279
   30   1HG1  VAL   4          1HG1      VAL   4  27.740  30.675 -44.426
   31   2HG1  VAL   4          2HG1      VAL   4  27.624  28.916 -44.329
   32   3HG1  VAL   4          3HG1      VAL   4  27.740  29.707 -45.901
   33   1HG2  VAL   4          1HG2      VAL   4  29.940  31.733 -45.103
   34   2HG2  VAL   4          2HG2      VAL   4  29.859  30.788 -46.590
   35   3HG2  VAL   4          3HG2      VAL   4  31.286  30.687 -45.558
   36    H    THR   5           H        THR   5  27.846  29.181 -42.304
   37    HA   THR   5           HA       THR   5  28.593  26.901 -40.738
   38    HB   THR   5           HB       THR   5  26.084  26.843 -40.264
   39    HG1  THR   5           1HG      THR   5  25.705  28.147 -42.296
   40   1HG2  THR   5          1HG2      THR   5  27.612  29.383 -39.676
   41   2HG2  THR   5          2HG2      THR   5  27.705  27.885 -38.750
   42   3HG2  THR   5          3HG2      THR   5  26.200  28.802 -38.794
   43    HA   PRO   6           HA       PRO   6  27.370  24.047 -44.002
   44   1HB   PRO   6          2HB       PRO   6  29.090  22.087 -43.044
   45   2HB   PRO   6          1HB       PRO   6  29.500  23.305 -44.253
   46   1HG   PRO   6          2HG       PRO   6  30.572  23.058 -41.640
   47   2HG   PRO   6          1HG       PRO   6  30.845  24.376 -42.789
   48   1HD   PRO   6          2HD       PRO   6  28.963  24.227 -40.494
   49   2HD   PRO   6          1HD       PRO   6  29.797  25.636 -41.188
   50    H    ALA   7           H        ALA   7  26.653  21.802 -43.945
   51    HA   ALA   7           HA       ALA   7  24.986  21.330 -41.595
   52   1HB   ALA   7          1HB       ALA   7  24.998  19.923 -44.250
   53   2HB   ALA   7          2HB       ALA   7  23.941  21.261 -43.803
   54   3HB   ALA   7          3HB       ALA   7  23.815  19.717 -42.963
   55    H    HIS   8           H        HIS   8  27.212  20.956 -40.665
   56    HA   HIS   8           HA       HIS   8  27.954  18.145 -40.787
   57   1HB   HIS   8          2HB       HIS   8  29.132  20.476 -39.269
   58   2HB   HIS   8          1HB       HIS   8  29.732  18.829 -39.152
   59    HD1  HIS   8           1HD      HIS   8  31.636  21.031 -40.113
   60    HD2  HIS   8           2HD      HIS   8  29.296  18.712 -42.658
   61    HE1  HIS   8           1HE      HIS   8  32.770  21.083 -42.376
   62    H    GLU   9           H        GLU   9  25.692  19.995 -39.438
   63    HA   GLU   9           HA       GLU   9  25.707  19.499 -36.705
   64   1HB   GLU   9          2HB       GLU   9  23.323  19.988 -36.723
   65   2HB   GLU   9          1HB       GLU   9  24.183  21.102 -37.777
   66   1HG   GLU   9          2HG       GLU   9  23.344  20.114 -39.711
   67   2HG   GLU   9          1HG       GLU   9  22.891  18.633 -38.870
   68    H    ALA  10           H        ALA  10  24.901  17.961 -35.394
   69    HA   ALA  10           HA       ALA  10  23.506  15.662 -36.505
   70   1HB   ALA  10          1HB       ALA  10  26.058  15.406 -34.904
   71   2HB   ALA  10          2HB       ALA  10  25.848  14.975 -36.603
   72   3HB   ALA  10          3HB       ALA  10  25.000  14.067 -35.350
   73    H    VAL  11           H        VAL  11  21.899  16.930 -35.377
   74    HA   VAL  11           HA       VAL  11  22.133  17.400 -32.579
   75    HB   VAL  11           HB       VAL  11  20.809  18.833 -34.131
   76   1HG1  VAL  11          1HG1      VAL  11  19.738  17.116 -35.459
   77   2HG1  VAL  11          2HG1      VAL  11  18.530  18.166 -34.719
   78   3HG1  VAL  11          3HG1      VAL  11  18.833  16.562 -34.049
   79   1HG2  VAL  11          1HG2      VAL  11  18.978  19.268 -32.568
   80   2HG2  VAL  11          2HG2      VAL  11  20.502  19.001 -31.723
   81   3HG2  VAL  11          3HG2      VAL  11  19.287  17.722 -31.776
   82    H    VAL  12           H        VAL  12  21.051  14.785 -34.483
   83    HA   VAL  12           HA       VAL  12  19.624  13.053 -34.132
   84    HB   VAL  12           HB       VAL  12  21.782  12.188 -33.796
   85   1HG1  VAL  12          1HG1      VAL  12  22.557  13.721 -32.058
   86   2HG1  VAL  12          2HG1      VAL  12  22.899  12.038 -31.652
   87   3HG1  VAL  12          3HG1      VAL  12  21.555  12.877 -30.877
   88   1HG2  VAL  12          1HG2      VAL  12  21.300  10.255 -32.344
   89   2HG2  VAL  12          2HG2      VAL  12  19.972  10.644 -33.438
   90   3HG2  VAL  12          3HG2      VAL  12  19.876  11.103 -31.739
   91    H    ARG  13           H        ARG  13  17.810  14.096 -33.515
   92    HA   ARG  13           HA       ARG  13  17.204  14.205 -30.677
   93   1HB   ARG  13          2HB       ARG  13  15.315  15.670 -31.367
   94   2HB   ARG  13          1HB       ARG  13  16.911  16.319 -31.724
   95   1HG   ARG  13          2HG       ARG  13  16.674  15.530 -34.038
   96   2HG   ARG  13          1HG       ARG  13  15.040  14.995 -33.654
   97   1HD   ARG  13          2HD       ARG  13  14.295  17.215 -33.296
   98   2HD   ARG  13          1HD       ARG  13  15.943  17.839 -33.252
   99    HE   ARG  13           HE       ARG  13  15.578  16.695 -35.764
  100   1HH1  ARG  13          1HH1      ARG  13  14.203  19.334 -33.902
  101   2HH1  ARG  13          2HH1      ARG  13  13.875  20.313 -35.301
  102   1HH2  ARG  13          1HH2      ARG  13  15.150  17.990 -37.606
  103   2HH2  ARG  13          2HH2      ARG  13  14.414  19.555 -37.407
  104    H    VAL  14           H        VAL  14  16.365  12.461 -30.036
  105    HA   VAL  14           HA       VAL  14  14.067  11.269 -31.368
  106    HB   VAL  14           HB       VAL  14  16.138   9.604 -29.999
  107   1HG1  VAL  14          1HG1      VAL  14  14.037   8.922 -32.046
  108   2HG1  VAL  14          2HG1      VAL  14  13.977   8.563 -30.319
  109   3HG1  VAL  14          3HG1      VAL  14  15.184   7.782 -31.339
  110   1HG2  VAL  14          1HG2      VAL  14  17.084   9.003 -32.199
  111   2HG2  VAL  14          2HG2      VAL  14  17.354  10.694 -31.777
  112   3HG2  VAL  14          3HG2      VAL  14  16.097  10.264 -32.939
  113    H    GLY  15           H        GLY  15  12.846   9.930 -29.877
  114   1HA   GLY  15          2HA       GLY  15  13.343   9.888 -27.129
  115   2HA   GLY  15          1HA       GLY  15  12.147  11.117 -27.509
  116    H    THR  16           H        THR  16  12.944   7.773 -28.215
  117    HA   THR  16           HA       THR  16  10.285   7.080 -28.950
  118    HB   THR  16           HB       THR  16  12.491   5.160 -28.266
  119    HG1  THR  16           1HG      THR  16  12.144   6.230 -30.868
  120   1HG2  THR  16          1HG2      THR  16  10.243   5.081 -30.266
  121   2HG2  THR  16          2HG2      THR  16  10.314   4.203 -28.737
  122   3HG2  THR  16          3HG2      THR  16  11.452   3.818 -30.029
  123    H    LYS  17           H        LYS  17  12.180   6.910 -26.118
  124    HA   LYS  17           HA       LYS  17  10.956   4.882 -24.675
  125   1HB   LYS  17          2HB       LYS  17  12.164   7.367 -23.458
  126   2HB   LYS  17          1HB       LYS  17  12.023   5.778 -22.723
  127   1HG   LYS  17          2HG       LYS  17  13.823   6.602 -24.983
  128   2HG   LYS  17          1HG       LYS  17  14.286   6.074 -23.364
  129   1HD   LYS  17          2HD       LYS  17  13.360   3.847 -23.848
  130   2HD   LYS  17          1HD       LYS  17  12.946   4.385 -25.477
  131   1HE   LYS  17          2HE       LYS  17  15.405   4.949 -25.755
  132   2HE   LYS  17          1HE       LYS  17  15.677   4.047 -24.266
  133   1HZ   LYS  17          1HZ       LYS  17  14.635   2.111 -25.347
  134   2HZ   LYS  17          2HZ       LYS  17  16.039   2.625 -26.142
  135   3HZ   LYS  17          3HZ       LYS  17  14.520   2.996 -26.791
  136    HA   PRO  18           HA       PRO  18   7.130   7.073 -23.751
  137   1HB   PRO  18          2HB       PRO  18   5.885   4.574 -23.294
  138   2HB   PRO  18          1HB       PRO  18   5.765   5.579 -24.740
  139   1HG   PRO  18          2HG       PRO  18   6.975   3.087 -24.604
  140   2HG   PRO  18          1HG       PRO  18   7.219   4.286 -25.882
  141   1HD   PRO  18          2HD       PRO  18   8.932   3.663 -23.516
  142   2HD   PRO  18          1HD       PRO  18   9.411   4.120 -25.170
  143    H    GLY  19           H        GLY  19   5.637   6.950 -21.984
  144   1HA   GLY  19          2HA       GLY  19   7.010   6.176 -19.498
  145   2HA   GLY  19          1HA       GLY  19   5.821   7.468 -19.619
  146    H    THR  20           H        THR  20   5.465   4.491 -21.222
  147    HA   THR  20           HA       THR  20   2.937   3.918 -20.074
  148    HB   THR  20           HB       THR  20   4.692   2.030 -21.654
  149    HG1  THR  20           1HG      THR  20   2.930   4.112 -22.507
  150   1HG2  THR  20          1HG2      THR  20   1.698   2.237 -21.348
  151   2HG2  THR  20          2HG2      THR  20   2.729   1.004 -20.624
  152   3HG2  THR  20          3HG2      THR  20   2.551   1.084 -22.375
  153    H    GLU  21           H        GLU  21   6.188   2.685 -19.596
  154    HA   GLU  21           HA       GLU  21   5.261   1.204 -17.271
  155   1HB   GLU  21          2HB       GLU  21   7.590   0.645 -19.110
  156   2HB   GLU  21          1HB       GLU  21   7.370  -0.151 -17.557
  157   1HG   GLU  21          2HG       GLU  21   5.252  -1.080 -18.323
  158   2HG   GLU  21          1HG       GLU  21   5.453  -0.270 -19.875
  159    H    VAL  22           H        VAL  22   5.886   2.004 -15.437
  160    HA   VAL  22           HA       VAL  22   7.478   4.363 -15.328
  161    HB   VAL  22           HB       VAL  22   6.511   2.648 -13.036
  162   1HG1  VAL  22          1HG1      VAL  22   8.261   4.213 -12.378
  163   2HG1  VAL  22          2HG1      VAL  22   6.702   4.697 -11.709
  164   3HG1  VAL  22          3HG1      VAL  22   7.362   5.542 -13.109
  165   1HG2  VAL  22          1HG2      VAL  22   4.668   3.331 -14.475
  166   2HG2  VAL  22          2HG2      VAL  22   5.198   5.010 -14.373
  167   3HG2  VAL  22          3HG2      VAL  22   4.605   4.184 -12.931
  168    HA   PRO  23           HA       PRO  23  11.480   2.387 -15.133
  169   1HB   PRO  23          2HB       PRO  23  12.168   5.125 -14.207
  170   2HB   PRO  23          1HB       PRO  23  12.930   4.140 -15.462
  171   1HG   PRO  23          2HG       PRO  23  11.347   6.152 -16.139
  172   2HG   PRO  23          1HG       PRO  23  11.270   4.618 -17.025
  173   1HD   PRO  23          2HD       PRO  23   9.437   5.670 -14.932
  174   2HD   PRO  23          1HD       PRO  23   9.054   4.811 -16.432
  175    HA   PRO  24           HA       PRO  24  11.559   1.162 -10.923
  176   1HB   PRO  24          2HB       PRO  24  14.304   0.666 -10.761
  177   2HB   PRO  24          1HB       PRO  24  13.072  -0.484 -11.292
  178   1HG   PRO  24          2HG       PRO  24  14.840   1.287 -12.924
  179   2HG   PRO  24          1HG       PRO  24  14.343  -0.390 -13.226
  180   1HD   PRO  24          2HD       PRO  24  13.185   1.586 -14.559
  181   2HD   PRO  24          1HD       PRO  24  12.208   0.249 -13.920
  182    H    VAL  25           H        VAL  25  11.848   2.040  -9.035
  183    HA   VAL  25           HA       VAL  25  13.025   4.679  -8.875
  184    HB   VAL  25           HB       VAL  25  11.407   3.155  -6.818
  185   1HG1  VAL  25          1HG1      VAL  25  12.148   6.073  -6.982
  186   2HG1  VAL  25          2HG1      VAL  25  12.730   4.906  -5.798
  187   3HG1  VAL  25          3HG1      VAL  25  11.032   5.369  -5.812
  188   1HG2  VAL  25          1HG2      VAL  25  10.129   3.533  -8.857
  189   2HG2  VAL  25          2HG2      VAL  25  10.533   5.250  -8.804
  190   3HG2  VAL  25          3HG2      VAL  25   9.524   4.542  -7.543
  191    H    ILE  26           H        ILE  26  14.689   5.213  -7.588
  192    HA   ILE  26           HA       ILE  26  16.715   3.285  -7.321
  193    HB   ILE  26           HB       ILE  26  16.638   6.050  -6.107
  194   1HG1  ILE  26          2HG1      ILE  26  16.232   6.171  -8.498
  195   2HG1  ILE  26          1HG1      ILE  26  17.864   6.734  -8.158
  196   1HG2  ILE  26          1HG2      ILE  26  18.961   4.240  -6.755
  197   2HG2  ILE  26          2HG2      ILE  26  18.411   4.717  -5.148
  198   3HG2  ILE  26          3HG2      ILE  26  19.099   5.920  -6.238
  199   1HD1  ILE  26          1HD1      ILE  26  18.755   4.577  -8.874
  200   2HD1  ILE  26          2HD1      ILE  26  17.807   5.348 -10.145
  201   3HD1  ILE  26          3HD1      ILE  26  17.118   4.019  -9.214
  202    H    ASP  27           H        ASP  27  14.329   4.374  -5.092
  203    HA   ASP  27           HA       ASP  27  15.706   3.051  -2.893
  204   1HB   ASP  27          2HB       ASP  27  13.341   4.918  -2.815
  205   2HB   ASP  27          1HB       ASP  27  14.126   4.202  -1.414
  206    H    GLY  28           H        GLY  28  13.678   2.400  -5.237
  207   1HA   GLY  28          2HA       GLY  28  11.519   1.059  -3.970
  208   2HA   GLY  28          1HA       GLY  28  12.034   0.842  -5.639
  209    H    SER  29           H        SER  29  14.759   0.438  -4.146
  210    HA   SER  29           HA       SER  29  14.676  -2.434  -4.161
  211   1HB   SER  29          2HB       SER  29  16.869  -0.665  -3.111
  212   2HB   SER  29          1HB       SER  29  17.015  -2.306  -3.742
  213    HG   SER  29           HG       SER  29  17.194  -1.505  -5.679
  214    H    ILE  30           H        ILE  30  14.832   0.135  -1.834
  215    HA   ILE  30           HA       ILE  30  15.052  -1.477   0.506
  216    HB   ILE  30           HB       ILE  30  13.601   1.090   0.815
  217   1HG1  ILE  30          2HG1      ILE  30  15.117   1.715  -1.034
  218   2HG1  ILE  30          1HG1      ILE  30  15.564   2.509   0.470
  219   1HG2  ILE  30          1HG2      ILE  30  16.065  -0.027   2.122
  220   2HG2  ILE  30          2HG2      ILE  30  14.408  -0.186   2.704
  221   3HG2  ILE  30          3HG2      ILE  30  15.170   1.403   2.637
  222   1HD1  ILE  30          1HD1      ILE  30  16.917   0.080  -0.677
  223   2HD1  ILE  30          2HD1      ILE  30  17.372   0.925   0.802
  224   3HD1  ILE  30          3HD1      ILE  30  17.518   1.734  -0.758
  225    H    TRP  31           H        TRP  31  12.523  -0.131  -1.446
  226    HA   TRP  31           HA       TRP  31  10.367  -0.725   0.302
  227   1HB   TRP  31          2HB       TRP  31  10.415  -0.160  -2.675
  228   2HB   TRP  31          1HB       TRP  31   8.958  -0.230  -1.689
  229    HD1  TRP  31           HD       TRP  31  10.974   2.322  -3.125
  230    HE1  TRP  31           1HE      TRP  31  10.936   4.517  -1.755
  231    HE3  TRP  31           3HE      TRP  31   9.200   0.471   1.238
  232    HZ2  TRP  31           2HZ      TRP  31  10.257   5.309   0.844
  233    HZ3  TRP  31           3HZ      TRP  31   8.898   1.989   3.146
  234    HH2  TRP  31           HH       TRP  31   9.424   4.362   2.947
  235    H    ASP  32           H        ASP  32  11.939  -2.424  -2.329
  236    HA   ASP  32           HA       ASP  32  10.039  -4.543  -2.446
  237   1HB   ASP  32          2HB       ASP  32  11.476  -3.938  -4.352
  238   2HB   ASP  32          1HB       ASP  32  12.897  -4.420  -3.426
  239    H    ALA  33           H        ALA  33  13.177  -4.030  -0.880
  240    HA   ALA  33           HA       ALA  33  13.346  -6.663   0.140
  241   1HB   ALA  33          1HB       ALA  33  15.319  -5.260  -0.164
  242   2HB   ALA  33          2HB       ALA  33  15.183  -5.829   1.500
  243   3HB   ALA  33          3HB       ALA  33  14.739  -4.170   1.098
  244    H    ILE  34           H        ILE  34  11.980  -3.651   1.358
  245    HA   ILE  34           HA       ILE  34  11.405  -4.528   3.981
  246    HB   ILE  34           HB       ILE  34  10.135  -2.459   2.211
  247   1HG1  ILE  34          2HG1      ILE  34  11.710  -2.230   4.787
  248   2HG1  ILE  34          1HG1      ILE  34  12.382  -2.021   3.175
  249   1HG2  ILE  34          1HG2      ILE  34   8.795  -1.699   4.122
  250   2HG2  ILE  34          2HG2      ILE  34   9.351  -3.088   5.056
  251   3HG2  ILE  34          3HG2      ILE  34   8.351  -3.333   3.625
  252   1HD1  ILE  34          1HD1      ILE  34  11.940   0.107   4.276
  253   2HD1  ILE  34          2HD1      ILE  34  10.232  -0.316   4.402
  254   3HD1  ILE  34          3HD1      ILE  34  10.967  -0.087   2.817
  255    H    ALA  35           H        ALA  35   9.416  -4.553   1.023
  256    HA   ALA  35           HA       ALA  35   7.215  -5.886   2.203
  257   1HB   ALA  35          1HB       ALA  35   8.052  -5.855  -0.691
  258   2HB   ALA  35          2HB       ALA  35   7.058  -4.632   0.102
  259   3HB   ALA  35          3HB       ALA  35   6.461  -6.284  -0.065
  260    H    GLY  36           H        GLY  36  10.161  -6.964   0.669
  261   1HA   GLY  36          2HA       GLY  36   9.467  -9.740   0.578
  262   2HA   GLY  36          1HA       GLY  36  11.087  -9.067   0.439
  263    H    CYS  37           H        CYS  37  10.537  -7.595   3.004
  264    HA   CYS  37           HA       CYS  37  11.713  -9.531   4.727
  265   1HB   CYS  37          2HB       CYS  37  12.621  -7.470   5.139
  266   2HB   CYS  37          1HB       CYS  37  11.113  -6.626   4.827
  267    H    GLU  38           H        GLU  38   8.770  -7.523   5.203
  268    HA   GLU  38           HA       GLU  38   8.077  -9.449   7.285
  269   1HB   GLU  38          2HB       GLU  38   8.035  -6.856   7.581
  270   2HB   GLU  38          1HB       GLU  38   6.458  -6.982   6.807
  271   1HG   GLU  38          2HG       GLU  38   5.622  -8.377   8.516
  272   2HG   GLU  38          1HG       GLU  38   7.227  -8.634   9.192
  273    H    ALA  39           H        ALA  39   6.960  -8.279   4.204
  274    HA   ALA  39           HA       ALA  39   4.475  -9.708   4.439
  275   1HB   ALA  39          1HB       ALA  39   4.493  -7.583   3.255
  276   2HB   ALA  39          2HB       ALA  39   3.980  -8.896   2.194
  277   3HB   ALA  39          3HB       ALA  39   5.618  -8.251   2.071
  278    H    GLY  40           H        GLY  40   7.635 -10.426   3.521
  279   1HA   GLY  40          2HA       GLY  40   8.541 -12.443   2.834
  280   2HA   GLY  40          1HA       GLY  40   6.910 -13.111   2.778
  281    H    GLY  41           H        GLY  41   7.558 -10.147   1.251
  282   1HA   GLY  41          2HA       GLY  41   7.498  -9.483  -0.904
  283   2HA   GLY  41          1HA       GLY  41   7.997 -11.107  -1.394
  284    H    ASN  42           H        ASN  42   5.205  -9.400  -0.028
  285    HA   ASN  42           HA       ASN  42   3.460 -10.776  -1.919
  286   1HB   ASN  42          2HB       ASN  42   3.659 -11.789   0.576
  287   2HB   ASN  42          1HB       ASN  42   2.459 -10.535   0.870
  288   1HD2  ASN  42          1HD2      ASN  42   1.423 -10.869  -1.935
  289   2HD2  ASN  42          2HD2      ASN  42   0.454 -12.299  -1.862
  290    H    TRP  43           H        TRP  43   3.370  -8.744  -2.916
  291    HA   TRP  43           HA       TRP  43   2.634  -6.382  -1.483
  292   1HB   TRP  43          2HB       TRP  43   2.644  -6.940  -4.457
  293   2HB   TRP  43          1HB       TRP  43   2.498  -5.352  -3.710
  294    HD1  TRP  43           HD       TRP  43   5.057  -8.280  -3.751
  295    HE1  TRP  43           1HE      TRP  43   7.440  -7.279  -3.694
  296    HE3  TRP  43           3HE      TRP  43   3.835  -3.336  -3.390
  297    HZ2  TRP  43           2HZ      TRP  43   8.634  -4.692  -3.507
  298    HZ3  TRP  43           3HZ      TRP  43   5.628  -1.665  -3.285
  299    HH2  TRP  43           HH       TRP  43   7.976  -2.329  -3.350
  300    H    ALA  44           H        ALA  44   0.988  -9.051  -2.595
  301    HA   ALA  44           HA       ALA  44  -1.575  -7.614  -2.772
  302   1HB   ALA  44          1HB       ALA  44  -1.028  -9.000  -4.698
  303   2HB   ALA  44          2HB       ALA  44  -2.449  -9.617  -3.857
  304   3HB   ALA  44          3HB       ALA  44  -0.888 -10.412  -3.652
  305    H    ILE  45           H        ILE  45   0.068  -8.680  -0.355
  306    HA   ILE  45           HA       ILE  45  -1.621 -10.612   0.859
  307    HB   ILE  45           HB       ILE  45   0.908 -10.178   1.254
  308   1HG1  ILE  45          2HG1      ILE  45  -0.927 -10.601   3.612
  309   2HG1  ILE  45          1HG1      ILE  45  -0.490 -11.833   2.433
  310   1HG2  ILE  45          1HG2      ILE  45  -0.259  -8.222   3.236
  311   2HG2  ILE  45          2HG2      ILE  45   0.727  -7.812   1.833
  312   3HG2  ILE  45          3HG2      ILE  45   1.427  -8.739   3.159
  313   1HD1  ILE  45          1HD1      ILE  45   1.376 -10.435   4.334
  314   2HD1  ILE  45          2HD1      ILE  45   1.863 -11.603   3.107
  315   3HD1  ILE  45          3HD1      ILE  45   0.818 -12.105   4.437
  316    H    ASN  46           H        ASN  46  -3.106 -10.262   2.532
  317    HA   ASN  46           HA       ASN  46  -3.616  -7.547   3.411
  318   1HB   ASN  46          2HB       ASN  46  -4.805  -7.930   1.148
  319   2HB   ASN  46          1HB       ASN  46  -5.887  -8.981   2.054
  320   1HD2  ASN  46          1HD2      ASN  46  -6.165  -6.343   0.664
  321   2HD2  ASN  46          2HD2      ASN  46  -6.957  -5.335   1.832
  322    H    THR  47           H        THR  47  -3.287  -8.224   5.449
  323    HA   THR  47           HA       THR  47  -4.619 -10.492   6.545
  324    HB   THR  47           HB       THR  47  -3.772  -9.486   8.746
  325    HG1  THR  47           1HG      THR  47  -2.154  -7.848   8.418
  326   1HG2  THR  47          1HG2      THR  47  -1.459 -10.135   8.298
  327   2HG2  THR  47          2HG2      THR  47  -1.761 -10.049   6.563
  328   3HG2  THR  47          3HG2      THR  47  -2.583 -11.265   7.540
  329    H    GLY  48           H        GLY  48  -5.405  -7.203   6.034
  330   1HA   GLY  48          2HA       GLY  48  -7.535  -6.262   6.216
  331   2HA   GLY  48          1HA       GLY  48  -8.009  -7.600   7.258
  332    H    ASN  49           H        ASN  49  -5.048  -5.917   7.802
  333    HA   ASN  49           HA       ASN  49  -6.110  -5.125  10.403
  334   1HB   ASN  49          2HB       ASN  49  -3.275  -5.461   9.422
  335   2HB   ASN  49          1HB       ASN  49  -3.679  -4.831  11.015
  336   1HD2  ASN  49          1HD2      ASN  49  -2.652  -6.547  12.052
  337   2HD2  ASN  49          2HD2      ASN  49  -3.337  -8.138  12.084
  338    H    GLY  50           H        GLY  50  -6.228  -3.672   7.699
  339   1HA   GLY  50          2HA       GLY  50  -6.672  -1.421   7.296
  340   2HA   GLY  50          1HA       GLY  50  -5.870  -1.014   8.805
  341    H    TYR  51           H        TYR  51  -3.578  -2.790   7.906
  342    HA   TYR  51           HA       TYR  51  -2.377  -1.016   5.934
  343   1HB   TYR  51          2HB       TYR  51  -1.026  -3.246   7.474
  344   2HB   TYR  51          1HB       TYR  51  -0.244  -1.990   6.521
  345    HD1  TYR  51           1HD      TYR  51   1.135  -1.832   8.660
  346    HD2  TYR  51           2HD      TYR  51  -2.957  -0.693   8.449
  347    HE1  TYR  51           1HE      TYR  51   1.424  -0.474  10.685
  348    HE2  TYR  51           2HE      TYR  51  -2.678   0.662  10.489
  349    HH   TYR  51           HH       TYR  51  -1.177   0.735  12.472
  350    H    TYR  52           H        TYR  52  -1.945  -1.694   3.942
  351    HA   TYR  52           HA       TYR  52  -3.077  -4.304   3.271
  352   1HB   TYR  52          2HB       TYR  52  -2.857  -1.775   1.632
  353   2HB   TYR  52          1HB       TYR  52  -3.410  -3.319   0.981
  354    HD1  TYR  52           1HD      TYR  52  -4.128  -0.988   3.814
  355    HD2  TYR  52           2HD      TYR  52  -5.690  -3.761   0.997
  356    HE1  TYR  52           1HE      TYR  52  -6.393  -0.521   4.640
  357    HE2  TYR  52           2HE      TYR  52  -7.971  -3.301   1.804
  358    HH   TYR  52           HH       TYR  52  -8.756  -0.681   3.734
  359    H    GLY  53           H        GLY  53  -2.167  -5.137   1.096
  360   1HA   GLY  53          2HA       GLY  53   0.211  -6.292   1.799
  361   2HA   GLY  53          1HA       GLY  53  -0.441  -6.304   0.176
  362    H    GLY  54           H        GLY  54   2.250  -6.355   0.935
  363   1HA   GLY  54          2HA       GLY  54   3.986  -5.594  -0.478
  364   2HA   GLY  54          1HA       GLY  54   3.135  -4.061  -0.644
  365    H    VAL  55           H        VAL  55   3.894  -2.429   0.469
  366    HA   VAL  55           HA       VAL  55   5.878  -2.911   2.531
  367    HB   VAL  55           HB       VAL  55   5.887  -0.314   2.574
  368   1HG1  VAL  55          1HG1      VAL  55   7.699  -1.680   1.697
  369   2HG1  VAL  55          2HG1      VAL  55   7.427  -0.281   0.657
  370   3HG1  VAL  55          3HG1      VAL  55   6.836  -1.871   0.172
  371   1HG2  VAL  55          1HG2      VAL  55   3.791  -0.077   1.275
  372   2HG2  VAL  55          2HG2      VAL  55   4.619  -0.767  -0.122
  373   3HG2  VAL  55          3HG2      VAL  55   5.159   0.768   0.555
  374    H    GLN  56           H        GLN  56   2.581  -2.537   2.365
  375    HA   GLN  56           HA       GLN  56   0.941  -2.333   3.924
  376   1HB   GLN  56          2HB       GLN  56   1.268  -3.739   5.896
  377   2HB   GLN  56          1HB       GLN  56   1.840  -4.504   4.423
  378   1HG   GLN  56          2HG       GLN  56   4.154  -3.786   5.066
  379   2HG   GLN  56          1HG       GLN  56   3.487  -3.295   6.624
  380   1HE2  GLN  56          1HE2      GLN  56   4.259  -5.946   4.544
  381   2HE2  GLN  56          2HE2      GLN  56   4.098  -7.192   5.732
  382    H    PHE  57           H        PHE  57   1.828   0.180   3.903
  383    HA   PHE  57           HA       PHE  57   2.468   0.821   6.684
  384   1HB   PHE  57          2HB       PHE  57   3.179   3.024   5.868
  385   2HB   PHE  57          1HB       PHE  57   4.073   1.694   5.147
  386    HD1  PHE  57           1HD      PHE  57   2.208   4.641   4.521
  387    HD2  PHE  57           2HD      PHE  57   3.279   0.896   2.808
  388    HE1  PHE  57           1HE      PHE  57   1.819   5.557   2.270
  389    HE2  PHE  57           2HE      PHE  57   2.892   1.808   0.564
  390    HZ   PHE  57           HZ       PHE  57   2.183   4.139   0.284
  391    H    ASP  58           H        ASP  58  -0.179   0.366   5.373
  392    HA   ASP  58           HA       ASP  58  -2.183   0.619   6.449
  393   1HB   ASP  58          2HB       ASP  58  -1.630   1.530   8.447
  394   2HB   ASP  58          1HB       ASP  58  -0.696   2.814   7.722
  395    H    GLN  59           H        GLN  59  -4.004   1.236   5.641
  396    HA   GLN  59           HA       GLN  59  -4.129   2.437   3.132
  397   1HB   GLN  59          2HB       GLN  59  -5.805   0.921   3.720
  398   2HB   GLN  59          1HB       GLN  59  -6.119   1.711   5.256
  399   1HG   GLN  59          2HG       GLN  59  -7.963   2.296   4.037
  400   2HG   GLN  59          1HG       GLN  59  -6.915   3.680   3.770
  401   1HE2  GLN  59          1HE2      GLN  59  -5.219   2.168   1.866
  402   2HE2  GLN  59          2HE2      GLN  59  -6.146   2.073   0.405
  403    H    GLY  60           H        GLY  60  -4.571   3.705   6.355
  404   1HA   GLY  60          2HA       GLY  60  -5.638   6.233   5.598
  405   2HA   GLY  60          1HA       GLY  60  -4.849   5.862   7.126
  406    H    THR  61           H        THR  61  -2.354   5.115   6.272
  407    HA   THR  61           HA       THR  61  -1.091   7.596   5.764
  408    HB   THR  61           HB       THR  61  -0.017   4.794   5.765
  409    HG1  THR  61           1HG      THR  61  -0.846   5.233   7.777
  410   1HG2  THR  61          1HG2      THR  61   1.436   7.423   6.102
  411   2HG2  THR  61          2HG2      THR  61   1.488   6.407   4.662
  412   3HG2  THR  61          3HG2      THR  61   2.154   5.814   6.184
  413    H    TRP  62           H        TRP  62  -1.614   4.658   3.882
  414    HA   TRP  62           HA       TRP  62  -0.469   5.361   1.461
  415   1HB   TRP  62          2HB       TRP  62  -1.410   3.174   1.985
  416   2HB   TRP  62          1HB       TRP  62  -3.017   3.877   2.098
  417    HD1  TRP  62           HD       TRP  62  -4.239   4.511  -0.187
  418    HE1  TRP  62           1HE      TRP  62  -3.929   3.617  -2.575
  419    HE3  TRP  62           3HE      TRP  62   0.362   2.380   0.355
  420    HZ2  TRP  62           2HZ      TRP  62  -1.974   2.159  -4.057
  421    HZ3  TRP  62           3HZ      TRP  62   1.396   1.270  -1.578
  422    HH2  TRP  62           HH       TRP  62   0.262   1.164  -3.734
  423    H    GLU  63           H        GLU  63  -3.755   5.970   2.624
  424    HA   GLU  63           HA       GLU  63  -4.665   7.399   0.389
  425   1HB   GLU  63          2HB       GLU  63  -6.324   6.582   1.799
  426   2HB   GLU  63          1HB       GLU  63  -5.516   7.146   3.252
  427   1HG   GLU  63          2HG       GLU  63  -7.372   8.525   3.072
  428   2HG   GLU  63          1HG       GLU  63  -6.061   9.501   2.415
  429    H    ALA  64           H        ALA  64  -3.094   8.379   3.387
  430    HA   ALA  64           HA       ALA  64  -3.482  11.155   3.166
  431   1HB   ALA  64          1HB       ALA  64  -1.703  11.381   4.799
  432   2HB   ALA  64          2HB       ALA  64  -1.190   9.721   4.503
  433   3HB   ALA  64          3HB       ALA  64  -2.761  10.041   5.238
  434    H    ASN  65           H        ASN  65  -0.870   9.057   2.024
  435    HA   ASN  65           HA       ASN  65   0.571  11.242   0.838
  436   1HB   ASN  65          2HB       ASN  65   0.928   8.265   0.430
  437   2HB   ASN  65          1HB       ASN  65   2.087   9.527   0.024
  438   1HD2  ASN  65          1HD2      ASN  65   1.437  11.025   2.495
  439   2HD2  ASN  65          2HD2      ASN  65   2.224  10.160   3.775
  440    H    GLY  66           H        GLY  66  -2.129   9.454   0.001
  441   1HA   GLY  66          2HA       GLY  66  -3.516   9.880  -1.817
  442   2HA   GLY  66          1HA       GLY  66  -2.191  10.726  -2.601
  443    H    GLY  67           H        GLY  67  -2.535   7.402  -1.374
  444   1HA   GLY  67          2HA       GLY  67  -1.033   6.438  -3.633
  445   2HA   GLY  67          1HA       GLY  67  -1.657   5.478  -2.299
  446    H    LEU  68           H        LEU  68  -4.326   6.894  -2.918
  447    HA   LEU  68           HA       LEU  68  -5.470   4.711  -4.134
  448   1HB   LEU  68          2HB       LEU  68  -6.455   7.484  -3.644
  449   2HB   LEU  68          1HB       LEU  68  -7.476   6.265  -4.380
  450    HG   LEU  68           HG       LEU  68  -6.917   4.852  -2.300
  451   1HD1  LEU  68          1HD1      LEU  68  -6.472   6.175  -0.279
  452   2HD1  LEU  68          2HD1      LEU  68  -6.185   7.588  -1.296
  453   3HD1  LEU  68          3HD1      LEU  68  -5.124   6.184  -1.416
  454   1HD2  LEU  68          1HD2      LEU  68  -8.642   7.307  -2.054
  455   2HD2  LEU  68          2HD2      LEU  68  -8.753   5.861  -1.053
  456   3HD2  LEU  68          3HD2      LEU  68  -9.122   5.772  -2.775
  457    H    ARG  69           H        ARG  69  -4.093   7.546  -5.568
  458    HA   ARG  69           HA       ARG  69  -5.317   7.350  -8.110
  459   1HB   ARG  69          2HB       ARG  69  -3.438   8.699  -8.914
  460   2HB   ARG  69          1HB       ARG  69  -4.099   9.354  -7.422
  461   1HG   ARG  69          2HG       ARG  69  -2.266   8.727  -6.177
  462   2HG   ARG  69          1HG       ARG  69  -1.778   7.486  -7.332
  463   1HD   ARG  69          2HD       ARG  69  -0.225   9.302  -7.477
  464   2HD   ARG  69          1HD       ARG  69  -1.206   9.297  -8.940
  465    HE   ARG  69           HE       ARG  69  -2.276  11.049  -6.949
  466   1HH1  ARG  69          1HH1      ARG  69   0.256  10.774  -9.369
  467   2HH1  ARG  69          2HH1      ARG  69   0.338  12.491  -9.660
  468   1HH2  ARG  69          1HH2      ARG  69  -2.131  13.319  -7.315
  469   2HH2  ARG  69          2HH2      ARG  69  -1.003  13.924  -8.489
  470    H    TYR  70           H        TYR  70  -2.636   5.768  -6.558
  471    HA   TYR  70           HA       TYR  70  -1.661   4.459  -8.946
  472   1HB   TYR  70          2HB       TYR  70  -1.133   3.952  -6.006
  473   2HB   TYR  70          1HB       TYR  70  -0.160   3.345  -7.341
  474    HD1  TYR  70           1HD      TYR  70   1.235   4.959  -8.661
  475    HD2  TYR  70           2HD      TYR  70  -0.861   6.089  -5.144
  476    HE1  TYR  70           1HE      TYR  70   2.636   6.974  -8.487
  477    HE2  TYR  70           2HE      TYR  70   0.528   8.104  -4.958
  478    HH   TYR  70           HH       TYR  70   2.491   9.224  -7.492
  479    H    ALA  71           H        ALA  71  -3.683   3.993  -6.219
  480    HA   ALA  71           HA       ALA  71  -5.483   2.173  -7.115
  481   1HB   ALA  71          1HB       ALA  71  -3.219   0.713  -5.733
  482   2HB   ALA  71          2HB       ALA  71  -3.661   0.544  -7.433
  483   3HB   ALA  71          3HB       ALA  71  -4.780   0.018  -6.174
  484    HA   PRO  72           HA       PRO  72  -6.801   3.849  -3.215
  485   1HB   PRO  72          2HB       PRO  72  -8.918   1.874  -3.310
  486   2HB   PRO  72          1HB       PRO  72  -9.009   3.625  -3.267
  487   1HG   PRO  72          2HG       PRO  72  -9.555   2.120  -5.484
  488   2HG   PRO  72          1HG       PRO  72  -9.036   3.813  -5.526
  489   1HD   PRO  72          2HD       PRO  72  -7.548   1.370  -6.212
  490   2HD   PRO  72          1HD       PRO  72  -7.264   3.050  -6.711
  491    H    ARG  73           H        ARG  73  -5.722   0.722  -3.757
  492    HA   ARG  73           HA       ARG  73  -5.331   0.347  -0.896
  493   1HB   ARG  73          2HB       ARG  73  -6.078  -1.963  -0.922
  494   2HB   ARG  73          1HB       ARG  73  -7.392  -0.924  -1.462
  495   1HG   ARG  73          2HG       ARG  73  -6.642  -1.459  -3.818
  496   2HG   ARG  73          1HG       ARG  73  -5.635  -2.719  -3.093
  497   1HD   ARG  73          2HD       ARG  73  -8.606  -2.499  -2.628
  498   2HD   ARG  73          1HD       ARG  73  -7.903  -3.449  -3.935
  499    HE   ARG  73           HE       ARG  73  -6.610  -4.409  -1.790
  500   1HH1  ARG  73          1HH1      ARG  73 -10.029  -3.766  -2.276
  501   2HH1  ARG  73          2HH1      ARG  73 -10.537  -5.164  -1.380
  502   1HH2  ARG  73          1HH2      ARG  73  -7.277  -6.249  -0.667
  503   2HH2  ARG  73          2HH2      ARG  73  -8.976  -6.569  -0.436
  504    H    ALA  74           H        ALA  74  -3.437  -0.554  -0.439
  505    HA   ALA  74           HA       ALA  74  -1.364  -0.426  -2.285
  506   1HB   ALA  74          1HB       ALA  74  -1.289  -1.892   0.351
  507   2HB   ALA  74          2HB       ALA  74  -1.110  -0.148   0.176
  508   3HB   ALA  74          3HB       ALA  74   0.080  -1.229  -0.541
  509    H    ASP  75           H        ASP  75  -3.450  -3.111  -1.443
  510    HA   ASP  75           HA       ASP  75  -1.580  -5.010  -2.577
  511   1HB   ASP  75          2HB       ASP  75  -3.229  -6.735  -1.972
  512   2HB   ASP  75          1HB       ASP  75  -2.712  -5.770  -0.606
  513    H    LEU  76           H        LEU  76  -3.691  -2.930  -3.853
  514    HA   LEU  76           HA       LEU  76  -4.221  -4.650  -6.173
  515   1HB   LEU  76          2HB       LEU  76  -6.090  -3.250  -5.417
  516   2HB   LEU  76          1HB       LEU  76  -5.094  -1.816  -5.571
  517    HG   LEU  76           HG       LEU  76  -4.961  -2.199  -8.013
  518   1HD1  LEU  76          1HD1      LEU  76  -5.280  -4.610  -8.024
  519   2HD1  LEU  76          2HD1      LEU  76  -6.470  -3.813  -9.053
  520   3HD1  LEU  76          3HD1      LEU  76  -6.938  -4.405  -7.459
  521   1HD2  LEU  76          1HD2      LEU  76  -7.757  -2.042  -6.894
  522   2HD2  LEU  76          2HD2      LEU  76  -7.259  -1.530  -8.508
  523   3HD2  LEU  76          3HD2      LEU  76  -6.635  -0.693  -7.085
  524    H    ALA  77           H        ALA  77  -2.404  -1.957  -4.989
  525    HA   ALA  77           HA       ALA  77  -1.156  -1.299  -7.469
  526   1HB   ALA  77          1HB       ALA  77   0.259   0.129  -6.047
  527   2HB   ALA  77          2HB       ALA  77  -0.486  -0.587  -4.618
  528   3HB   ALA  77          3HB       ALA  77  -1.462   0.368  -5.736
  529    H    THR  78           H        THR  78   0.876  -1.817  -8.134
  530    HA   THR  78           HA       THR  78   2.052  -4.196  -6.922
  531    HB   THR  78           HB       THR  78   3.248  -4.509  -8.978
  532    HG1  THR  78           1HG      THR  78   2.469  -1.819  -9.480
  533   1HG2  THR  78          1HG2      THR  78   1.398  -4.506 -10.637
  534   2HG2  THR  78          2HG2      THR  78   0.435  -3.554  -9.504
  535   3HG2  THR  78          3HG2      THR  78   0.933  -5.192  -9.079
  536    H    ARG  79           H        ARG  79   4.679  -3.944  -7.615
  537    HA   ARG  79           HA       ARG  79   5.825  -2.610  -5.518
  538   1HB   ARG  79          2HB       ARG  79   7.064  -3.054  -8.246
  539   2HB   ARG  79          1HB       ARG  79   7.956  -2.637  -6.793
  540   1HG   ARG  79          2HG       ARG  79   7.195  -4.763  -5.776
  541   2HG   ARG  79          1HG       ARG  79   6.430  -5.176  -7.314
  542   1HD   ARG  79          2HD       ARG  79   8.605  -6.236  -7.161
  543   2HD   ARG  79          1HD       ARG  79   8.620  -5.011  -8.426
  544    HE   ARG  79           HE       ARG  79   9.674  -4.416  -5.744
  545   1HH1  ARG  79          1HH1      ARG  79  10.139  -4.698  -9.205
  546   2HH1  ARG  79          2HH1      ARG  79  11.730  -3.986  -9.183
  547   1HH2  ARG  79          1HH2      ARG  79  11.746  -3.447  -5.710
  548   2HH2  ARG  79          2HH2      ARG  79  12.639  -3.259  -7.184
  549    H    GLU  80           H        GLU  80   5.457  -1.412  -8.828
  550    HA   GLU  80           HA       GLU  80   6.882   0.956  -8.504
  551   1HB   GLU  80          2HB       GLU  80   5.745   1.711 -10.569
  552   2HB   GLU  80          1HB       GLU  80   6.412   0.089 -10.687
  553   1HG   GLU  80          2HG       GLU  80   4.103  -0.771 -10.186
  554   2HG   GLU  80          1HG       GLU  80   3.531   0.884 -10.395
  555    H    GLU  81           H        GLU  81   3.306   0.510  -8.268
  556    HA   GLU  81           HA       GLU  81   2.787   3.179  -7.562
  557   1HB   GLU  81          2HB       GLU  81   1.274   0.684  -6.831
  558   2HB   GLU  81          1HB       GLU  81   0.670   2.323  -6.661
  559   1HG   GLU  81          2HG       GLU  81  -0.263   1.885  -8.626
  560   2HG   GLU  81          1HG       GLU  81   1.310   2.345  -9.260
  561    H    GLN  82           H        GLN  82   3.227   0.297  -5.496
  562    HA   GLN  82           HA       GLN  82   2.668   1.632  -3.082
  563   1HB   GLN  82          2HB       GLN  82   4.417  -0.784  -3.513
  564   2HB   GLN  82          1HB       GLN  82   3.803  -0.236  -1.962
  565   1HG   GLN  82          2HG       GLN  82   1.482  -0.503  -3.057
  566   2HG   GLN  82          1HG       GLN  82   2.346  -1.512  -4.225
  567   1HE2  GLN  82          1HE2      GLN  82   1.553  -3.460  -3.635
  568   2HE2  GLN  82          2HE2      GLN  82   1.801  -4.169  -2.068
  569    H    ILE  83           H        ILE  83   5.664   1.064  -4.813
  570    HA   ILE  83           HA       ILE  83   7.450   2.106  -2.945
  571    HB   ILE  83           HB       ILE  83   7.516   1.985  -5.953
  572   1HG1  ILE  83          2HG1      ILE  83   9.308   0.652  -3.929
  573   2HG1  ILE  83          1HG1      ILE  83   7.806  -0.073  -4.477
  574   1HG2  ILE  83          1HG2      ILE  83   9.895   2.664  -5.830
  575   2HG2  ILE  83          2HG2      ILE  83   9.643   3.104  -4.140
  576   3HG2  ILE  83          3HG2      ILE  83   8.771   3.957  -5.414
  577   1HD1  ILE  83          1HD1      ILE  83  10.168   0.631  -6.204
  578   2HD1  ILE  83          2HD1      ILE  83   8.658  -0.078  -6.772
  579   3HD1  ILE  83          3HD1      ILE  83   9.700  -0.984  -5.676
  580    H    ALA  84           H        ALA  84   5.536   3.700  -5.464
  581    HA   ALA  84           HA       ALA  84   6.704   6.266  -5.151
  582   1HB   ALA  84          1HB       ALA  84   5.534   5.639  -7.175
  583   2HB   ALA  84          2HB       ALA  84   4.778   7.061  -6.454
  584   3HB   ALA  84          3HB       ALA  84   4.023   5.476  -6.280
  585    H    VAL  85           H        VAL  85   3.799   4.789  -3.778
  586    HA   VAL  85           HA       VAL  85   2.937   7.107  -2.381
  587    HB   VAL  85           HB       VAL  85   2.368   4.258  -1.597
  588   1HG1  VAL  85          1HG1      VAL  85   0.739   6.786  -1.299
  589   2HG1  VAL  85          2HG1      VAL  85   1.649   5.996  -0.011
  590   3HG1  VAL  85          3HG1      VAL  85   0.271   5.177  -0.747
  591   1HG2  VAL  85          1HG2      VAL  85   0.440   4.329  -3.085
  592   2HG2  VAL  85          2HG2      VAL  85   1.949   4.513  -3.978
  593   3HG2  VAL  85          3HG2      VAL  85   0.937   5.922  -3.657
  594    H    ALA  86           H        ALA  86   4.669   4.173  -1.310
  595    HA   ALA  86           HA       ALA  86   5.302   4.955   1.278
  596   1HB   ALA  86          1HB       ALA  86   5.633   2.687   0.409
  597   2HB   ALA  86          2HB       ALA  86   7.096   3.318   1.162
  598   3HB   ALA  86          3HB       ALA  86   6.959   3.268  -0.594
  599    H    GLU  87           H        GLU  87   6.614   5.883  -1.775
  600    HA   GLU  87           HA       GLU  87   9.091   6.967  -0.996
  601   1HB   GLU  87          2HB       GLU  87   7.213   7.529  -3.263
  602   2HB   GLU  87          1HB       GLU  87   8.538   8.644  -2.968
  603   1HG   GLU  87          2HG       GLU  87   8.849   5.693  -3.453
  604   2HG   GLU  87          1HG       GLU  87   9.037   6.950  -4.678
  605    H    VAL  88           H        VAL  88   5.862   8.427  -1.179
  606    HA   VAL  88           HA       VAL  88   6.606  10.962  -0.191
  607    HB   VAL  88           HB       VAL  88   3.961   9.568   0.266
  608   1HG1  VAL  88          1HG1      VAL  88   4.273  11.563   1.624
  609   2HG1  VAL  88          2HG1      VAL  88   3.057  11.837   0.377
  610   3HG1  VAL  88          3HG1      VAL  88   4.681  12.496   0.183
  611   1HG2  VAL  88          1HG2      VAL  88   4.504   9.524  -2.103
  612   2HG2  VAL  88          2HG2      VAL  88   4.845  11.255  -2.075
  613   3HG2  VAL  88          3HG2      VAL  88   3.204  10.675  -1.791
  614    H    THR  89           H        THR  89   5.594   7.984   1.405
  615    HA   THR  89           HA       THR  89   5.316   9.009   3.999
  616    HB   THR  89           HB       THR  89   6.250   6.215   3.668
  617    HG1  THR  89           1HG      THR  89   3.740   7.142   2.655
  618   1HG2  THR  89          1HG2      THR  89   3.849   7.445   5.013
  619   2HG2  THR  89          2HG2      THR  89   5.388   7.101   5.796
  620   3HG2  THR  89          3HG2      THR  89   4.401   5.778   5.176
  621    H    ARG  90           H        ARG  90   8.084   7.378   2.440
  622    HA   ARG  90           HA       ARG  90   9.762   7.339   4.691
  623   1HB   ARG  90          2HB       ARG  90  11.579   6.812   3.239
  624   2HB   ARG  90          1HB       ARG  90  10.149   6.042   2.570
  625   1HG   ARG  90          2HG       ARG  90  10.033   7.532   0.791
  626   2HG   ARG  90          1HG       ARG  90  11.088   8.706   1.589
  627   1HD   ARG  90          2HD       ARG  90  12.984   7.257   1.337
  628   2HD   ARG  90          1HD       ARG  90  11.965   5.954   0.728
  629    HE   ARG  90           HE       ARG  90  11.709   7.127  -1.307
  630   1HH1  ARG  90          1HH1      ARG  90  13.951   8.653   0.911
  631   2HH1  ARG  90          2HH1      ARG  90  14.705   9.616  -0.314
  632   1HH2  ARG  90          1HH2      ARG  90  12.672   8.377  -2.917
  633   2HH2  ARG  90          2HH2      ARG  90  14.000   9.436  -2.520
  634    H    LEU  91           H        LEU  91   8.985   9.855   2.479
  635    HA   LEU  91           HA       LEU  91  11.218  11.555   3.030
  636   1HB   LEU  91          2HB       LEU  91   8.465  12.524   2.281
  637   2HB   LEU  91          1HB       LEU  91   9.993  13.338   2.017
  638    HG   LEU  91           HG       LEU  91   9.030  10.860   0.619
  639   1HD1  LEU  91          1HD1      LEU  91   9.007  12.321  -1.362
  640   2HD1  LEU  91          2HD1      LEU  91   9.412  13.695  -0.332
  641   3HD1  LEU  91          3HD1      LEU  91   7.877  12.853  -0.118
  642   1HD2  LEU  91          1HD2      LEU  91  11.450  10.805   0.917
  643   2HD2  LEU  91          2HD2      LEU  91  11.581  12.435   0.257
  644   3HD2  LEU  91          3HD2      LEU  91  11.038  11.110  -0.772
  645    H    ARG  92           H        ARG  92   8.170  10.942   4.557
  646    HA   ARG  92           HA       ARG  92   8.311  13.356   6.149
  647   1HB   ARG  92          2HB       ARG  92   6.246  11.229   6.481
  648   2HB   ARG  92          1HB       ARG  92   6.103  12.960   6.752
  649   1HG   ARG  92          2HG       ARG  92   6.018  13.410   4.435
  650   2HG   ARG  92          1HG       ARG  92   6.498  11.758   4.034
  651   1HD   ARG  92          2HD       ARG  92   3.879  12.806   4.963
  652   2HD   ARG  92          1HD       ARG  92   4.245  11.609   3.713
  653    HE   ARG  92           HE       ARG  92   5.032  10.368   5.953
  654   1HH1  ARG  92          1HH1      ARG  92   2.048  11.993   5.092
  655   2HH1  ARG  92          2HH1      ARG  92   1.075  11.058   6.198
  656   1HH2  ARG  92          1HH2      ARG  92   3.718   9.079   7.362
  657   2HH2  ARG  92          2HH2      ARG  92   2.006   9.395   7.445
  658    H    GLN  93           H        GLN  93   8.127   9.868   6.605
  659    HA   GLN  93           HA       GLN  93   8.906  10.266   9.380
  660   1HB   GLN  93          2HB       GLN  93   7.061   9.113   9.792
  661   2HB   GLN  93          1HB       GLN  93   6.836   8.771   8.092
  662   1HG   GLN  93          2HG       GLN  93   8.583   7.153   9.918
  663   2HG   GLN  93          1HG       GLN  93   6.887   6.795   9.608
  664   1HE2  GLN  93          1HE2      GLN  93   7.048   7.482   6.774
  665   2HE2  GLN  93          2HE2      GLN  93   7.921   6.194   6.030
  666    H    GLY  94           H        GLY  94   9.999   8.966   6.429
  667   1HA   GLY  94          2HA       GLY  94  12.175   8.255   5.984
  668   2HA   GLY  94          1HA       GLY  94  12.461   8.141   7.717
  669    H    TRP  95           H        TRP  95  12.415   6.262   8.627
  670    HA   TRP  95           HA       TRP  95  11.020   4.025   7.418
  671   1HB   TRP  95          2HB       TRP  95  13.878   3.624   8.299
  672   2HB   TRP  95          1HB       TRP  95  12.902   2.625   7.217
  673    HD1  TRP  95           HD       TRP  95  14.878   5.916   7.239
  674    HE1  TRP  95           1HE      TRP  95  15.471   6.544   4.826
  675    HE3  TRP  95           3HE      TRP  95  12.270   2.253   4.816
  676    HZ2  TRP  95           2HZ      TRP  95  14.909   5.593   2.219
  677    HZ3  TRP  95           3HZ      TRP  95  12.349   2.183   2.358
  678    HH2  TRP  95           HH       TRP  95  13.641   3.819   1.089
  679    H    GLY  96           H        GLY  96  10.862   5.884   9.687
  680   1HA   GLY  96          2HA       GLY  96  11.267   4.281  12.049
  681   2HA   GLY  96          1HA       GLY  96  10.387   5.801  11.953
  682    H    ALA  97           H        ALA  97   8.804   4.686   9.666
  683    HA   ALA  97           HA       ALA  97   6.806   3.287  11.229
  684   1HB   ALA  97          1HB       ALA  97   6.074   5.002   9.636
  685   2HB   ALA  97          2HB       ALA  97   5.399   3.421   9.243
  686   3HB   ALA  97          3HB       ALA  97   6.757   4.056   8.312
  687    H    TRP  98           H        TRP  98   9.156   2.655   8.696
  688    HA   TRP  98           HA       TRP  98   8.408  -0.196   8.760
  689   1HB   TRP  98          2HB       TRP  98  10.377   1.297   6.998
  690   2HB   TRP  98          1HB       TRP  98   9.956  -0.404   6.842
  691    HD1  TRP  98           HD       TRP  98   7.422  -0.948   6.026
  692    HE1  TRP  98           1HE      TRP  98   5.861   0.362   4.460
  693    HE3  TRP  98           3HE      TRP  98   9.693   3.661   6.260
  694    HZ2  TRP  98           2HZ      TRP  98   5.627   2.997   3.436
  695    HZ3  TRP  98           3HZ      TRP  98   8.725   5.510   4.948
  696    HH2  TRP  98           HH       TRP  98   6.739   5.169   3.582
  697    HA   PRO  99           HA       PRO  99  11.726  -0.038  11.789
  698   1HB   PRO  99          2HB       PRO  99  10.638  -2.531  12.838
  699   2HB   PRO  99          1HB       PRO  99  10.751  -0.944  13.593
  700   1HG   PRO  99          2HG       PRO  99   8.384  -1.930  12.825
  701   2HG   PRO  99          1HG       PRO  99   8.788  -0.205  12.669
  702   1HD   PRO  99          2HD       PRO  99   8.938  -2.342  10.544
  703   2HD   PRO  99          1HD       PRO  99   8.117  -0.761  10.475
  704    H    VAL 100           H        VAL 100  11.187  -3.517  11.564
  705    HA   VAL 100           HA       VAL 100  14.009  -3.931  11.527
  706    HB   VAL 100           HB       VAL 100  11.759  -5.927  11.172
  707   1HG1  VAL 100          1HG1      VAL 100  14.664  -6.365  11.871
  708   2HG1  VAL 100          2HG1      VAL 100  13.888  -6.785  10.344
  709   3HG1  VAL 100          3HG1      VAL 100  13.413  -7.608  11.829
  710   1HG2  VAL 100          1HG2      VAL 100  13.301  -5.132  13.640
  711   2HG2  VAL 100          2HG2      VAL 100  12.094  -6.417  13.548
  712   3HG2  VAL 100          3HG2      VAL 100  11.618  -4.737  13.292
  713    H    CYS 101           H        CYS 101  11.493  -3.774   9.192
  714    HA   CYS 101           HA       CYS 101  12.844  -5.257   7.168
  715   1HB   CYS 101          2HB       CYS 101  10.477  -3.393   7.049
  716   2HB   CYS 101          1HB       CYS 101  11.090  -4.283   5.655
  717    H    ALA 102           H        ALA 102  12.842  -1.918   8.166
  718    HA   ALA 102           HA       ALA 102  14.103  -0.903   5.825
  719   1HB   ALA 102          1HB       ALA 102  14.619   1.058   7.165
  720   2HB   ALA 102          2HB       ALA 102  14.180   0.190   8.637
  721   3HB   ALA 102          3HB       ALA 102  12.949   0.554   7.427
  722    H    ALA 103           H        ALA 103  15.281  -2.180   8.908
  723    HA   ALA 103           HA       ALA 103  18.019  -1.714   8.463
  724   1HB   ALA 103          1HB       ALA 103  16.718  -3.911  10.073
  725   2HB   ALA 103          2HB       ALA 103  17.120  -2.297  10.661
  726   3HB   ALA 103          3HB       ALA 103  18.405  -3.408  10.185
  727    H    ARG 104           H        ARG 104  15.894  -4.353   7.601
  728    HA   ARG 104           HA       ARG 104  17.881  -6.014   6.434
  729   1HB   ARG 104          2HB       ARG 104  14.924  -5.945   6.606
  730   2HB   ARG 104          1HB       ARG 104  15.607  -6.857   5.272
  731   1HG   ARG 104          2HG       ARG 104  15.078  -8.223   7.259
  732   2HG   ARG 104          1HG       ARG 104  16.761  -8.315   6.760
  733   1HD   ARG 104          2HD       ARG 104  16.023  -6.325   8.847
  734   2HD   ARG 104          1HD       ARG 104  16.057  -8.031   9.296
  735    HE   ARG 104           HE       ARG 104  18.415  -7.090   7.903
  736   1HH1  ARG 104          1HH1      ARG 104  16.931  -7.725  11.025
  737   2HH1  ARG 104          2HH1      ARG 104  18.451  -7.735  11.870
  738   1HH2  ARG 104          1HH2      ARG 104  20.391  -7.105   9.024
  739   2HH2  ARG 104          2HH2      ARG 104  20.401  -7.375  10.742
  740    H    ALA 105           H        ALA 105  15.978  -3.345   5.266
  741    HA   ALA 105           HA       ALA 105  16.455  -4.079   2.473
  742   1HB   ALA 105          1HB       ALA 105  14.780  -1.867   3.630
  743   2HB   ALA 105          2HB       ALA 105  14.199  -3.471   3.182
  744   3HB   ALA 105          3HB       ALA 105  14.824  -2.381   1.944
  745    H    GLY 106           H        GLY 106  17.584  -1.819   4.844
  746   1HA   GLY 106          2HA       GLY 106  19.634  -0.610   4.467
  747   2HA   GLY 106          1HA       GLY 106  19.210  -0.504   2.765
  748    H    ALA 107           H        ALA 107  18.033   0.487   5.957
  749    HA   ALA 107           HA       ALA 107  16.304   2.523   5.120
  750   1HB   ALA 107          1HB       ALA 107  16.269   1.563   7.377
  751   2HB   ALA 107          2HB       ALA 107  16.399   3.322   7.417
  752   3HB   ALA 107          3HB       ALA 107  17.823   2.327   7.719
  753    H    ARG 108           H        ARG 108  16.540   4.807   5.119
  754    HA   ARG 108           HA       ARG 108  19.303   5.684   4.671
  755   1HB   ARG 108          2HB       ARG 108  17.020   5.960   2.714
  756   2HB   ARG 108          1HB       ARG 108  18.560   6.794   2.561
  757   1HG   ARG 108          2HG       ARG 108  19.727   4.708   2.323
  758   2HG   ARG 108          1HG       ARG 108  18.245   3.799   2.640
  759   1HD   ARG 108          2HD       ARG 108  17.270   4.512   0.593
  760   2HD   ARG 108          1HD       ARG 108  18.527   5.725   0.338
  761    HE   ARG 108           HE       ARG 108  19.745   3.211   0.492
  762   1HH1  ARG 108          1HH1      ARG 108  17.526   4.901  -1.635
  763   2HH1  ARG 108          2HH1      ARG 108  18.162   4.157  -3.074
  764   1HH2  ARG 108          1HH2      ARG 108  20.575   2.242  -1.399
  765   2HH2  ARG 108          2HH2      ARG 108  19.914   2.676  -2.949
  Start of MODEL   21
    1   1H    ASN   1          1HT       ASN   1  30.498 -11.626 -26.191
    2   2H    ASN   1          2HT       ASN   1  30.355 -13.304 -26.010
    3   3H    ASN   1          3HT       ASN   1  30.279 -12.293 -24.649
    4    HA   ASN   1           HA       ASN   1  28.109 -13.166 -25.425
    5   1HB   ASN   1          2HB       ASN   1  28.553 -10.183 -25.368
    6   2HB   ASN   1          1HB       ASN   1  26.963 -10.934 -25.377
    7   1HD2  ASN   1          1HD2      ASN   1  28.300  -9.252 -23.370
    8   2HD2  ASN   1          2HD2      ASN   1  28.302 -10.187 -21.907
    9    H    VAL   2           H        VAL   2  28.030 -14.137 -27.353
   10    HA   VAL   2           HA       VAL   2  27.563 -12.428 -29.690
   11    HB   VAL   2           HB       VAL   2  29.422 -14.163 -29.751
   12   1HG1  VAL   2          1HG1      VAL   2  28.745 -16.470 -30.283
   13   2HG1  VAL   2          2HG1      VAL   2  27.080 -16.046 -29.889
   14   3HG1  VAL   2          3HG1      VAL   2  28.323 -15.985 -28.641
   15   1HG2  VAL   2          1HG2      VAL   2  28.579 -13.126 -31.773
   16   2HG2  VAL   2          2HG2      VAL   2  27.263 -14.296 -31.853
   17   3HG2  VAL   2          3HG2      VAL   2  28.931 -14.829 -32.067
   18    H    VAL   3           H        VAL   3  26.014 -14.007 -27.321
   19    HA   VAL   3           HA       VAL   3  23.951 -15.434 -28.462
   20    HB   VAL   3           HB       VAL   3  24.401 -15.417 -26.061
   21   1HG1  VAL   3          1HG1      VAL   3  23.721 -13.551 -24.642
   22   2HG1  VAL   3          2HG1      VAL   3  23.288 -12.615 -26.073
   23   3HG1  VAL   3          3HG1      VAL   3  24.971 -13.061 -25.791
   24   1HG2  VAL   3          1HG2      VAL   3  21.620 -14.471 -26.732
   25   2HG2  VAL   3          2HG2      VAL   3  22.091 -15.290 -25.243
   26   3HG2  VAL   3          3HG2      VAL   3  22.203 -16.136 -26.787
   27    H    VAL   4           H        VAL   4  22.004 -14.915 -29.353
   28    HA   VAL   4           HA       VAL   4  21.645 -12.430 -30.588
   29    HB   VAL   4           HB       VAL   4  20.599 -14.317 -31.555
   30   1HG1  VAL   4          1HG1      VAL   4  18.790 -15.576 -30.486
   31   2HG1  VAL   4          2HG1      VAL   4  18.999 -14.612 -29.024
   32   3HG1  VAL   4          3HG1      VAL   4  20.292 -15.681 -29.568
   33   1HG2  VAL   4          1HG2      VAL   4  18.272 -13.600 -31.819
   34   2HG2  VAL   4          2HG2      VAL   4  19.403 -12.250 -31.912
   35   3HG2  VAL   4          3HG2      VAL   4  18.465 -12.514 -30.441
   36    H    THR   5           H        THR   5  20.304 -10.749 -30.200
   37    HA   THR   5           HA       THR   5  19.852 -10.304 -27.362
   38    HB   THR   5           HB       THR   5  21.268  -8.678 -28.488
   39    HG1  THR   5           1HG      THR   5  19.234  -6.942 -28.126
   40   1HG2  THR   5          1HG2      THR   5  20.345  -8.800 -30.742
   41   2HG2  THR   5          2HG2      THR   5  20.349  -7.135 -30.160
   42   3HG2  THR   5          3HG2      THR   5  18.847  -8.058 -30.179
   43    HA   PRO   6           HA       PRO   6  15.413 -10.358 -28.031
   44   1HB   PRO   6          2HB       PRO   6  15.015  -9.732 -25.289
   45   2HB   PRO   6          1HB       PRO   6  14.932 -11.323 -26.045
   46   1HG   PRO   6          2HG       PRO   6  16.846 -10.520 -24.200
   47   2HG   PRO   6          1HG       PRO   6  16.995 -11.899 -25.303
   48   1HD   PRO   6          2HD       PRO   6  18.135  -9.151 -25.540
   49   2HD   PRO   6          1HD       PRO   6  18.832 -10.714 -26.013
   50    H    ALA   7           H        ALA   7  13.611  -8.982 -27.144
   51    HA   ALA   7           HA       ALA   7  12.480  -7.018 -27.251
   52   1HB   ALA   7          1HB       ALA   7  14.947  -5.803 -26.045
   53   2HB   ALA   7          2HB       ALA   7  13.751  -6.722 -25.134
   54   3HB   ALA   7          3HB       ALA   7  13.287  -5.218 -25.930
   55    H    HIS   8           H        HIS   8  13.356  -7.658 -29.552
   56    HA   HIS   8           HA       HIS   8  14.624  -5.427 -30.874
   57   1HB   HIS   8          2HB       HIS   8  14.995  -7.648 -31.783
   58   2HB   HIS   8          1HB       HIS   8  13.263  -7.927 -31.902
   59    HD1  HIS   8           1HD      HIS   8  15.797  -5.461 -33.404
   60    HD2  HIS   8           2HD      HIS   8  12.311  -7.522 -34.356
   61    HE1  HIS   8           1HE      HIS   8  15.310  -4.958 -35.831
   62    H    GLU   9           H        GLU   9  11.645  -6.139 -29.593
   63    HA   GLU   9           HA       GLU   9   9.889  -5.049 -31.525
   64   1HB   GLU   9          2HB       GLU   9   8.239  -4.967 -29.752
   65   2HB   GLU   9          1HB       GLU   9   9.122  -6.481 -29.676
   66   1HG   GLU   9          2HG       GLU   9  10.503  -5.522 -27.855
   67   2HG   GLU   9          1HG       GLU   9   9.485  -4.084 -27.896
   68    H    ALA  10           H        ALA  10   9.154  -3.004 -31.848
   69    HA   ALA  10           HA       ALA  10  10.838  -0.934 -30.645
   70   1HB   ALA  10          1HB       ALA  10  11.091  -1.215 -33.073
   71   2HB   ALA  10          2HB       ALA  10  10.453   0.377 -32.657
   72   3HB   ALA  10          3HB       ALA  10   9.373  -0.869 -33.282
   73    H    VAL  11           H        VAL  11   9.211  -1.302 -28.926
   74    HA   VAL  11           HA       VAL  11   6.771   0.187 -29.207
   75    HB   VAL  11           HB       VAL  11   8.093  -0.779 -26.703
   76   1HG1  VAL  11          1HG1      VAL  11   5.848  -0.559 -25.712
   77   2HG1  VAL  11          2HG1      VAL  11   5.276   0.145 -27.225
   78   3HG1  VAL  11          3HG1      VAL  11   6.495   0.984 -26.266
   79   1HG2  VAL  11          1HG2      VAL  11   7.592  -2.625 -28.224
   80   2HG2  VAL  11          2HG2      VAL  11   5.918  -2.082 -28.325
   81   3HG2  VAL  11          3HG2      VAL  11   6.562  -2.672 -26.794
   82    H    VAL  12           H        VAL  12   9.635   0.517 -27.172
   83    HA   VAL  12           HA       VAL  12  10.418   2.271 -25.997
   84    HB   VAL  12           HB       VAL  12  11.859   2.108 -27.829
   85   1HG1  VAL  12          1HG1      VAL  12  11.600   3.330 -29.921
   86   2HG1  VAL  12          2HG1      VAL  12  10.049   3.959 -29.364
   87   3HG1  VAL  12          3HG1      VAL  12  10.246   2.229 -29.651
   88   1HG2  VAL  12          1HG2      VAL  12  12.293   3.961 -26.350
   89   2HG2  VAL  12          2HG2      VAL  12  11.220   4.996 -27.287
   90   3HG2  VAL  12          3HG2      VAL  12  12.723   4.411 -27.999
   91    H    ARG  13           H        ARG  13   8.725   2.983 -24.894
   92    HA   ARG  13           HA       ARG  13   7.396   4.521 -23.954
   93   1HB   ARG  13          2HB       ARG  13   9.458   5.872 -25.181
   94   2HB   ARG  13          1HB       ARG  13   8.017   6.767 -25.650
   95   1HG   ARG  13          2HG       ARG  13   7.416   7.105 -23.356
   96   2HG   ARG  13          1HG       ARG  13   8.726   6.047 -22.820
   97   1HD   ARG  13          2HD       ARG  13   9.091   8.631 -24.333
   98   2HD   ARG  13          1HD       ARG  13   9.270   8.447 -22.587
   99    HE   ARG  13           HE       ARG  13  11.062   6.743 -23.233
  100   1HH1  ARG  13          1HH1      ARG  13  10.267   9.479 -25.259
  101   2HH1  ARG  13          2HH1      ARG  13  11.903   9.698 -25.825
  102   1HH2  ARG  13          1HH2      ARG  13  13.204   7.009 -23.984
  103   2HH2  ARG  13          2HH2      ARG  13  13.567   8.282 -25.110
  104    H    VAL  14           H        VAL  14   5.349   5.178 -24.086
  105    HA   VAL  14           HA       VAL  14   4.062   5.272 -26.707
  106    HB   VAL  14           HB       VAL  14   2.610   5.301 -24.094
  107   1HG1  VAL  14          1HG1      VAL  14   0.835   4.215 -25.394
  108   2HG1  VAL  14          2HG1      VAL  14   1.866   4.277 -26.823
  109   3HG1  VAL  14          3HG1      VAL  14   1.310   5.772 -26.072
  110   1HG2  VAL  14          1HG2      VAL  14   4.094   3.382 -23.931
  111   2HG2  VAL  14          2HG2      VAL  14   3.562   2.816 -25.516
  112   3HG2  VAL  14          3HG2      VAL  14   2.430   2.847 -24.163
  113    H    GLY  15           H        GLY  15   2.430   6.939 -26.931
  114   1HA   GLY  15          2HA       GLY  15   3.296   9.435 -25.646
  115   2HA   GLY  15          1HA       GLY  15   2.909   9.300 -27.355
  116    H    THR  16           H        THR  16   0.729   8.069 -27.588
  117    HA   THR  16           HA       THR  16  -1.252   9.836 -26.744
  118    HB   THR  16           HB       THR  16  -1.661   7.045 -27.788
  119    HG1  THR  16           1HG      THR  16  -1.711   9.264 -29.497
  120   1HG2  THR  16          1HG2      THR  16  -3.359   9.530 -27.991
  121   2HG2  THR  16          2HG2      THR  16  -3.681   8.148 -26.944
  122   3HG2  THR  16          3HG2      THR  16  -3.734   7.960 -28.696
  123    H    LYS  17           H        LYS  17  -0.300   6.695 -25.645
  124    HA   LYS  17           HA       LYS  17  -2.085   6.920 -23.325
  125   1HB   LYS  17          2HB       LYS  17  -0.416   4.495 -23.962
  126   2HB   LYS  17          1HB       LYS  17  -1.866   4.595 -22.980
  127   1HG   LYS  17          2HG       LYS  17  -1.621   4.587 -25.962
  128   2HG   LYS  17          1HG       LYS  17  -2.515   3.484 -24.919
  129   1HD   LYS  17          2HD       LYS  17  -3.937   5.494 -24.287
  130   2HD   LYS  17          1HD       LYS  17  -3.172   6.315 -25.653
  131   1HE   LYS  17          2HE       LYS  17  -4.857   3.816 -25.712
  132   2HE   LYS  17          1HE       LYS  17  -5.253   5.389 -26.398
  133   1HZ   LYS  17          1HZ       LYS  17  -3.012   3.663 -27.315
  134   2HZ   LYS  17          2HZ       LYS  17  -3.510   5.121 -28.020
  135   3HZ   LYS  17          3HZ       LYS  17  -4.527   3.769 -28.067
  136    HA   PRO  18           HA       PRO  18   1.864   8.066 -21.343
  137   1HB   PRO  18          2HB       PRO  18   0.086   9.134 -19.270
  138   2HB   PRO  18          1HB       PRO  18   1.325   9.965 -20.218
  139   1HG   PRO  18          2HG       PRO  18  -1.276  10.434 -20.605
  140   2HG   PRO  18          1HG       PRO  18  -0.114  10.428 -21.943
  141   1HD   PRO  18          2HD       PRO  18  -1.991   8.249 -21.076
  142   2HD   PRO  18          1HD       PRO  18  -1.685   8.868 -22.715
  143    H    GLY  19           H        GLY  19   2.781   7.345 -19.478
  144   1HA   GLY  19          2HA       GLY  19   3.013   6.023 -17.564
  145   2HA   GLY  19          1HA       GLY  19   1.306   5.600 -17.683
  146    H    THR  20           H        THR  20   4.048   5.334 -19.878
  147    HA   THR  20           HA       THR  20   3.314   2.903 -21.045
  148    HB   THR  20           HB       THR  20   6.121   3.986 -20.693
  149    HG1  THR  20           1HG      THR  20   3.985   5.018 -22.005
  150   1HG2  THR  20          1HG2      THR  20   5.997   1.708 -21.573
  151   2HG2  THR  20          2HG2      THR  20   6.560   2.847 -22.798
  152   3HG2  THR  20          3HG2      THR  20   4.897   2.261 -22.835
  153    H    GLU  21           H        GLU  21   5.396   3.665 -18.343
  154    HA   GLU  21           HA       GLU  21   4.966   1.058 -17.173
  155   1HB   GLU  21          2HB       GLU  21   7.712   2.321 -17.469
  156   2HB   GLU  21          1HB       GLU  21   7.353   0.881 -16.530
  157   1HG   GLU  21          2HG       GLU  21   6.794  -0.333 -18.540
  158   2HG   GLU  21          1HG       GLU  21   7.028   1.119 -19.514
  159    H    VAL  22           H        VAL  22   4.753   1.281 -14.956
  160    HA   VAL  22           HA       VAL  22   4.514   3.935 -13.926
  161    HB   VAL  22           HB       VAL  22   4.594   1.344 -12.360
  162   1HG1  VAL  22          1HG1      VAL  22   3.471   4.061 -11.665
  163   2HG1  VAL  22          2HG1      VAL  22   4.901   3.308 -10.958
  164   3HG1  VAL  22          3HG1      VAL  22   3.308   2.603 -10.683
  165   1HG2  VAL  22          1HG2      VAL  22   2.877   1.264 -14.092
  166   2HG2  VAL  22          2HG2      VAL  22   2.226   2.804 -13.529
  167   3HG2  VAL  22          3HG2      VAL  22   2.151   1.381 -12.488
  168    HA   PRO  23           HA       PRO  23   8.780   4.533 -13.957
  169   1HB   PRO  23          2HB       PRO  23   8.285   6.575 -11.858
  170   2HB   PRO  23          1HB       PRO  23   9.082   6.741 -13.427
  171   1HG   PRO  23          2HG       PRO  23   6.607   7.661 -13.021
  172   2HG   PRO  23          1HG       PRO  23   7.079   6.939 -14.568
  173   1HD   PRO  23          2HD       PRO  23   5.432   5.820 -12.366
  174   2HD   PRO  23          1HD       PRO  23   5.296   5.571 -14.116
  175    HA   PRO  24           HA       PRO  24  10.362   2.145 -10.510
  176   1HB   PRO  24          2HB       PRO  24  12.985   2.560 -11.376
  177   2HB   PRO  24          1HB       PRO  24  11.962   1.187 -11.811
  178   1HG   PRO  24          2HG       PRO  24  12.492   3.711 -13.312
  179   2HG   PRO  24          1HG       PRO  24  12.309   2.055 -13.927
  180   1HD   PRO  24          2HD       PRO  24  10.314   3.793 -14.162
  181   2HD   PRO  24          1HD       PRO  24   9.992   2.107 -13.712
  182    H    VAL  25           H        VAL  25  11.112   2.760  -8.637
  183    HA   VAL  25           HA       VAL  25  12.116   5.505  -8.327
  184    HB   VAL  25           HB       VAL  25  10.563   3.840  -6.334
  185   1HG1  VAL  25          1HG1      VAL  25  12.085   5.313  -5.186
  186   2HG1  VAL  25          2HG1      VAL  25  10.440   5.916  -5.013
  187   3HG1  VAL  25          3HG1      VAL  25  11.546   6.680  -6.156
  188   1HG2  VAL  25          1HG2      VAL  25   9.710   6.243  -7.945
  189   2HG2  VAL  25          2HG2      VAL  25   8.755   5.463  -6.682
  190   3HG2  VAL  25          3HG2      VAL  25   9.147   4.585  -8.161
  191    H    ILE  26           H        ILE  26  13.920   5.824  -7.139
  192    HA   ILE  26           HA       ILE  26  15.853   3.806  -7.348
  193    HB   ILE  26           HB       ILE  26  16.076   6.332  -5.712
  194   1HG1  ILE  26          2HG1      ILE  26  15.324   6.909  -7.937
  195   2HG1  ILE  26          1HG1      ILE  26  17.026   7.327  -7.785
  196   1HG2  ILE  26          1HG2      ILE  26  17.902   4.798  -5.295
  197   2HG2  ILE  26          2HG2      ILE  26  18.476   6.166  -6.247
  198   3HG2  ILE  26          3HG2      ILE  26  18.177   4.614  -7.028
  199   1HD1  ILE  26          1HD1      ILE  26  17.623   5.282  -8.995
  200   2HD1  ILE  26          2HD1      ILE  26  16.574   6.338  -9.941
  201   3HD1  ILE  26          3HD1      ILE  26  15.911   4.899  -9.168
  202    H    ASP  27           H        ASP  27  13.724   4.543  -4.778
  203    HA   ASP  27           HA       ASP  27  15.347   3.107  -2.841
  204   1HB   ASP  27          2HB       ASP  27  12.773   4.580  -2.326
  205   2HB   ASP  27          1HB       ASP  27  13.926   4.001  -1.133
  206    H    GLY  28           H        GLY  28  13.266   2.421  -5.118
  207   1HA   GLY  28          2HA       GLY  28  11.263   0.842  -3.903
  208   2HA   GLY  28          1HA       GLY  28  11.807   0.710  -5.573
  209    H    SER  29           H        SER  29  14.561   0.462  -4.180
  210    HA   SER  29           HA       SER  29  14.662  -2.416  -4.246
  211   1HB   SER  29          2HB       SER  29  16.781  -0.580  -3.168
  212   2HB   SER  29          1HB       SER  29  16.992  -2.165  -3.908
  213    HG   SER  29           HG       SER  29  16.665  -1.320  -5.887
  214    H    ILE  30           H        ILE  30  14.802   0.100  -1.882
  215    HA   ILE  30           HA       ILE  30  15.200  -1.509   0.426
  216    HB   ILE  30           HB       ILE  30  13.665   1.012   0.774
  217   1HG1  ILE  30          2HG1      ILE  30  15.070   1.691  -1.118
  218   2HG1  ILE  30          1HG1      ILE  30  15.603   2.476   0.363
  219   1HG2  ILE  30          1HG2      ILE  30  14.564  -0.199   2.661
  220   2HG2  ILE  30          2HG2      ILE  30  15.291   1.403   2.539
  221   3HG2  ILE  30          3HG2      ILE  30  16.198  -0.018   2.022
  222   1HD1  ILE  30          1HD1      ILE  30  17.489   1.748  -0.966
  223   2HD1  ILE  30          2HD1      ILE  30  16.897   0.088  -0.924
  224   3HD1  ILE  30          3HD1      ILE  30  17.428   0.872   0.565
  225    H    TRP  31           H        TRP  31  12.502  -0.250  -1.355
  226    HA   TRP  31           HA       TRP  31  10.483  -0.953   0.498
  227   1HB   TRP  31          2HB       TRP  31  10.373  -0.334  -2.458
  228   2HB   TRP  31          1HB       TRP  31   8.950  -0.555  -1.444
  229    HD1  TRP  31           HD       TRP  31  10.705   2.181  -2.838
  230    HE1  TRP  31           1HE      TRP  31  10.514   4.321  -1.402
  231    HE3  TRP  31           3HE      TRP  31   9.229   0.056   1.493
  232    HZ2  TRP  31           2HZ      TRP  31   9.862   4.970   1.250
  233    HZ3  TRP  31           3HZ      TRP  31   8.862   1.476   3.460
  234    HH2  TRP  31           HH       TRP  31   9.177   3.887   3.335
  235    H    ASP  32           H        ASP  32  12.006  -2.588  -2.198
  236    HA   ASP  32           HA       ASP  32  10.123  -4.725  -2.294
  237   1HB   ASP  32          2HB       ASP  32  11.384  -4.173  -4.265
  238   2HB   ASP  32          1HB       ASP  32  12.910  -4.421  -3.412
  239    H    ALA  33           H        ALA  33  13.270  -4.194  -0.744
  240    HA   ALA  33           HA       ALA  33  13.423  -6.821   0.298
  241   1HB   ALA  33          1HB       ALA  33  14.786  -4.323   1.276
  242   2HB   ALA  33          2HB       ALA  33  15.402  -5.415   0.038
  243   3HB   ALA  33          3HB       ALA  33  15.221  -5.978   1.698
  244    H    ILE  34           H        ILE  34  12.044  -3.793   1.464
  245    HA   ILE  34           HA       ILE  34  11.355  -4.695   4.069
  246    HB   ILE  34           HB       ILE  34  10.145  -2.557   2.325
  247   1HG1  ILE  34          2HG1      ILE  34  11.942  -2.429   4.759
  248   2HG1  ILE  34          1HG1      ILE  34  12.439  -2.135   3.096
  249   1HG2  ILE  34          1HG2      ILE  34   9.527  -3.184   5.211
  250   2HG2  ILE  34          2HG2      ILE  34   8.422  -3.328   3.844
  251   3HG2  ILE  34          3HG2      ILE  34   8.995  -1.739   4.349
  252   1HD1  ILE  34          1HD1      ILE  34  12.168  -0.058   4.311
  253   2HD1  ILE  34          2HD1      ILE  34  10.496  -0.472   4.685
  254   3HD1  ILE  34          3HD1      ILE  34  10.978  -0.178   3.015
  255    H    ALA  35           H        ALA  35   9.521  -4.575   1.030
  256    HA   ALA  35           HA       ALA  35   7.166  -5.754   2.015
  257   1HB   ALA  35          1HB       ALA  35   6.605  -6.185  -0.297
  258   2HB   ALA  35          2HB       ALA  35   8.277  -5.899  -0.780
  259   3HB   ALA  35          3HB       ALA  35   7.305  -4.574  -0.133
  260    H    GLY  36           H        GLY  36  10.151  -7.091   0.776
  261   1HA   GLY  36          2HA       GLY  36   9.251  -9.814   0.747
  262   2HA   GLY  36          1HA       GLY  36  10.925  -9.271   0.691
  263    H    CYS  37           H        CYS  37  10.052  -7.647   3.182
  264    HA   CYS  37           HA       CYS  37  11.078  -9.605   5.039
  265   1HB   CYS  37          2HB       CYS  37  12.087  -7.406   5.003
  266   2HB   CYS  37          1HB       CYS  37  10.526  -6.647   5.279
  267    H    GLU  38           H        GLU  38   8.346  -7.281   5.136
  268    HA   GLU  38           HA       GLU  38   7.248  -8.820   7.348
  269   1HB   GLU  38          2HB       GLU  38   6.557  -6.115   6.227
  270   2HB   GLU  38          1HB       GLU  38   5.545  -6.923   7.418
  271   1HG   GLU  38          2HG       GLU  38   7.522  -7.063   8.910
  272   2HG   GLU  38          1HG       GLU  38   8.418  -6.102   7.740
  273    H    ALA  39           H        ALA  39   6.610  -8.182   3.999
  274    HA   ALA  39           HA       ALA  39   3.948  -9.294   4.239
  275   1HB   ALA  39          1HB       ALA  39   4.193  -7.317   2.857
  276   2HB   ALA  39          2HB       ALA  39   3.656  -8.695   1.891
  277   3HB   ALA  39          3HB       ALA  39   5.341  -8.174   1.826
  278    H    GLY  40           H        GLY  40   7.047 -10.379   3.697
  279   1HA   GLY  40          2HA       GLY  40   7.825 -12.495   3.167
  280   2HA   GLY  40          1HA       GLY  40   6.153 -13.000   2.913
  281    H    GLY  41           H        GLY  41   7.063 -10.136   1.416
  282   1HA   GLY  41          2HA       GLY  41   7.455  -9.531  -0.729
  283   2HA   GLY  41          1HA       GLY  41   7.954 -11.183  -1.085
  284    H    ASN  42           H        ASN  42   4.901  -9.672  -0.024
  285    HA   ASN  42           HA       ASN  42   3.617 -10.639  -2.448
  286   1HB   ASN  42          2HB       ASN  42   3.297 -12.345  -0.607
  287   2HB   ASN  42          1HB       ASN  42   2.438 -11.097   0.292
  288   1HD2  ASN  42          1HD2      ASN  42   2.129 -11.335  -3.191
  289   2HD2  ASN  42          2HD2      ASN  42   0.509 -11.932  -3.181
  290    H    TRP  43           H        TRP  43   3.111  -8.736  -3.251
  291    HA   TRP  43           HA       TRP  43   2.496  -6.503  -1.521
  292   1HB   TRP  43          2HB       TRP  43   2.639  -6.695  -4.532
  293   2HB   TRP  43          1HB       TRP  43   2.494  -5.208  -3.608
  294    HD1  TRP  43           HD       TRP  43   4.982  -8.191  -3.773
  295    HE1  TRP  43           1HE      TRP  43   7.373  -7.244  -3.564
  296    HE3  TRP  43           3HE      TRP  43   3.843  -3.252  -3.160
  297    HZ2  TRP  43           2HZ      TRP  43   8.611  -4.711  -3.192
  298    HZ3  TRP  43           3HZ      TRP  43   5.672  -1.631  -2.895
  299    HH2  TRP  43           HH       TRP  43   8.006  -2.352  -2.921
  300    H    ALA  44           H        ALA  44   0.804  -8.928  -3.046
  301    HA   ALA  44           HA       ALA  44  -1.653  -7.329  -3.279
  302   1HB   ALA  44          1HB       ALA  44  -0.984  -8.558  -5.295
  303   2HB   ALA  44          2HB       ALA  44  -2.533  -9.123  -4.670
  304   3HB   ALA  44          3HB       ALA  44  -1.072 -10.073  -4.396
  305    H    ILE  45           H        ILE  45  -0.253  -8.844  -0.896
  306    HA   ILE  45           HA       ILE  45  -2.209 -10.709  -0.043
  307    HB   ILE  45           HB       ILE  45   0.354 -10.405   0.624
  308   1HG1  ILE  45          2HG1      ILE  45  -1.754 -11.392   2.552
  309   2HG1  ILE  45          1HG1      ILE  45  -1.109 -12.299   1.187
  310   1HG2  ILE  45          1HG2      ILE  45   0.597  -9.495   2.877
  311   2HG2  ILE  45          2HG2      ILE  45  -1.092  -8.987   2.855
  312   3HG2  ILE  45          3HG2      ILE  45   0.061  -8.263   1.736
  313   1HD1  ILE  45          1HD1      ILE  45   1.124 -12.217   2.213
  314   2HD1  ILE  45          2HD1      ILE  45  -0.064 -13.019   3.243
  315   3HD1  ILE  45          3HD1      ILE  45   0.436 -11.365   3.595
  316    H    ASN  46           H        ASN  46  -3.802 -10.436   1.498
  317    HA   ASN  46           HA       ASN  46  -4.288  -7.755   2.564
  318   1HB   ASN  46          2HB       ASN  46  -5.524  -8.022   0.363
  319   2HB   ASN  46          1HB       ASN  46  -6.455  -9.308   1.124
  320   1HD2  ASN  46          1HD2      ASN  46  -5.914  -5.923   0.880
  321   2HD2  ASN  46          2HD2      ASN  46  -7.238  -5.428   1.872
  322    H    THR  47           H        THR  47  -3.736  -8.669   4.549
  323    HA   THR  47           HA       THR  47  -5.069 -10.973   5.552
  324    HB   THR  47           HB       THR  47  -4.084 -10.207   7.768
  325    HG1  THR  47           1HG      THR  47  -2.525  -8.497   7.567
  326   1HG2  THR  47          1HG2      THR  47  -1.782 -10.737   7.125
  327   2HG2  THR  47          2HG2      THR  47  -2.186 -10.473   5.431
  328   3HG2  THR  47          3HG2      THR  47  -2.923 -11.807   6.315
  329    H    GLY  48           H        GLY  48  -5.744  -7.606   5.442
  330   1HA   GLY  48          2HA       GLY  48  -7.839  -6.626   5.867
  331   2HA   GLY  48          1HA       GLY  48  -8.266  -8.024   6.852
  332    H    ASN  49           H        ASN  49  -5.172  -6.635   7.264
  333    HA   ASN  49           HA       ASN  49  -5.674  -6.218  10.050
  334   1HB   ASN  49          2HB       ASN  49  -3.538  -7.081   9.068
  335   2HB   ASN  49          1HB       ASN  49  -3.239  -5.473   8.426
  336   1HD2  ASN  49          1HD2      ASN  49  -1.353  -5.208   9.562
  337   2HD2  ASN  49          2HD2      ASN  49  -1.323  -4.966  11.283
  338    H    GLY  50           H        GLY  50  -6.289  -4.333   7.414
  339   1HA   GLY  50          2HA       GLY  50  -7.114  -2.117   7.423
  340   2HA   GLY  50          1HA       GLY  50  -6.234  -1.827   8.925
  341    H    TYR  51           H        TYR  51  -4.045  -3.428   7.547
  342    HA   TYR  51           HA       TYR  51  -2.978  -1.330   5.810
  343   1HB   TYR  51          2HB       TYR  51  -1.250  -3.417   7.142
  344   2HB   TYR  51          1HB       TYR  51  -0.775  -1.888   6.446
  345    HD1  TYR  51           1HD      TYR  51   0.372  -2.533   8.924
  346    HD2  TYR  51           2HD      TYR  51  -3.462  -0.828   8.198
  347    HE1  TYR  51           1HE      TYR  51   0.421  -1.504  11.156
  348    HE2  TYR  51           2HE      TYR  51  -3.418   0.205  10.439
  349    HH   TYR  51           HH       TYR  51  -0.564   0.268  12.389
  350    H    TYR  52           H        TYR  52  -1.543  -2.331   4.077
  351    HA   TYR  52           HA       TYR  52  -2.964  -4.731   3.159
  352   1HB   TYR  52          2HB       TYR  52  -2.332  -2.271   1.530
  353   2HB   TYR  52          1HB       TYR  52  -3.106  -3.732   0.916
  354    HD1  TYR  52           1HD      TYR  52  -3.499  -0.913   3.278
  355    HD2  TYR  52           2HD      TYR  52  -5.441  -4.071   1.203
  356    HE1  TYR  52           1HE      TYR  52  -5.662  -0.023   3.979
  357    HE2  TYR  52           2HE      TYR  52  -7.630  -3.192   1.905
  358    HH   TYR  52           HH       TYR  52  -8.507  -1.776   3.823
  359    H    GLY  53           H        GLY  53  -1.886  -5.638   1.114
  360   1HA   GLY  53          2HA       GLY  53   0.524  -6.708   2.009
  361   2HA   GLY  53          1HA       GLY  53  -0.127  -6.891   0.389
  362    H    GLY  54           H        GLY  54   2.486  -6.877   0.593
  363   1HA   GLY  54          2HA       GLY  54   4.184  -5.865  -0.645
  364   2HA   GLY  54          1HA       GLY  54   3.207  -4.406  -0.754
  365    H    VAL  55           H        VAL  55   3.668  -2.743   0.547
  366    HA   VAL  55           HA       VAL  55   5.977  -3.058   2.285
  367    HB   VAL  55           HB       VAL  55   4.508  -0.467   2.045
  368   1HG1  VAL  55          1HG1      VAL  55   7.452  -1.091   2.099
  369   2HG1  VAL  55          2HG1      VAL  55   6.475  -0.764   3.528
  370   3HG1  VAL  55          3HG1      VAL  55   6.684   0.486   2.303
  371   1HG2  VAL  55          1HG2      VAL  55   5.746   0.057  -0.017
  372   2HG2  VAL  55          2HG2      VAL  55   4.603  -1.266  -0.249
  373   3HG2  VAL  55          3HG2      VAL  55   6.325  -1.608  -0.079
  374    H    GLN  56           H        GLN  56   2.768  -3.501   2.624
  375    HA   GLN  56           HA       GLN  56   1.457  -3.977   4.403
  376   1HB   GLN  56          2HB       GLN  56   4.167  -4.111   5.709
  377   2HB   GLN  56          1HB       GLN  56   2.687  -4.488   6.579
  378   1HG   GLN  56          2HG       GLN  56   3.622  -5.870   4.077
  379   2HG   GLN  56          1HG       GLN  56   3.832  -6.479   5.718
  380   1HE2  GLN  56          1HE2      GLN  56   2.406  -7.645   3.476
  381   2HE2  GLN  56          2HE2      GLN  56   0.781  -7.873   4.008
  382    H    PHE  57           H        PHE  57   1.470  -1.229   3.857
  383    HA   PHE  57           HA       PHE  57   1.253  -0.265   6.610
  384   1HB   PHE  57          2HB       PHE  57   1.698   2.023   5.874
  385   2HB   PHE  57          1HB       PHE  57   3.038   0.927   5.624
  386    HD1  PHE  57           1HD      PHE  57   2.968  -0.154   3.084
  387    HD2  PHE  57           2HD      PHE  57   1.390   3.610   4.299
  388    HE1  PHE  57           1HE      PHE  57   3.254   0.704   0.799
  389    HE2  PHE  57           2HE      PHE  57   1.657   4.459   2.012
  390    HZ   PHE  57           HZ       PHE  57   2.604   3.015   0.258
  391    H    ASP  58           H        ASP  58  -0.244   1.712   6.760
  392    HA   ASP  58           HA       ASP  58  -2.709   0.321   6.438
  393   1HB   ASP  58          2HB       ASP  58  -3.658   2.079   7.842
  394   2HB   ASP  58          1HB       ASP  58  -2.182   1.415   8.534
  395    H    GLN  59           H        GLN  59  -4.717   1.408   5.929
  396    HA   GLN  59           HA       GLN  59  -4.844   2.304   3.311
  397   1HB   GLN  59          2HB       GLN  59  -6.680   1.245   4.572
  398   2HB   GLN  59          1HB       GLN  59  -6.797   2.668   5.583
  399   1HG   GLN  59          2HG       GLN  59  -8.520   2.827   4.003
  400   2HG   GLN  59          1HG       GLN  59  -7.284   3.986   3.529
  401   1HE2  GLN  59          1HE2      GLN  59  -5.991   3.526   1.689
  402   2HE2  GLN  59          2HE2      GLN  59  -6.525   2.401   0.479
  403    H    GLY  60           H        GLY  60  -4.752   4.045   6.371
  404   1HA   GLY  60          2HA       GLY  60  -5.656   6.540   5.336
  405   2HA   GLY  60          1HA       GLY  60  -4.910   6.277   6.904
  406    H    THR  61           H        THR  61  -2.451   5.389   6.321
  407    HA   THR  61           HA       THR  61  -1.038   7.696   5.604
  408    HB   THR  61           HB       THR  61  -0.120   4.852   5.687
  409    HG1  THR  61           1HG      THR  61  -0.403   5.110   7.746
  410   1HG2  THR  61          1HG2      THR  61   2.134   5.795   6.058
  411   2HG2  THR  61          2HG2      THR  61   1.481   7.408   5.765
  412   3HG2  THR  61          3HG2      THR  61   1.487   6.208   4.471
  413    H    TRP  62           H        TRP  62  -1.766   4.764   3.820
  414    HA   TRP  62           HA       TRP  62  -0.465   5.266   1.419
  415   1HB   TRP  62          2HB       TRP  62  -1.533   3.140   1.982
  416   2HB   TRP  62          1HB       TRP  62  -3.105   3.929   2.023
  417    HD1  TRP  62           HD       TRP  62  -4.319   4.373  -0.258
  418    HE1  TRP  62           1HE      TRP  62  -3.947   3.478  -2.644
  419    HE3  TRP  62           3HE      TRP  62   0.352   2.442   0.360
  420    HZ2  TRP  62           2HZ      TRP  62  -1.905   2.113  -4.089
  421    HZ3  TRP  62           3HZ      TRP  62   1.461   1.359  -1.541
  422    HH2  TRP  62           HH       TRP  62   0.364   1.197  -3.726
  423    H    GLU  63           H        GLU  63  -3.722   6.038   2.475
  424    HA   GLU  63           HA       GLU  63  -4.599   7.337   0.142
  425   1HB   GLU  63          2HB       GLU  63  -6.140   6.439   1.722
  426   2HB   GLU  63          1HB       GLU  63  -5.467   7.403   3.025
  427   1HG   GLU  63          2HG       GLU  63  -6.281   9.431   1.772
  428   2HG   GLU  63          1HG       GLU  63  -7.167   8.315   0.728
  429    H    ALA  64           H        ALA  64  -3.022   8.475   3.077
  430    HA   ALA  64           HA       ALA  64  -3.562  11.235   2.693
  431   1HB   ALA  64          1HB       ALA  64  -3.009  10.320   4.883
  432   2HB   ALA  64          2HB       ALA  64  -1.903  11.619   4.439
  433   3HB   ALA  64          3HB       ALA  64  -1.380   9.941   4.322
  434    H    ASN  65           H        ASN  65  -0.715   9.226   1.924
  435    HA   ASN  65           HA       ASN  65   0.675  11.417   0.713
  436   1HB   ASN  65          2HB       ASN  65   1.142   8.429   0.644
  437   2HB   ASN  65          1HB       ASN  65   2.232   9.615  -0.067
  438   1HD2  ASN  65          1HD2      ASN  65   0.579  10.366   2.900
  439   2HD2  ASN  65          2HD2      ASN  65   1.958  10.214   3.936
  440    H    GLY  66           H        GLY  66  -1.888   9.448  -0.180
  441   1HA   GLY  66          2HA       GLY  66  -3.232   9.907  -2.044
  442   2HA   GLY  66          1HA       GLY  66  -1.851  10.668  -2.830
  443    H    GLY  67           H        GLY  67  -2.355   7.427  -1.431
  444   1HA   GLY  67          2HA       GLY  67  -0.910   6.262  -3.647
  445   2HA   GLY  67          1HA       GLY  67  -1.564   5.414  -2.253
  446    H    LEU  68           H        LEU  68  -4.095   7.057  -3.018
  447    HA   LEU  68           HA       LEU  68  -5.460   4.783  -3.909
  448   1HB   LEU  68          2HB       LEU  68  -6.421   7.605  -3.993
  449   2HB   LEU  68          1HB       LEU  68  -7.397   6.161  -3.806
  450    HG   LEU  68           HG       LEU  68  -5.433   7.185  -1.747
  451   1HD1  LEU  68          1HD1      LEU  68  -8.441   7.382  -1.835
  452   2HD1  LEU  68          2HD1      LEU  68  -7.305   8.718  -2.017
  453   3HD1  LEU  68          3HD1      LEU  68  -7.415   7.859  -0.481
  454   1HD2  LEU  68          1HD2      LEU  68  -6.555   5.588  -0.262
  455   2HD2  LEU  68          2HD2      LEU  68  -5.721   4.806  -1.605
  456   3HD2  LEU  68          3HD2      LEU  68  -7.476   4.980  -1.639
  457    H    ARG  69           H        ARG  69  -4.154   7.574  -5.539
  458    HA   ARG  69           HA       ARG  69  -5.431   7.268  -8.032
  459   1HB   ARG  69          2HB       ARG  69  -3.497   8.557  -8.921
  460   2HB   ARG  69          1HB       ARG  69  -4.241   9.302  -7.513
  461   1HG   ARG  69          2HG       ARG  69  -2.488   8.587  -6.096
  462   2HG   ARG  69          1HG       ARG  69  -1.819   7.541  -7.347
  463   1HD   ARG  69          2HD       ARG  69  -1.992  10.547  -7.544
  464   2HD   ARG  69          1HD       ARG  69  -0.559   9.667  -7.014
  465    HE   ARG  69           HE       ARG  69  -1.572   8.840  -9.586
  466   1HH1  ARG  69          1HH1      ARG  69   0.566  11.023  -7.879
  467   2HH1  ARG  69          2HH1      ARG  69   1.552  11.353  -9.276
  468   1HH2  ARG  69          1HH2      ARG  69  -0.300   9.274 -11.427
  469   2HH2  ARG  69          2HH2      ARG  69   1.078  10.332 -11.298
  470    H    TYR  70           H        TYR  70  -2.703   5.720  -6.521
  471    HA   TYR  70           HA       TYR  70  -1.727   4.389  -8.885
  472   1HB   TYR  70          2HB       TYR  70  -1.330   3.911  -5.922
  473   2HB   TYR  70          1HB       TYR  70  -0.359   3.164  -7.197
  474    HD1  TYR  70           1HD      TYR  70  -1.016   6.129  -5.245
  475    HD2  TYR  70           2HD      TYR  70   1.286   4.532  -8.437
  476    HE1  TYR  70           1HE      TYR  70   0.512   8.045  -5.091
  477    HE2  TYR  70           2HE      TYR  70   2.832   6.442  -8.295
  478    HH   TYR  70           HH       TYR  70   2.697   8.732  -5.683
  479    H    ALA  71           H        ALA  71  -3.795   3.947  -6.222
  480    HA   ALA  71           HA       ALA  71  -5.635   2.184  -7.115
  481   1HB   ALA  71          1HB       ALA  71  -4.976  -0.004  -6.221
  482   2HB   ALA  71          2HB       ALA  71  -3.401   0.643  -5.768
  483   3HB   ALA  71          3HB       ALA  71  -3.843   0.511  -7.472
  484    HA   PRO  72           HA       PRO  72  -6.921   3.956  -3.244
  485   1HB   PRO  72          2HB       PRO  72  -8.972   1.894  -3.314
  486   2HB   PRO  72          1HB       PRO  72  -9.118   3.640  -3.210
  487   1HG   PRO  72          2HG       PRO  72  -9.640   2.199  -5.468
  488   2HG   PRO  72          1HG       PRO  72  -9.174   3.906  -5.458
  489   1HD   PRO  72          2HD       PRO  72  -7.642   1.562  -6.310
  490   2HD   PRO  72          1HD       PRO  72  -7.367   3.284  -6.647
  491    H    ARG  73           H        ARG  73  -5.824   0.800  -3.668
  492    HA   ARG  73           HA       ARG  73  -5.257   0.651  -0.820
  493   1HB   ARG  73          2HB       ARG  73  -6.028  -1.644  -0.596
  494   2HB   ARG  73          1HB       ARG  73  -7.366  -0.668  -1.192
  495   1HG   ARG  73          2HG       ARG  73  -6.499  -1.414  -3.522
  496   2HG   ARG  73          1HG       ARG  73  -5.726  -2.709  -2.606
  497   1HD   ARG  73          2HD       ARG  73  -8.669  -2.063  -2.483
  498   2HD   ARG  73          1HD       ARG  73  -7.964  -3.266  -3.561
  499    HE   ARG  73           HE       ARG  73  -7.089  -4.228  -1.301
  500   1HH1  ARG  73          1HH1      ARG  73 -10.177  -2.667  -1.827
  501   2HH1  ARG  73          2HH1      ARG  73 -11.054  -3.731  -0.772
  502   1HH2  ARG  73          1HH2      ARG  73  -8.240  -5.664   0.072
  503   2HH2  ARG  73          2HH2      ARG  73  -9.950  -5.458   0.309
  504    H    ALA  74           H        ALA  74  -3.337  -0.379  -0.414
  505    HA   ALA  74           HA       ALA  74  -1.380  -0.322  -2.365
  506   1HB   ALA  74          1HB       ALA  74   0.124  -1.040  -0.757
  507   2HB   ALA  74          2HB       ALA  74  -1.078  -2.005   0.085
  508   3HB   ALA  74          3HB       ALA  74  -1.137  -0.245   0.185
  509    H    ASP  75           H        ASP  75  -3.424  -3.012  -1.386
  510    HA   ASP  75           HA       ASP  75  -1.650  -4.948  -2.564
  511   1HB   ASP  75          2HB       ASP  75  -3.180  -6.631  -1.874
  512   2HB   ASP  75          1HB       ASP  75  -3.048  -5.474  -0.557
  513    H    LEU  76           H        LEU  76  -4.012  -2.893  -3.731
  514    HA   LEU  76           HA       LEU  76  -4.668  -4.533  -6.038
  515   1HB   LEU  76          2HB       LEU  76  -6.352  -3.004  -5.112
  516   2HB   LEU  76          1HB       LEU  76  -5.283  -1.645  -5.393
  517    HG   LEU  76           HG       LEU  76  -5.422  -2.079  -7.833
  518   1HD1  LEU  76          1HD1      LEU  76  -5.949  -4.436  -7.793
  519   2HD1  LEU  76          2HD1      LEU  76  -7.212  -3.549  -8.650
  520   3HD1  LEU  76          3HD1      LEU  76  -7.489  -4.103  -6.998
  521   1HD2  LEU  76          1HD2      LEU  76  -8.070  -1.674  -6.451
  522   2HD2  LEU  76          2HD2      LEU  76  -7.672  -1.200  -8.105
  523   3HD2  LEU  76          3HD2      LEU  76  -6.856  -0.427  -6.744
  524    H    ALA  77           H        ALA  77  -2.599  -1.914  -5.077
  525    HA   ALA  77           HA       ALA  77  -1.503  -1.462  -7.690
  526   1HB   ALA  77          1HB       ALA  77   0.008   0.063  -6.498
  527   2HB   ALA  77          2HB       ALA  77  -0.634  -0.513  -4.959
  528   3HB   ALA  77          3HB       ALA  77  -1.679   0.360  -6.080
  529    H    THR  78           H        THR  78   0.812  -1.730  -8.095
  530    HA   THR  78           HA       THR  78   1.774  -4.236  -6.930
  531    HB   THR  78           HB       THR  78   3.100  -4.570  -8.880
  532    HG1  THR  78           1HG      THR  78   2.639  -1.817  -9.303
  533   1HG2  THR  78          1HG2      THR  78   0.401  -3.435  -9.601
  534   2HG2  THR  78          2HG2      THR  78   0.771  -5.110  -9.187
  535   3HG2  THR  78          3HG2      THR  78   1.390  -4.416 -10.686
  536    H    ARG  79           H        ARG  79   4.446  -4.060  -7.452
  537    HA   ARG  79           HA       ARG  79   5.500  -2.964  -5.177
  538   1HB   ARG  79          2HB       ARG  79   6.885  -3.274  -7.844
  539   2HB   ARG  79          1HB       ARG  79   7.692  -3.043  -6.305
  540   1HG   ARG  79          2HG       ARG  79   6.697  -5.193  -5.538
  541   2HG   ARG  79          1HG       ARG  79   6.092  -5.429  -7.182
  542   1HD   ARG  79          2HD       ARG  79   8.269  -6.562  -6.719
  543   2HD   ARG  79          1HD       ARG  79   8.309  -5.429  -8.074
  544    HE   ARG  79           HE       ARG  79   9.301  -4.734  -5.377
  545   1HH1  ARG  79          1HH1      ARG  79   9.664  -4.806  -8.853
  546   2HH1  ARG  79          2HH1      ARG  79  11.114  -3.850  -8.856
  547   1HH2  ARG  79          1HH2      ARG  79  11.221  -3.467  -5.377
  548   2HH2  ARG  79          2HH2      ARG  79  12.007  -3.112  -6.881
  549    H    GLU  80           H        GLU  80   5.505  -1.580  -8.410
  550    HA   GLU  80           HA       GLU  80   7.069   0.637  -7.779
  551   1HB   GLU  80          2HB       GLU  80   6.144   1.521  -9.998
  552   2HB   GLU  80          1HB       GLU  80   7.057   0.020 -10.005
  553   1HG   GLU  80          2HG       GLU  80   4.573  -0.963  -9.740
  554   2HG   GLU  80          1HG       GLU  80   4.225   0.521 -10.622
  555    H    GLU  81           H        GLU  81   3.474   0.424  -7.985
  556    HA   GLU  81           HA       GLU  81   3.024   3.120  -7.350
  557   1HB   GLU  81          2HB       GLU  81   1.340   0.726  -6.630
  558   2HB   GLU  81          1HB       GLU  81   0.811   2.399  -6.590
  559   1HG   GLU  81          2HG       GLU  81  -0.030   1.810  -8.578
  560   2HG   GLU  81          1HG       GLU  81   1.563   2.312  -9.123
  561    H    GLN  82           H        GLN  82   3.216   0.274  -5.206
  562    HA   GLN  82           HA       GLN  82   2.681   1.683  -2.820
  563   1HB   GLN  82          2HB       GLN  82   4.343  -0.812  -3.148
  564   2HB   GLN  82          1HB       GLN  82   3.647  -0.227  -1.645
  565   1HG   GLN  82          2HG       GLN  82   1.395  -0.454  -2.858
  566   2HG   GLN  82          1HG       GLN  82   2.291  -1.460  -4.000
  567   1HE2  GLN  82          1HE2      GLN  82   1.324  -3.376  -3.463
  568   2HE2  GLN  82          2HE2      GLN  82   1.510  -4.130  -1.911
  569    H    ILE  83           H        ILE  83   5.624   0.964  -4.544
  570    HA   ILE  83           HA       ILE  83   7.515   1.886  -2.718
  571    HB   ILE  83           HB       ILE  83   7.442   1.689  -5.714
  572   1HG1  ILE  83          2HG1      ILE  83   9.305   0.365  -3.753
  573   2HG1  ILE  83          1HG1      ILE  83   7.732  -0.312  -4.154
  574   1HG2  ILE  83          1HG2      ILE  83   9.893   2.244  -5.679
  575   2HG2  ILE  83          2HG2      ILE  83   9.637   2.885  -4.057
  576   3HG2  ILE  83          3HG2      ILE  83   8.796   3.597  -5.429
  577   1HD1  ILE  83          1HD1      ILE  83   9.967   0.227  -6.096
  578   2HD1  ILE  83          2HD1      ILE  83   8.401  -0.481  -6.489
  579   3HD1  ILE  83          3HD1      ILE  83   9.521  -1.347  -5.439
  580    H    ALA  84           H        ALA  84   5.672   3.578  -5.200
  581    HA   ALA  84           HA       ALA  84   6.897   6.103  -4.865
  582   1HB   ALA  84          1HB       ALA  84   5.038   6.962  -6.179
  583   2HB   ALA  84          2HB       ALA  84   4.169   5.442  -5.963
  584   3HB   ALA  84          3HB       ALA  84   5.672   5.474  -6.884
  585    H    VAL  85           H        VAL  85   3.895   4.716  -3.576
  586    HA   VAL  85           HA       VAL  85   3.074   7.023  -2.159
  587    HB   VAL  85           HB       VAL  85   2.453   4.151  -1.514
  588   1HG1  VAL  85          1HG1      VAL  85   0.911   6.686  -0.938
  589   2HG1  VAL  85          2HG1      VAL  85   1.794   5.718   0.242
  590   3HG1  VAL  85          3HG1      VAL  85   0.375   5.048  -0.564
  591   1HG2  VAL  85          1HG2      VAL  85   1.988   4.577  -3.845
  592   2HG2  VAL  85          2HG2      VAL  85   1.074   6.025  -3.426
  593   3HG2  VAL  85          3HG2      VAL  85   0.478   4.436  -2.946
  594    H    ALA  86           H        ALA  86   4.695   4.043  -0.997
  595    HA   ALA  86           HA       ALA  86   4.986   4.866   1.658
  596   1HB   ALA  86          1HB       ALA  86   6.663   2.915   0.080
  597   2HB   ALA  86          2HB       ALA  86   5.187   2.531   0.968
  598   3HB   ALA  86          3HB       ALA  86   6.628   3.061   1.837
  599    H    GLU  87           H        GLU  87   6.832   5.493  -1.225
  600    HA   GLU  87           HA       GLU  87   9.168   6.332   0.192
  601   1HB   GLU  87          2HB       GLU  87  10.184   6.805  -1.825
  602   2HB   GLU  87          1HB       GLU  87   9.049   5.538  -2.251
  603   1HG   GLU  87          2HG       GLU  87   8.751   6.939  -3.979
  604   2HG   GLU  87          1HG       GLU  87   7.515   7.556  -2.887
  605    H    VAL  88           H        VAL  88   6.256   8.011  -0.906
  606    HA   VAL  88           HA       VAL  88   7.111  10.616  -0.230
  607    HB   VAL  88           HB       VAL  88   4.292   9.512   0.168
  608   1HG1  VAL  88          1HG1      VAL  88   3.625  11.867  -0.001
  609   2HG1  VAL  88          2HG1      VAL  88   5.318  12.344  -0.127
  610   3HG1  VAL  88          3HG1      VAL  88   4.721  11.600   1.359
  611   1HG2  VAL  88          1HG2      VAL  88   5.059   9.209  -2.149
  612   2HG2  VAL  88          2HG2      VAL  88   5.494  10.918  -2.231
  613   3HG2  VAL  88          3HG2      VAL  88   3.805  10.445  -2.038
  614    H    THR  89           H        THR  89   5.731   7.984   1.639
  615    HA   THR  89           HA       THR  89   5.482   9.368   4.077
  616    HB   THR  89           HB       THR  89   6.016   6.429   4.041
  617    HG1  THR  89           1HG      THR  89   3.959   7.774   2.656
  618   1HG2  THR  89          1HG2      THR  89   4.186   6.415   5.631
  619   2HG2  THR  89          2HG2      THR  89   3.877   8.123   5.322
  620   3HG2  THR  89          3HG2      THR  89   5.378   7.627   6.096
  621    H    ARG  90           H        ARG  90   8.056   7.349   2.715
  622    HA   ARG  90           HA       ARG  90   9.697   7.348   5.034
  623   1HB   ARG  90          2HB       ARG  90  11.309   6.259   3.732
  624   2HB   ARG  90          1HB       ARG  90   9.796   5.789   2.975
  625   1HG   ARG  90          2HG       ARG  90  11.056   6.281   1.128
  626   2HG   ARG  90          1HG       ARG  90  10.294   7.845   1.422
  627   1HD   ARG  90          2HD       ARG  90  12.256   8.730   2.384
  628   2HD   ARG  90          1HD       ARG  90  12.997   7.137   2.528
  629    HE   ARG  90           HE       ARG  90  12.561   7.518  -0.166
  630   1HH1  ARG  90          1HH1      ARG  90  14.317   9.194   2.351
  631   2HH1  ARG  90          2HH1      ARG  90  15.604   9.698   1.294
  632   1HH2  ARG  90          1HH2      ARG  90  14.243   8.158  -1.563
  633   2HH2  ARG  90          2HH2      ARG  90  15.543   9.144  -0.944
  634    H    LEU  91           H        LEU  91   9.228   9.447   2.372
  635    HA   LEU  91           HA       LEU  91  11.612  10.885   2.310
  636   1HB   LEU  91          2HB       LEU  91   9.591  10.846   0.715
  637   2HB   LEU  91          1HB       LEU  91   8.878  12.036   1.779
  638    HG   LEU  91           HG       LEU  91   9.927  12.942  -0.285
  639   1HD1  LEU  91          1HD1      LEU  91  11.089  13.910   2.320
  640   2HD1  LEU  91          2HD1      LEU  91   9.548  14.396   1.613
  641   3HD1  LEU  91          3HD1      LEU  91  11.059  14.821   0.809
  642   1HD2  LEU  91          1HD2      LEU  91  11.819  11.434  -0.417
  643   2HD2  LEU  91          2HD2      LEU  91  12.473  12.097   1.081
  644   3HD2  LEU  91          3HD2      LEU  91  12.373  13.110  -0.360
  645    H    ARG  92           H        ARG  92   8.842  11.085   4.384
  646    HA   ARG  92           HA       ARG  92   9.589  13.718   5.392
  647   1HB   ARG  92          2HB       ARG  92   7.280  12.009   6.251
  648   2HB   ARG  92          1HB       ARG  92   7.420  13.766   6.332
  649   1HG   ARG  92          2HG       ARG  92   6.963  14.042   4.095
  650   2HG   ARG  92          1HG       ARG  92   7.512  12.416   3.679
  651   1HD   ARG  92          2HD       ARG  92   4.887  13.329   4.724
  652   2HD   ARG  92          1HD       ARG  92   5.268  12.125   3.487
  653    HE   ARG  92           HE       ARG  92   6.210  11.019   5.759
  654   1HH1  ARG  92          1HH1      ARG  92   3.072  12.238   4.769
  655   2HH1  ARG  92          2HH1      ARG  92   2.196  11.255   5.911
  656   1HH2  ARG  92          1HH2      ARG  92   5.061   9.749   7.265
  657   2HH2  ARG  92          2HH2      ARG  92   3.327   9.840   7.332
  658    H    GLN  93           H        GLN  93   9.257  10.398   6.319
  659    HA   GLN  93           HA       GLN  93   9.716  10.988   9.127
  660   1HB   GLN  93          2HB       GLN  93   8.805   8.866   9.521
  661   2HB   GLN  93          1HB       GLN  93   7.939   9.485   8.105
  662   1HG   GLN  93          2HG       GLN  93   9.380   8.207   6.636
  663   2HG   GLN  93          1HG       GLN  93  10.252   7.567   8.028
  664   1HE2  GLN  93          1HE2      GLN  93   7.355   7.535   6.211
  665   2HE2  GLN  93          2HE2      GLN  93   6.665   6.117   6.926
  666    H    GLY  94           H        GLY  94  11.356   9.314   6.474
  667   1HA   GLY  94          2HA       GLY  94  13.676   8.965   6.334
  668   2HA   GLY  94          1HA       GLY  94  13.816   9.338   8.044
  669    H    TRP  95           H        TRP  95  11.523   7.010   6.782
  670    HA   TRP  95           HA       TRP  95  11.303   4.773   6.905
  671   1HB   TRP  95          2HB       TRP  95  14.267   4.535   7.434
  672   2HB   TRP  95          1HB       TRP  95  13.191   3.328   6.733
  673    HD1  TRP  95           HD       TRP  95  14.840   6.679   5.836
  674    HE1  TRP  95           1HE      TRP  95  15.115   6.800   3.297
  675    HE3  TRP  95           3HE      TRP  95  12.372   2.396   4.585
  676    HZ2  TRP  95           2HZ      TRP  95  14.368   5.272   1.036
  677    HZ3  TRP  95           3HZ      TRP  95  12.190   1.797   2.210
  678    HH2  TRP  95           HH       TRP  95  13.167   3.205   0.472
  679    H    GLY  96           H        GLY  96  11.610   6.678   9.268
  680   1HA   GLY  96          2HA       GLY  96  12.515   5.249  11.502
  681   2HA   GLY  96          1HA       GLY  96  11.384   6.591  11.542
  682    H    ALA  97           H        ALA  97   9.256   5.410  10.074
  683    HA   ALA  97           HA       ALA  97   8.132   3.842  12.207
  684   1HB   ALA  97          1HB       ALA  97   6.773   5.527  11.074
  685   2HB   ALA  97          2HB       ALA  97   6.052   3.922  10.946
  686   3HB   ALA  97          3HB       ALA  97   6.901   4.619   9.567
  687    H    TRP  98           H        TRP  98   9.590   3.172   9.108
  688    HA   TRP  98           HA       TRP  98   8.755   0.387   9.208
  689   1HB   TRP  98          2HB       TRP  98  10.665   1.921   7.438
  690   2HB   TRP  98          1HB       TRP  98  10.498   0.173   7.345
  691    HD1  TRP  98           HD       TRP  98   8.042  -0.759   6.575
  692    HE1  TRP  98           1HE      TRP  98   6.323   0.268   4.952
  693    HE3  TRP  98           3HE      TRP  98   9.712   4.102   6.582
  694    HZ2  TRP  98           2HZ      TRP  98   5.751   2.806   3.805
  695    HZ3  TRP  98           3HZ      TRP  98   8.525   5.725   5.217
  696    HH2  TRP  98           HH       TRP  98   6.593   5.110   3.861
  697    HA   PRO  99           HA       PRO  99  11.943   0.106  12.264
  698   1HB   PRO  99          2HB       PRO  99  10.791  -2.488  12.968
  699   2HB   PRO  99          1HB       PRO  99  10.901  -1.009  13.915
  700   1HG   PRO  99          2HG       PRO  99   8.559  -1.853  12.940
  701   2HG   PRO  99          1HG       PRO  99   8.986  -0.131  13.031
  702   1HD   PRO  99          2HD       PRO  99   9.162  -1.967  10.652
  703   2HD   PRO  99          1HD       PRO  99   8.404  -0.356  10.766
  704    H    VAL 100           H        VAL 100  11.524  -3.342  11.746
  705    HA   VAL 100           HA       VAL 100  14.364  -3.600  11.776
  706    HB   VAL 100           HB       VAL 100  12.297  -5.747  11.266
  707   1HG1  VAL 100          1HG1      VAL 100  15.132  -5.935  12.281
  708   2HG1  VAL 100          2HG1      VAL 100  14.578  -6.406  10.675
  709   3HG1  VAL 100          3HG1      VAL 100  14.009  -7.281  12.096
  710   1HG2  VAL 100          1HG2      VAL 100  12.454  -6.221  13.674
  711   2HG2  VAL 100          2HG2      VAL 100  11.802  -4.612  13.355
  712   3HG2  VAL 100          3HG2      VAL 100  13.478  -4.800  13.876
  713    H    CYS 101           H        CYS 101  11.898  -3.493   9.391
  714    HA   CYS 101           HA       CYS 101  13.401  -5.056   7.478
  715   1HB   CYS 101          2HB       CYS 101  10.781  -3.589   7.127
  716   2HB   CYS 101          1HB       CYS 101  11.479  -4.757   6.003
  717    H    ALA 102           H        ALA 102  12.899  -1.684   8.182
  718    HA   ALA 102           HA       ALA 102  13.808  -0.699   5.668
  719   1HB   ALA 102          1HB       ALA 102  14.070   1.439   6.795
  720   2HB   ALA 102          2HB       ALA 102  13.890   0.650   8.364
  721   3HB   ALA 102          3HB       ALA 102  12.534   0.692   7.238
  722    H    ALA 103           H        ALA 103  15.383  -1.311   8.787
  723    HA   ALA 103           HA       ALA 103  17.978  -0.541   8.045
  724   1HB   ALA 103          1HB       ALA 103  18.726  -1.845   9.961
  725   2HB   ALA 103          2HB       ALA 103  17.155  -2.643  10.047
  726   3HB   ALA 103          3HB       ALA 103  17.284  -0.913  10.371
  727    H    ARG 104           H        ARG 104  16.272  -3.598   7.804
  728    HA   ARG 104           HA       ARG 104  18.397  -5.157   6.800
  729   1HB   ARG 104          2HB       ARG 104  15.409  -5.400   6.695
  730   2HB   ARG 104          1HB       ARG 104  16.449  -6.563   5.879
  731   1HG   ARG 104          2HG       ARG 104  17.450  -7.225   7.938
  732   2HG   ARG 104          1HG       ARG 104  16.652  -5.913   8.808
  733   1HD   ARG 104          2HD       ARG 104  15.620  -8.195   9.071
  734   2HD   ARG 104          1HD       ARG 104  14.525  -6.911   8.553
  735    HE   ARG 104           HE       ARG 104  14.966  -7.822   6.224
  736   1HH1  ARG 104          1HH1      ARG 104  15.184  -9.847   9.082
  737   2HH1  ARG 104          2HH1      ARG 104  14.610 -11.277   8.265
  738   1HH2  ARG 104          1HH2      ARG 104  14.229  -9.699   5.155
  739   2HH2  ARG 104          2HH2      ARG 104  14.076 -11.190   6.031
  740    H    ALA 105           H        ALA 105  16.014  -3.110   5.240
  741    HA   ALA 105           HA       ALA 105  16.652  -4.062   2.588
  742   1HB   ALA 105          1HB       ALA 105  14.956  -2.477   1.875
  743   2HB   ALA 105          2HB       ALA 105  14.869  -1.832   3.512
  744   3HB   ALA 105          3HB       ALA 105  14.381  -3.495   3.193
  745    H    GLY 106           H        GLY 106  17.675  -1.469   4.642
  746   1HA   GLY 106          2HA       GLY 106  19.746  -0.328   4.099
  747   2HA   GLY 106          1HA       GLY 106  19.271  -0.381   2.408
  748    H    ALA 107           H        ALA 107  17.969   0.821   5.488
  749    HA   ALA 107           HA       ALA 107  16.285   2.760   4.372
  750   1HB   ALA 107          1HB       ALA 107  16.036   3.606   6.625
  751   2HB   ALA 107          2HB       ALA 107  17.458   2.702   7.146
  752   3HB   ALA 107          3HB       ALA 107  16.007   1.843   6.632
  753    H    ARG 108           H        ARG 108  16.436   5.030   4.391
  754    HA   ARG 108           HA       ARG 108  19.177   6.060   4.252
  755   1HB   ARG 108          2HB       ARG 108  17.035   6.443   2.150
  756   2HB   ARG 108          1HB       ARG 108  18.654   7.126   2.109
  757   1HG   ARG 108          2HG       ARG 108  19.644   4.984   1.836
  758   2HG   ARG 108          1HG       ARG 108  18.114   4.165   2.172
  759   1HD   ARG 108          2HD       ARG 108  17.171   4.914   0.120
  760   2HD   ARG 108          1HD       ARG 108  18.508   6.035  -0.161
  761    HE   ARG 108           HE       ARG 108  19.670   3.548  -0.001
  762   1HH1  ARG 108          1HH1      ARG 108  17.155   4.963  -2.013
  763   2HH1  ARG 108          2HH1      ARG 108  17.611   4.034  -3.413
  764   1HH2  ARG 108          1HH2      ARG 108  20.241   2.355  -1.841
  765   2HH2  ARG 108          2HH2      ARG 108  19.352   2.560  -3.324
  Start of MODEL   22
    1   1H    ASN   1          1HT       ASN   1 -18.113 -22.306  17.236
    2   2H    ASN   1          2HT       ASN   1 -18.716 -22.054  15.672
    3   3H    ASN   1          3HT       ASN   1 -17.392 -21.149  16.232
    4    HA   ASN   1           HA       ASN   1 -17.407 -24.078  15.795
    5   1HB   ASN   1          2HB       ASN   1 -16.133 -21.821  14.232
    6   2HB   ASN   1          1HB       ASN   1 -15.758 -23.521  13.990
    7   1HD2  ASN   1          1HD2      ASN   1 -18.569 -24.328  14.420
    8   2HD2  ASN   1          2HD2      ASN   1 -19.407 -23.869  12.973
    9    H    VAL   2           H        VAL   2 -15.992 -25.081  17.035
   10    HA   VAL   2           HA       VAL   2 -14.038 -23.590  18.556
   11    HB   VAL   2           HB       VAL   2 -14.483 -26.580  18.429
   12   1HG1  VAL   2          1HG1      VAL   2 -12.273 -26.004  19.270
   13   2HG1  VAL   2          2HG1      VAL   2 -13.288 -26.620  20.573
   14   3HG1  VAL   2          3HG1      VAL   2 -12.991 -24.888  20.430
   15   1HG2  VAL   2          1HG2      VAL   2 -15.715 -26.277  20.533
   16   2HG2  VAL   2          2HG2      VAL   2 -16.481 -25.428  19.191
   17   3HG2  VAL   2          3HG2      VAL   2 -15.532 -24.531  20.375
   18    H    VAL   3           H        VAL   3 -13.892 -26.291  16.234
   19    HA   VAL   3           HA       VAL   3 -11.080 -25.818  15.874
   20    HB   VAL   3           HB       VAL   3 -12.806 -27.992  14.694
   21   1HG1  VAL   3          1HG1      VAL   3  -9.801 -27.719  14.779
   22   2HG1  VAL   3          2HG1      VAL   3 -10.817 -27.546  13.347
   23   3HG1  VAL   3          3HG1      VAL   3 -10.697 -29.108  14.159
   24   1HG2  VAL   3          1HG2      VAL   3 -10.923 -28.061  17.051
   25   2HG2  VAL   3          2HG2      VAL   3 -11.763 -29.451  16.364
   26   3HG2  VAL   3          3HG2      VAL   3 -12.683 -28.152  17.123
   27    H    VAL   4           H        VAL   4 -10.604 -24.245  14.558
   28    HA   VAL   4           HA       VAL   4 -10.427 -22.861  12.815
   29    HB   VAL   4           HB       VAL   4  -9.625 -25.140  12.050
   30   1HG1  VAL   4          1HG1      VAL   4 -10.745 -26.103  10.113
   31   2HG1  VAL   4          2HG1      VAL   4 -12.050 -24.929  10.288
   32   3HG1  VAL   4          3HG1      VAL   4 -11.774 -26.135  11.547
   33   1HG2  VAL   4          1HG2      VAL   4  -8.983 -24.297   9.901
   34   2HG2  VAL   4          2HG2      VAL   4  -8.979 -22.975  11.067
   35   3HG2  VAL   4          3HG2      VAL   4 -10.306 -23.134   9.920
   36    H    THR   5           H        THR   5 -11.272 -21.949  10.887
   37    HA   THR   5           HA       THR   5 -14.191 -21.777  10.886
   38    HB   THR   5           HB       THR   5 -13.616 -19.666   9.456
   39    HG1  THR   5           1HG      THR   5 -11.571 -19.060   9.444
   40   1HG2  THR   5          1HG2      THR   5 -14.606 -19.550  11.678
   41   2HG2  THR   5          2HG2      THR   5 -13.359 -18.315  11.499
   42   3HG2  THR   5          3HG2      THR   5 -13.019 -19.785  12.414
   43    HA   PRO   6           HA       PRO   6 -14.035 -24.063   7.056
   44   1HB   PRO   6          2HB       PRO   6 -16.822 -23.204   6.720
   45   2HB   PRO   6          1HB       PRO   6 -16.168 -24.832   6.918
   46   1HG   PRO   6          2HG       PRO   6 -17.584 -23.650   8.856
   47   2HG   PRO   6          1HG       PRO   6 -16.209 -24.710   9.225
   48   1HD   PRO   6          2HD       PRO   6 -16.313 -21.714   9.141
   49   2HD   PRO   6          1HD       PRO   6 -15.577 -22.773  10.364
   50    H    ALA   7           H        ALA   7 -14.822 -23.760   4.854
   51    HA   ALA   7           HA       ALA   7 -14.590 -22.734   2.850
   52   1HB   ALA   7          1HB       ALA   7 -15.558 -20.292   4.306
   53   2HB   ALA   7          2HB       ALA   7 -16.585 -21.547   3.614
   54   3HB   ALA   7          3HB       ALA   7 -15.567 -20.558   2.563
   55    H    HIS   8           H        HIS   8 -12.365 -23.134   3.232
   56    HA   HIS   8           HA       HIS   8 -10.760 -20.683   3.283
   57   1HB   HIS   8          2HB       HIS   8 -10.095 -22.615   4.762
   58   2HB   HIS   8          1HB       HIS   8  -9.838 -23.559   3.301
   59    HD1  HIS   8           1HD      HIS   8  -7.318 -23.839   3.318
   60    HD2  HIS   8           2HD      HIS   8  -8.515 -19.901   3.929
   61    HE1  HIS   8           1HE      HIS   8  -5.212 -22.438   3.280
   62    H    GLU   9           H        GLU   9 -12.553 -22.301   1.315
   63    HA   GLU   9           HA       GLU   9 -11.245 -23.165  -0.915
   64   1HB   GLU   9          2HB       GLU   9 -13.230 -22.420  -2.210
   65   2HB   GLU   9          1HB       GLU   9 -13.627 -23.320  -0.753
   66   1HG   GLU   9          2HG       GLU   9 -14.154 -21.252   0.403
   67   2HG   GLU   9          1HG       GLU   9 -13.706 -20.325  -1.029
   68    H    ALA  10           H        ALA  10 -10.595 -22.292  -2.860
   69    HA   ALA  10           HA       ALA  10  -9.671 -19.527  -2.640
   70   1HB   ALA  10          1HB       ALA  10  -7.851 -21.167  -2.640
   71   2HB   ALA  10          2HB       ALA  10  -7.802 -20.160  -4.087
   72   3HB   ALA  10          3HB       ALA  10  -8.428 -21.806  -4.178
   73    H    VAL  11           H        VAL  11 -11.906 -19.260  -3.384
   74    HA   VAL  11           HA       VAL  11 -12.623 -19.648  -6.075
   75    HB   VAL  11           HB       VAL  11 -14.249 -19.078  -4.321
   76   1HG1  VAL  11          1HG1      VAL  11 -12.995 -16.339  -4.386
   77   2HG1  VAL  11          2HG1      VAL  11 -12.936 -17.487  -3.048
   78   3HG1  VAL  11          3HG1      VAL  11 -14.476 -16.772  -3.529
   79   1HG2  VAL  11          1HG2      VAL  11 -15.568 -17.442  -5.611
   80   2HG2  VAL  11          2HG2      VAL  11 -14.879 -18.709  -6.624
   81   3HG2  VAL  11          3HG2      VAL  11 -14.147 -17.106  -6.597
   82    H    VAL  12           H        VAL  12 -10.674 -17.326  -4.426
   83    HA   VAL  12           HA       VAL  12  -9.548 -15.491  -5.023
   84    HB   VAL  12           HB       VAL  12  -8.003 -17.208  -5.359
   85   1HG1  VAL  12          1HG1      VAL  12  -8.988 -17.500  -8.185
   86   2HG1  VAL  12          2HG1      VAL  12  -9.291 -18.627  -6.863
   87   3HG1  VAL  12          3HG1      VAL  12  -7.645 -18.381  -7.453
   88   1HG2  VAL  12          1HG2      VAL  12  -7.262 -14.996  -6.003
   89   2HG2  VAL  12          2HG2      VAL  12  -7.834 -15.263  -7.648
   90   3HG2  VAL  12          3HG2      VAL  12  -6.491 -16.214  -7.016
   91    H    ARG  13           H        ARG  13 -10.952 -14.002  -5.588
   92    HA   ARG  13           HA       ARG  13 -11.748 -13.476  -8.248
   93   1HB   ARG  13          2HB       ARG  13 -11.562 -11.720  -5.800
   94   2HB   ARG  13          1HB       ARG  13 -12.248 -11.219  -7.330
   95   1HG   ARG  13          2HG       ARG  13 -13.941 -12.978  -7.149
   96   2HG   ARG  13          1HG       ARG  13 -13.264 -13.444  -5.586
   97   1HD   ARG  13          2HD       ARG  13 -14.465 -10.768  -6.286
   98   2HD   ARG  13          1HD       ARG  13 -15.218 -12.019  -5.298
   99    HE   ARG  13           HE       ARG  13 -13.393 -11.655  -3.680
  100   1HH1  ARG  13          1HH1      ARG  13 -14.043  -9.175  -6.065
  101   2HH1  ARG  13          2HH1      ARG  13 -13.443  -7.880  -5.072
  102   1HH2  ARG  13          1HH2      ARG  13 -12.537  -9.971  -2.392
  103   2HH2  ARG  13          2HH2      ARG  13 -12.548  -8.338  -2.992
  104    H    VAL  14           H        VAL  14 -10.436 -12.992  -9.730
  105    HA   VAL  14           HA       VAL  14  -7.782 -12.936  -9.734
  106    HB   VAL  14           HB       VAL  14  -8.845 -13.080 -11.800
  107   1HG1  VAL  14          1HG1      VAL  14 -10.087 -11.245 -12.861
  108   2HG1  VAL  14          2HG1      VAL  14  -9.865 -10.268 -11.408
  109   3HG1  VAL  14          3HG1      VAL  14 -10.830 -11.743 -11.340
  110   1HG2  VAL  14          1HG2      VAL  14  -7.319 -10.485 -11.754
  111   2HG2  VAL  14          2HG2      VAL  14  -7.676 -11.438 -13.195
  112   3HG2  VAL  14          3HG2      VAL  14  -6.636 -12.102 -11.935
  113    H    GLY  15           H        GLY  15  -6.311 -11.861  -8.888
  114   1HA   GLY  15          2HA       GLY  15  -6.288  -8.989  -8.951
  115   2HA   GLY  15          1HA       GLY  15  -6.103  -9.757  -7.383
  116    H    THR  16           H        THR  16  -4.888 -10.064 -10.646
  117    HA   THR  16           HA       THR  16  -2.287 -10.871  -9.642
  118    HB   THR  16           HB       THR  16  -3.469 -10.983 -12.416
  119    HG1  THR  16           1HG      THR  16  -3.548 -13.276 -11.913
  120   1HG2  THR  16          1HG2      THR  16  -1.040 -10.843 -12.449
  121   2HG2  THR  16          2HG2      THR  16  -1.590 -12.443 -12.950
  122   3HG2  THR  16          3HG2      THR  16  -0.939 -12.200 -11.329
  123    H    LYS  17           H        LYS  17  -3.932  -8.304 -11.085
  124    HA   LYS  17           HA       LYS  17  -3.396  -6.315 -12.021
  125   1HB   LYS  17          2HB       LYS  17  -1.216  -6.744 -10.025
  126   2HB   LYS  17          1HB       LYS  17  -1.370  -5.231 -10.906
  127   1HG   LYS  17          2HG       LYS  17  -2.503  -4.710  -9.004
  128   2HG   LYS  17          1HG       LYS  17  -3.832  -5.364  -9.962
  129   1HD   LYS  17          2HD       LYS  17  -3.902  -6.276  -7.715
  130   2HD   LYS  17          1HD       LYS  17  -3.512  -7.552  -8.870
  131   1HE   LYS  17          2HE       LYS  17  -2.099  -7.755  -6.917
  132   2HE   LYS  17          1HE       LYS  17  -1.127  -7.295  -8.313
  133   1HZ   LYS  17          1HZ       LYS  17  -1.457  -4.923  -7.456
  134   2HZ   LYS  17          2HZ       LYS  17  -0.372  -5.918  -6.624
  135   3HZ   LYS  17          3HZ       LYS  17  -1.923  -5.645  -5.994
  136    HA   PRO  18           HA       PRO  18  -0.824  -8.070 -15.462
  137   1HB   PRO  18          2HB       PRO  18  -2.286  -5.633 -16.435
  138   2HB   PRO  18          1HB       PRO  18  -1.870  -7.116 -17.312
  139   1HG   PRO  18          2HG       PRO  18  -4.299  -6.877 -16.369
  140   2HG   PRO  18          1HG       PRO  18  -3.413  -8.396 -16.112
  141   1HD   PRO  18          2HD       PRO  18  -3.963  -6.186 -14.174
  142   2HD   PRO  18          1HD       PRO  18  -3.941  -7.940 -13.906
  143    H    GLY  19           H        GLY  19   1.114  -7.662 -15.204
  144   1HA   GLY  19          2HA       GLY  19   2.691  -5.643 -15.916
  145   2HA   GLY  19          1HA       GLY  19   2.133  -5.100 -14.336
  146    H    THR  20           H        THR  20   3.179  -8.127 -15.796
  147    HA   THR  20           HA       THR  20   4.009  -9.376 -13.471
  148    HB   THR  20           HB       THR  20   5.240  -9.893 -16.166
  149    HG1  THR  20           1HG      THR  20   2.829 -11.133 -15.449
  150   1HG2  THR  20          1HG2      THR  20   5.123 -12.226 -15.410
  151   2HG2  THR  20          2HG2      THR  20   4.408 -11.692 -13.890
  152   3HG2  THR  20          3HG2      THR  20   6.059 -11.228 -14.298
  153    H    GLU  21           H        GLU  21   5.892  -7.412 -15.751
  154    HA   GLU  21           HA       GLU  21   8.057  -7.441 -13.790
  155   1HB   GLU  21          2HB       GLU  21   8.212  -7.258 -16.771
  156   2HB   GLU  21          1HB       GLU  21   9.534  -6.774 -15.720
  157   1HG   GLU  21          2HG       GLU  21   9.615  -9.014 -14.772
  158   2HG   GLU  21          1HG       GLU  21   8.294  -9.509 -15.828
  159    H    VAL  22           H        VAL  22   7.031  -5.779 -12.747
  160    HA   VAL  22           HA       VAL  22   6.791  -3.171 -13.881
  161    HB   VAL  22           HB       VAL  22   5.370  -3.726 -12.029
  162   1HG1  VAL  22          1HG1      VAL  22   7.869  -4.221 -10.426
  163   2HG1  VAL  22          2HG1      VAL  22   6.728  -5.444 -10.987
  164   3HG1  VAL  22          3HG1      VAL  22   6.221  -4.242  -9.796
  165   1HG2  VAL  22          1HG2      VAL  22   7.483  -1.768 -11.154
  166   2HG2  VAL  22          2HG2      VAL  22   5.880  -1.926 -10.437
  167   3HG2  VAL  22          3HG2      VAL  22   6.048  -1.409 -12.115
  168    HA   PRO  23           HA       PRO  23  11.141  -2.267 -13.909
  169   1HB   PRO  23          2HB       PRO  23  10.150   0.530 -13.773
  170   2HB   PRO  23          1HB       PRO  23  11.266  -0.214 -14.922
  171   1HG   PRO  23          2HG       PRO  23   8.741   0.345 -15.597
  172   2HG   PRO  23          1HG       PRO  23   9.562  -1.105 -16.204
  173   1HD   PRO  23          2HD       PRO  23   7.488  -0.833 -14.097
  174   2HD   PRO  23          1HD       PRO  23   7.759  -2.151 -15.250
  175    HA   PRO  24           HA       PRO  24  11.870  -1.706  -9.550
  176   1HB   PRO  24          2HB       PRO  24  14.632  -1.420 -10.599
  177   2HB   PRO  24          1HB       PRO  24  14.032  -2.415  -9.265
  178   1HG   PRO  24          2HG       PRO  24  14.619  -3.503 -11.619
  179   2HG   PRO  24          1HG       PRO  24  13.221  -4.054 -10.677
  180   1HD   PRO  24          2HD       PRO  24  13.299  -2.305 -13.080
  181   2HD   PRO  24          1HD       PRO  24  12.112  -3.518 -12.601
  182    H    VAL  25           H        VAL  25  12.092   0.013  -8.319
  183    HA   VAL  25           HA       VAL  25  12.772   2.576  -9.534
  184    HB   VAL  25           HB       VAL  25  11.425   2.078  -6.871
  185   1HG1  VAL  25          1HG1      VAL  25  10.772   4.436  -7.027
  186   2HG1  VAL  25          2HG1      VAL  25  11.691   4.586  -8.524
  187   3HG1  VAL  25          3HG1      VAL  25  12.524   4.244  -7.008
  188   1HG2  VAL  25          1HG2      VAL  25  10.198   2.749  -9.540
  189   2HG2  VAL  25          2HG2      VAL  25   9.341   2.733  -7.998
  190   3HG2  VAL  25          3HG2      VAL  25  10.015   1.238  -8.648
  191    H    ILE  26           H        ILE  26  14.097   4.061  -8.166
  192    HA   ILE  26           HA       ILE  26  16.568   2.851  -7.811
  193    HB   ILE  26           HB       ILE  26  15.688   5.498  -6.661
  194   1HG1  ILE  26          2HG1      ILE  26  15.317   5.379  -9.073
  195   2HG1  ILE  26          1HG1      ILE  26  16.655   6.462  -8.710
  196   1HG2  ILE  26          1HG2      ILE  26  17.761   4.730  -5.648
  197   2HG2  ILE  26          2HG2      ILE  26  18.073   6.089  -6.730
  198   3HG2  ILE  26          3HG2      ILE  26  18.455   4.445  -7.244
  199   1HD1  ILE  26          1HD1      ILE  26  16.883   3.629  -9.701
  200   2HD1  ILE  26          2HD1      ILE  26  18.236   4.692  -9.314
  201   3HD1  ILE  26          3HD1      ILE  26  17.150   5.095 -10.645
  202    H    ASP  27           H        ASP  27  14.130   3.641  -5.436
  203    HA   ASP  27           HA       ASP  27  15.794   2.381  -3.372
  204   1HB   ASP  27          2HB       ASP  27  13.519   4.335  -3.005
  205   2HB   ASP  27          1HB       ASP  27  14.450   3.586  -1.713
  206    H    GLY  28           H        GLY  28  13.655   1.586  -5.461
  207   1HA   GLY  28          2HA       GLY  28  11.524   0.420  -3.982
  208   2HA   GLY  28          1HA       GLY  28  11.960   0.055  -5.648
  209    H    SER  29           H        SER  29  14.746  -0.266  -4.200
  210    HA   SER  29           HA       SER  29  14.613  -3.129  -3.926
  211   1HB   SER  29          2HB       SER  29  16.854  -1.294  -3.091
  212   2HB   SER  29          1HB       SER  29  16.965  -3.010  -3.477
  213    HG   SER  29           HG       SER  29  17.667  -1.568  -5.181
  214    H    ILE  30           H        ILE  30  14.959  -0.362  -1.858
  215    HA   ILE  30           HA       ILE  30  15.155  -1.742   0.616
  216    HB   ILE  30           HB       ILE  30  13.831   0.899   0.750
  217   1HG1  ILE  30          2HG1      ILE  30  15.221   1.305  -1.260
  218   2HG1  ILE  30          1HG1      ILE  30  15.809   2.212   0.126
  219   1HG2  ILE  30          1HG2      ILE  30  14.723  -0.193   2.692
  220   2HG2  ILE  30          2HG2      ILE  30  15.579   1.319   2.397
  221   3HG2  ILE  30          3HG2      ILE  30  16.333  -0.220   1.977
  222   1HD1  ILE  30          1HD1      ILE  30  16.992  -0.352  -0.912
  223   2HD1  ILE  30          2HD1      ILE  30  17.590   0.587   0.456
  224   3HD1  ILE  30          3HD1      ILE  30  17.637   1.269  -1.171
  225    H    TRP  31           H        TRP  31  12.606  -0.464  -1.363
  226    HA   TRP  31           HA       TRP  31  10.514  -0.876   0.507
  227   1HB   TRP  31          2HB       TRP  31  10.473  -0.380  -2.478
  228   2HB   TRP  31          1HB       TRP  31   9.026  -0.483  -1.480
  229    HD1  TRP  31           HD       TRP  31  10.930   2.128  -2.935
  230    HE1  TRP  31           1HE      TRP  31  10.865   4.315  -1.546
  231    HE3  TRP  31           3HE      TRP  31   9.315   0.202   1.458
  232    HZ2  TRP  31           2HZ      TRP  31  10.228   5.070   1.077
  233    HZ3  TRP  31           3HZ      TRP  31   9.014   1.696   3.385
  234    HH2  TRP  31           HH       TRP  31   9.466   4.087   3.196
  235    H    ASP  32           H        ASP  32  11.983  -2.796  -2.005
  236    HA   ASP  32           HA       ASP  32   9.931  -4.798  -1.986
  237   1HB   ASP  32          2HB       ASP  32  11.280  -4.393  -3.991
  238   2HB   ASP  32          1HB       ASP  32  12.734  -4.876  -3.117
  239    H    ALA  33           H        ALA  33  13.129  -4.377  -0.487
  240    HA   ALA  33           HA       ALA  33  13.149  -6.955   0.680
  241   1HB   ALA  33          1HB       ALA  33  15.200  -5.684   0.348
  242   2HB   ALA  33          2HB       ALA  33  14.994  -6.135   2.041
  243   3HB   ALA  33          3HB       ALA  33  14.651  -4.487   1.519
  244    H    ILE  34           H        ILE  34  11.959  -3.797   1.727
  245    HA   ILE  34           HA       ILE  34  11.192  -4.579   4.351
  246    HB   ILE  34           HB       ILE  34  10.070  -2.477   2.505
  247   1HG1  ILE  34          2HG1      ILE  34  11.798  -2.272   4.984
  248   2HG1  ILE  34          1HG1      ILE  34  12.380  -2.137   3.329
  249   1HG2  ILE  34          1HG2      ILE  34   9.405  -2.934   5.416
  250   2HG2  ILE  34          2HG2      ILE  34   8.316  -3.182   4.053
  251   3HG2  ILE  34          3HG2      ILE  34   8.881  -1.560   4.446
  252   1HD1  ILE  34          1HD1      ILE  34  10.432  -0.271   4.662
  253   2HD1  ILE  34          2HD1      ILE  34  11.044  -0.129   3.014
  254   3HD1  ILE  34          3HD1      ILE  34  12.144   0.041   4.383
  255    H    ALA  35           H        ALA  35   9.458  -4.537   1.260
  256    HA   ALA  35           HA       ALA  35   7.050  -5.668   2.095
  257   1HB   ALA  35          1HB       ALA  35   7.396  -4.720  -0.136
  258   2HB   ALA  35          2HB       ALA  35   6.753  -6.358  -0.218
  259   3HB   ALA  35          3HB       ALA  35   8.462  -6.065  -0.539
  260    H    GLY  36           H        GLY  36  10.117  -7.104   1.208
  261   1HA   GLY  36          2HA       GLY  36   9.219  -9.823   1.326
  262   2HA   GLY  36          1HA       GLY  36  10.892  -9.279   1.316
  263    H    CYS  37           H        CYS  37   9.842  -7.520   3.683
  264    HA   CYS  37           HA       CYS  37  10.736  -9.398   5.689
  265   1HB   CYS  37          2HB       CYS  37  11.738  -7.177   5.641
  266   2HB   CYS  37          1HB       CYS  37  10.156  -6.434   5.820
  267    H    GLU  38           H        GLU  38   8.008  -7.096   5.437
  268    HA   GLU  38           HA       GLU  38   6.721  -8.543   7.613
  269   1HB   GLU  38          2HB       GLU  38   6.011  -5.931   6.277
  270   2HB   GLU  38          1HB       GLU  38   5.072  -6.665   7.570
  271   1HG   GLU  38          2HG       GLU  38   7.210  -6.618   8.942
  272   2HG   GLU  38          1HG       GLU  38   7.862  -5.566   7.689
  273    H    ALA  39           H        ALA  39   6.362  -7.954   4.190
  274    HA   ALA  39           HA       ALA  39   3.704  -9.103   4.240
  275   1HB   ALA  39          1HB       ALA  39   5.211  -7.918   1.930
  276   2HB   ALA  39          2HB       ALA  39   4.026  -7.077   2.933
  277   3HB   ALA  39          3HB       ALA  39   3.522  -8.428   1.915
  278    H    GLY  40           H        GLY  40   6.829 -10.187   3.906
  279   1HA   GLY  40          2HA       GLY  40   7.576 -12.346   3.465
  280   2HA   GLY  40          1HA       GLY  40   5.941 -12.777   2.964
  281    H    GLY  41           H        GLY  41   6.860  -9.935   1.599
  282   1HA   GLY  41          2HA       GLY  41   7.703  -9.295  -0.408
  283   2HA   GLY  41          1HA       GLY  41   8.261 -10.942  -0.697
  284    H    ASN  42           H        ASN  42   5.040  -9.478  -0.150
  285    HA   ASN  42           HA       ASN  42   4.234 -10.242  -2.822
  286   1HB   ASN  42          2HB       ASN  42   3.626 -12.143  -1.235
  287   2HB   ASN  42          1HB       ASN  42   2.562 -10.989  -0.423
  288   1HD2  ASN  42          1HD2      ASN  42   1.979 -13.471  -1.971
  289   2HD2  ASN  42          2HD2      ASN  42   0.853 -12.968  -3.182
  290    H    TRP  43           H        TRP  43   3.015  -8.722  -3.654
  291    HA   TRP  43           HA       TRP  43   2.389  -6.446  -1.902
  292   1HB   TRP  43          2HB       TRP  43   2.721  -6.558  -4.895
  293   2HB   TRP  43          1HB       TRP  43   2.501  -5.099  -3.937
  294    HD1  TRP  43           HD       TRP  43   5.030  -8.050  -3.957
  295    HE1  TRP  43           1HE      TRP  43   7.389  -7.077  -3.661
  296    HE3  TRP  43           3HE      TRP  43   3.808  -3.114  -3.552
  297    HZ2  TRP  43           2HZ      TRP  43   8.582  -4.519  -3.312
  298    HZ3  TRP  43           3HZ      TRP  43   5.595  -1.463  -3.248
  299    HH2  TRP  43           HH       TRP  43   7.938  -2.150  -3.141
  300    H    ALA  44           H        ALA  44   0.929  -9.017  -3.206
  301    HA   ALA  44           HA       ALA  44  -1.626  -7.616  -3.655
  302   1HB   ALA  44          1HB       ALA  44  -0.796 -10.348  -4.627
  303   2HB   ALA  44          2HB       ALA  44  -0.836  -8.877  -5.598
  304   3HB   ALA  44          3HB       ALA  44  -2.334  -9.550  -4.954
  305    H    ILE  45           H        ILE  45   0.019  -9.328  -1.375
  306    HA   ILE  45           HA       ILE  45  -1.910 -11.063  -0.339
  307    HB   ILE  45           HB       ILE  45   0.572 -11.071   0.167
  308   1HG1  ILE  45          2HG1      ILE  45  -1.339 -11.056   2.507
  309   2HG1  ILE  45          1HG1      ILE  45  -1.005 -12.418   1.444
  310   1HG2  ILE  45          1HG2      ILE  45   1.350  -9.681   2.031
  311   2HG2  ILE  45          2HG2      ILE  45  -0.182  -8.806   1.998
  312   3HG2  ILE  45          3HG2      ILE  45   0.908  -8.731   0.613
  313   1HD1  ILE  45          1HD1      ILE  45   0.172 -12.654   3.554
  314   2HD1  ILE  45          2HD1      ILE  45   0.963 -11.098   3.299
  315   3HD1  ILE  45          3HD1      ILE  45   1.314 -12.451   2.225
  316    H    ASN  46           H        ASN  46  -3.407 -10.758   1.305
  317    HA   ASN  46           HA       ASN  46  -3.805  -8.064   2.382
  318   1HB   ASN  46          2HB       ASN  46  -5.188  -8.270   0.245
  319   2HB   ASN  46          1HB       ASN  46  -6.110  -9.529   1.063
  320   1HD2  ASN  46          1HD2      ASN  46  -5.533  -6.170   0.739
  321   2HD2  ASN  46          2HD2      ASN  46  -6.756  -5.622   1.839
  322    H    THR  47           H        THR  47  -3.230  -8.879   4.315
  323    HA   THR  47           HA       THR  47  -4.503 -11.129   5.469
  324    HB   THR  47           HB       THR  47  -3.500  -9.785   7.599
  325    HG1  THR  47           1HG      THR  47  -2.239  -8.203   6.950
  326   1HG2  THR  47          1HG2      THR  47  -1.424 -11.056   7.234
  327   2HG2  THR  47          2HG2      THR  47  -1.908 -11.357   5.564
  328   3HG2  THR  47          3HG2      THR  47  -2.850 -12.035   6.894
  329    H    GLY  48           H        GLY  48  -5.286  -7.803   5.129
  330   1HA   GLY  48          2HA       GLY  48  -7.398  -6.873   5.353
  331   2HA   GLY  48          1HA       GLY  48  -7.907  -8.308   6.234
  332    H    ASN  49           H        ASN  49  -4.989  -6.663   7.081
  333    HA   ASN  49           HA       ASN  49  -6.173  -6.286   9.718
  334   1HB   ASN  49          2HB       ASN  49  -3.900  -6.129  10.574
  335   2HB   ASN  49          1HB       ASN  49  -4.094  -7.567   9.579
  336   1HD2  ASN  49          1HD2      ASN  49  -2.537  -4.521   9.930
  337   2HD2  ASN  49          2HD2      ASN  49  -1.454  -4.685   8.591
  338    H    GLY  50           H        GLY  50  -6.337  -4.398   7.289
  339   1HA   GLY  50          2HA       GLY  50  -7.002  -2.137   7.413
  340   2HA   GLY  50          1HA       GLY  50  -6.035  -1.962   8.876
  341    H    TYR  51           H        TYR  51  -3.992  -3.595   7.265
  342    HA   TYR  51           HA       TYR  51  -2.985  -1.451   5.545
  343   1HB   TYR  51          2HB       TYR  51  -1.022  -3.405   6.669
  344   2HB   TYR  51          1HB       TYR  51  -0.792  -1.736   6.207
  345    HD1  TYR  51           1HD      TYR  51  -3.346  -1.045   8.171
  346    HD2  TYR  51           2HD      TYR  51   0.467  -2.896   8.548
  347    HE1  TYR  51           1HE      TYR  51  -3.261  -0.402  10.555
  348    HE2  TYR  51           2HE      TYR  51   0.553  -2.271  10.923
  349    HH   TYR  51           HH       TYR  51  -2.169  -1.110  12.618
  350    H    TYR  52           H        TYR  52  -1.539  -2.490   3.814
  351    HA   TYR  52           HA       TYR  52  -2.891  -4.983   3.056
  352   1HB   TYR  52          2HB       TYR  52  -2.436  -2.708   1.142
  353   2HB   TYR  52          1HB       TYR  52  -3.423  -4.145   0.899
  354    HD1  TYR  52           1HD      TYR  52  -3.327  -0.778   2.136
  355    HD2  TYR  52           2HD      TYR  52  -5.520  -4.411   2.305
  356    HE1  TYR  52           1HE      TYR  52  -5.262   0.447   3.025
  357    HE2  TYR  52           2HE      TYR  52  -7.475  -3.201   3.166
  358    HH   TYR  52           HH       TYR  52  -7.912  -1.072   4.427
  359    H    GLY  53           H        GLY  53  -1.881  -5.963   1.072
  360   1HA   GLY  53          2HA       GLY  53   0.670  -6.777   1.720
  361   2HA   GLY  53          1HA       GLY  53  -0.089  -7.025   0.159
  362    H    GLY  54           H        GLY  54   2.579  -6.762   0.345
  363   1HA   GLY  54          2HA       GLY  54   4.093  -5.600  -1.038
  364   2HA   GLY  54          1HA       GLY  54   3.045  -4.190  -0.974
  365    H    VAL  55           H        VAL  55   3.642  -2.581   0.301
  366    HA   VAL  55           HA       VAL  55   5.968  -2.961   2.008
  367    HB   VAL  55           HB       VAL  55   4.499  -0.358   1.783
  368   1HG1  VAL  55          1HG1      VAL  55   6.474  -0.707   3.288
  369   2HG1  VAL  55          2HG1      VAL  55   6.649   0.598   2.118
  370   3HG1  VAL  55          3HG1      VAL  55   7.448  -0.950   1.840
  371   1HG2  VAL  55          1HG2      VAL  55   5.774   0.171  -0.246
  372   2HG2  VAL  55          2HG2      VAL  55   4.643  -1.156  -0.511
  373   3HG2  VAL  55          3HG2      VAL  55   6.364  -1.490  -0.304
  374    H    GLN  56           H        GLN  56   2.748  -3.293   2.278
  375    HA   GLN  56           HA       GLN  56   1.253  -3.566   3.923
  376   1HB   GLN  56          2HB       GLN  56   2.982  -5.321   4.369
  377   2HB   GLN  56          1HB       GLN  56   3.634  -4.270   5.620
  378   1HG   GLN  56          2HG       GLN  56   1.700  -4.455   6.939
  379   2HG   GLN  56          1HG       GLN  56   0.758  -5.132   5.611
  380   1HE2  GLN  56          1HE2      GLN  56   2.877  -6.900   4.767
  381   2HE2  GLN  56          2HE2      GLN  56   2.946  -8.179   5.929
  382    H    PHE  57           H        PHE  57   1.655  -0.905   3.723
  383    HA   PHE  57           HA       PHE  57   1.458  -0.190   6.553
  384   1HB   PHE  57          2HB       PHE  57   1.875   2.158   5.935
  385   2HB   PHE  57          1HB       PHE  57   3.217   1.081   5.620
  386    HD1  PHE  57           1HD      PHE  57   1.457   3.786   4.416
  387    HD2  PHE  57           2HD      PHE  57   3.209   0.148   3.063
  388    HE1  PHE  57           1HE      PHE  57   1.716   4.744   2.167
  389    HE2  PHE  57           2HE      PHE  57   3.462   1.101   0.812
  390    HZ   PHE  57           HZ       PHE  57   2.732   3.413   0.363
  391    H    ASP  58           H        ASP  58  -0.107   1.644   6.985
  392    HA   ASP  58           HA       ASP  58  -2.540   0.270   6.462
  393   1HB   ASP  58          2HB       ASP  58  -3.549   1.835   8.054
  394   2HB   ASP  58          1HB       ASP  58  -2.054   1.149   8.679
  395    H    GLN  59           H        GLN  59  -4.515   1.182   5.860
  396    HA   GLN  59           HA       GLN  59  -4.600   2.382   3.379
  397   1HB   GLN  59          2HB       GLN  59  -6.402   1.050   4.246
  398   2HB   GLN  59          1HB       GLN  59  -6.620   2.139   5.601
  399   1HG   GLN  59          2HG       GLN  59  -8.383   2.615   4.188
  400   2HG   GLN  59          1HG       GLN  59  -7.225   3.902   3.895
  401   1HE2  GLN  59          1HE2      GLN  59  -5.494   2.236   2.205
  402   2HE2  GLN  59          2HE2      GLN  59  -6.335   2.045   0.702
  403    H    GLY  60           H        GLY  60  -4.662   3.782   6.565
  404   1HA   GLY  60          2HA       GLY  60  -5.705   6.326   5.838
  405   2HA   GLY  60          1HA       GLY  60  -4.888   5.931   7.345
  406    H    THR  61           H        THR  61  -2.436   5.229   6.640
  407    HA   THR  61           HA       THR  61  -1.113   7.619   5.965
  408    HB   THR  61           HB       THR  61  -0.073   4.818   5.908
  409    HG1  THR  61           1HG      THR  61  -0.468   4.945   7.978
  410   1HG2  THR  61          1HG2      THR  61   1.382   7.437   6.243
  411   2HG2  THR  61          2HG2      THR  61   1.426   6.413   4.808
  412   3HG2  THR  61          3HG2      THR  61   2.117   5.836   6.325
  413    H    TRP  62           H        TRP  62  -1.840   4.706   4.129
  414    HA   TRP  62           HA       TRP  62  -0.577   5.293   1.722
  415   1HB   TRP  62          2HB       TRP  62  -1.602   3.136   2.221
  416   2HB   TRP  62          1HB       TRP  62  -3.187   3.892   2.313
  417    HD1  TRP  62           HD       TRP  62  -4.448   4.388   0.071
  418    HE1  TRP  62           1HE      TRP  62  -4.090   3.588  -2.349
  419    HE3  TRP  62           3HE      TRP  62   0.283   2.553   0.540
  420    HZ2  TRP  62           2HZ      TRP  62  -2.046   2.300  -3.881
  421    HZ3  TRP  62           3HZ      TRP  62   1.378   1.561  -1.419
  422    HH2  TRP  62           HH       TRP  62   0.253   1.437  -3.583
  423    H    GLU  63           H        GLU  63  -3.831   6.046   2.861
  424    HA   GLU  63           HA       GLU  63  -4.613   7.475   0.560
  425   1HB   GLU  63          2HB       GLU  63  -6.273   6.520   1.990
  426   2HB   GLU  63          1HB       GLU  63  -5.683   7.410   3.383
  427   1HG   GLU  63          2HG       GLU  63  -6.465   9.476   2.474
  428   2HG   GLU  63          1HG       GLU  63  -6.869   8.706   0.937
  429    H    ALA  64           H        ALA  64  -3.000   8.364   3.529
  430    HA   ALA  64           HA       ALA  64  -3.408  11.159   3.399
  431   1HB   ALA  64          1HB       ALA  64  -2.690   9.997   5.439
  432   2HB   ALA  64          2HB       ALA  64  -1.606  11.323   5.021
  433   3HB   ALA  64          3HB       ALA  64  -1.131   9.657   4.688
  434    H    ASN  65           H        ASN  65  -0.788   9.069   2.220
  435    HA   ASN  65           HA       ASN  65   0.554  11.265   0.932
  436   1HB   ASN  65          2HB       ASN  65   0.980   8.311   0.444
  437   2HB   ASN  65          1HB       ASN  65   2.108   9.626   0.129
  438   1HD2  ASN  65          1HD2      ASN  65   1.465  10.960   2.685
  439   2HD2  ASN  65          2HD2      ASN  65   2.257  10.019   3.906
  440    H    GLY  66           H        GLY  66  -2.151   9.442   0.298
  441   1HA   GLY  66          2HA       GLY  66  -3.684   9.754  -1.397
  442   2HA   GLY  66          1HA       GLY  66  -2.486  10.708  -2.268
  443    H    GLY  67           H        GLY  67  -2.594   7.319  -1.136
  444   1HA   GLY  67          2HA       GLY  67  -1.223   6.473  -3.517
  445   2HA   GLY  67          1HA       GLY  67  -1.757   5.447  -2.191
  446    H    LEU  68           H        LEU  68  -4.474   6.861  -2.575
  447    HA   LEU  68           HA       LEU  68  -5.684   4.738  -3.857
  448   1HB   LEU  68          2HB       LEU  68  -6.677   7.482  -3.172
  449   2HB   LEU  68          1HB       LEU  68  -7.715   6.277  -3.909
  450    HG   LEU  68           HG       LEU  68  -7.040   4.788  -1.923
  451   1HD1  LEU  68          1HD1      LEU  68  -6.498   6.023   0.119
  452   2HD1  LEU  68          2HD1      LEU  68  -6.274   7.480  -0.850
  453   3HD1  LEU  68          3HD1      LEU  68  -5.216   6.090  -1.088
  454   1HD2  LEU  68          1HD2      LEU  68  -9.278   5.694  -2.235
  455   2HD2  LEU  68          2HD2      LEU  68  -8.775   7.211  -1.486
  456   3HD2  LEU  68          3HD2      LEU  68  -8.816   5.728  -0.533
  457    H    ARG  69           H        ARG  69  -4.257   7.548  -5.160
  458    HA   ARG  69           HA       ARG  69  -5.662   7.643  -7.624
  459   1HB   ARG  69          2HB       ARG  69  -3.854   9.093  -8.367
  460   2HB   ARG  69          1HB       ARG  69  -4.354   9.543  -6.742
  461   1HG   ARG  69          2HG       ARG  69  -2.463   8.159  -5.878
  462   2HG   ARG  69          1HG       ARG  69  -1.918   7.991  -7.544
  463   1HD   ARG  69          2HD       ARG  69  -2.320  10.636  -6.157
  464   2HD   ARG  69          1HD       ARG  69  -0.776   9.791  -6.256
  465    HE   ARG  69           HE       ARG  69  -2.094  10.342  -8.792
  466   1HH1  ARG  69          1HH1      ARG  69   0.281  11.325  -6.415
  467   2HH1  ARG  69          2HH1      ARG  69   1.146  12.355  -7.516
  468   1HH2  ARG  69          1HH2      ARG  69  -0.963  11.698 -10.242
  469   2HH2  ARG  69          2HH2      ARG  69   0.441  12.570  -9.694
  470    H    TYR  70           H        TYR  70  -2.929   5.886  -6.362
  471    HA   TYR  70           HA       TYR  70  -2.183   4.785  -8.942
  472   1HB   TYR  70          2HB       TYR  70  -1.330   3.969  -6.160
  473   2HB   TYR  70          1HB       TYR  70  -0.483   3.628  -7.665
  474    HD1  TYR  70           1HD      TYR  70  -0.937   5.869  -4.934
  475    HD2  TYR  70           2HD      TYR  70   0.599   5.574  -8.890
  476    HE1  TYR  70           1HE      TYR  70   0.411   7.879  -4.554
  477    HE2  TYR  70           2HE      TYR  70   1.959   7.590  -8.521
  478    HH   TYR  70           HH       TYR  70   2.451   8.933  -5.434
  479    H    ALA  71           H        ALA  71  -3.920   4.118  -6.050
  480    HA   ALA  71           HA       ALA  71  -5.699   2.228  -6.925
  481   1HB   ALA  71          1HB       ALA  71  -3.277   0.907  -5.680
  482   2HB   ALA  71          2HB       ALA  71  -3.796   0.726  -7.354
  483   3HB   ALA  71          3HB       ALA  71  -4.808   0.109  -6.046
  484    HA   PRO  72           HA       PRO  72  -6.953   3.854  -2.967
  485   1HB   PRO  72          2HB       PRO  72  -9.015   1.810  -3.091
  486   2HB   PRO  72          1HB       PRO  72  -9.156   3.555  -2.955
  487   1HG   PRO  72          2HG       PRO  72  -9.712   2.176  -5.238
  488   2HG   PRO  72          1HG       PRO  72  -9.190   3.866  -5.206
  489   1HD   PRO  72          2HD       PRO  72  -7.709   1.457  -6.020
  490   2HD   PRO  72          1HD       PRO  72  -7.446   3.157  -6.457
  491    H    ARG  73           H        ARG  73  -5.842   0.750  -3.581
  492    HA   ARG  73           HA       ARG  73  -5.345   0.345  -0.736
  493   1HB   ARG  73          2HB       ARG  73  -6.059  -1.973  -0.771
  494   2HB   ARG  73          1HB       ARG  73  -7.403  -0.963  -1.292
  495   1HG   ARG  73          2HG       ARG  73  -6.655  -1.450  -3.654
  496   2HG   ARG  73          1HG       ARG  73  -5.615  -2.694  -2.953
  497   1HD   ARG  73          2HD       ARG  73  -8.564  -2.600  -2.375
  498   2HD   ARG  73          1HD       ARG  73  -7.939  -3.379  -3.825
  499    HE   ARG  73           HE       ARG  73  -6.514  -4.422  -1.684
  500   1HH1  ARG  73          1HH1      ARG  73  -9.868  -4.301  -2.713
  501   2HH1  ARG  73          2HH1      ARG  73 -10.244  -5.892  -2.132
  502   1HH2  ARG  73          1HH2      ARG  73  -6.979  -6.517  -0.951
  503   2HH2  ARG  73          2HH2      ARG  73  -8.597  -7.151  -1.100
  504    H    ALA  74           H        ALA  74  -3.400  -0.514  -0.365
  505    HA   ALA  74           HA       ALA  74  -1.421  -0.227  -2.290
  506   1HB   ALA  74          1HB       ALA  74   0.121  -0.813  -0.643
  507   2HB   ALA  74          2HB       ALA  74  -1.019  -1.866   0.184
  508   3HB   ALA  74          3HB       ALA  74  -1.225  -0.117   0.261
  509    H    ASP  75           H        ASP  75  -3.314  -3.021  -1.431
  510    HA   ASP  75           HA       ASP  75  -1.428  -4.827  -2.651
  511   1HB   ASP  75          2HB       ASP  75  -3.074  -6.594  -2.100
  512   2HB   ASP  75          1HB       ASP  75  -2.533  -5.670  -0.709
  513    H    LEU  76           H        LEU  76  -3.932  -2.886  -3.708
  514    HA   LEU  76           HA       LEU  76  -4.416  -4.446  -6.111
  515   1HB   LEU  76          2HB       LEU  76  -6.184  -2.974  -5.221
  516   2HB   LEU  76          1HB       LEU  76  -5.135  -1.585  -5.433
  517    HG   LEU  76           HG       LEU  76  -5.138  -2.021  -7.890
  518   1HD1  LEU  76          1HD1      LEU  76  -6.840  -3.505  -8.813
  519   2HD1  LEU  76          2HD1      LEU  76  -7.277  -4.026  -7.187
  520   3HD1  LEU  76          3HD1      LEU  76  -5.678  -4.398  -7.832
  521   1HD2  LEU  76          1HD2      LEU  76  -7.411  -1.178  -8.258
  522   2HD2  LEU  76          2HD2      LEU  76  -6.603  -0.352  -6.928
  523   3HD2  LEU  76          3HD2      LEU  76  -7.821  -1.582  -6.592
  524    H    ALA  77           H        ALA  77  -2.472  -1.819  -4.941
  525    HA   ALA  77           HA       ALA  77  -1.295  -1.156  -7.449
  526   1HB   ALA  77          1HB       ALA  77  -0.470  -0.543  -4.613
  527   2HB   ALA  77          2HB       ALA  77  -1.488   0.462  -5.645
  528   3HB   ALA  77          3HB       ALA  77   0.207   0.203  -6.061
  529    H    THR  78           H        THR  78   0.859  -1.535  -8.053
  530    HA   THR  78           HA       THR  78   2.002  -4.003  -6.973
  531    HB   THR  78           HB       THR  78   3.215  -4.247  -9.005
  532    HG1  THR  78           1HG      THR  78   2.571  -1.515  -9.395
  533   1HG2  THR  78          1HG2      THR  78   1.416  -4.152 -10.709
  534   2HG2  THR  78          2HG2      THR  78   0.447  -3.195  -9.582
  535   3HG2  THR  78          3HG2      THR  78   0.881  -4.858  -9.182
  536    H    ARG  79           H        ARG  79   4.626  -3.686  -7.689
  537    HA   ARG  79           HA       ARG  79   5.733  -2.545  -5.456
  538   1HB   ARG  79          2HB       ARG  79   7.031  -2.840  -8.170
  539   2HB   ARG  79          1HB       ARG  79   7.888  -2.559  -6.664
  540   1HG   ARG  79          2HG       ARG  79   6.986  -4.707  -5.816
  541   2HG   ARG  79          1HG       ARG  79   6.295  -4.995  -7.414
  542   1HD   ARG  79          2HD       ARG  79   8.428  -6.134  -7.194
  543   2HD   ARG  79          1HD       ARG  79   8.532  -4.851  -8.398
  544    HE   ARG  79           HE       ARG  79   9.352  -3.953  -5.825
  545   1HH1  ARG  79          1HH1      ARG  79  10.423  -5.850  -8.571
  546   2HH1  ARG  79          2HH1      ARG  79  12.103  -5.484  -8.318
  547   1HH2  ARG  79          1HH2      ARG  79  11.580  -3.484  -5.492
  548   2HH2  ARG  79          2HH2      ARG  79  12.767  -4.149  -6.575
  549    H    GLU  80           H        GLU  80   5.458  -1.098  -8.675
  550    HA   GLU  80           HA       GLU  80   6.922   1.210  -8.063
  551   1HB   GLU  80          2HB       GLU  80   6.087   2.165 -10.124
  552   2HB   GLU  80          1HB       GLU  80   6.528   0.480 -10.358
  553   1HG   GLU  80          2HG       GLU  80   4.271  -0.196 -10.444
  554   2HG   GLU  80          1HG       GLU  80   3.708   1.375  -9.872
  555    H    GLU  81           H        GLU  81   3.326   0.786  -8.100
  556    HA   GLU  81           HA       GLU  81   2.737   3.423  -7.335
  557   1HB   GLU  81          2HB       GLU  81   1.227   0.941  -6.527
  558   2HB   GLU  81          1HB       GLU  81   0.609   2.583  -6.519
  559   1HG   GLU  81          2HG       GLU  81  -0.294   1.881  -8.439
  560   2HG   GLU  81          1HG       GLU  81   1.248   2.425  -9.090
  561    H    GLN  82           H        GLN  82   3.188   0.531  -5.339
  562    HA   GLN  82           HA       GLN  82   2.667   1.815  -2.891
  563   1HB   GLN  82          2HB       GLN  82   3.967  -0.761  -3.654
  564   2HB   GLN  82          1HB       GLN  82   4.052  -0.203  -1.985
  565   1HG   GLN  82          2HG       GLN  82   1.544   0.035  -2.083
  566   2HG   GLN  82          1HG       GLN  82   1.621  -0.858  -3.602
  567   1HE2  GLN  82          1HE2      GLN  82   1.895  -3.029  -3.562
  568   2HE2  GLN  82          2HE2      GLN  82   1.989  -3.950  -2.100
  569    H    ILE  83           H        ILE  83   5.655   1.248  -4.657
  570    HA   ILE  83           HA       ILE  83   7.434   2.286  -2.757
  571    HB   ILE  83           HB       ILE  83   7.519   2.191  -5.768
  572   1HG1  ILE  83          2HG1      ILE  83   9.388   0.883  -3.806
  573   2HG1  ILE  83          1HG1      ILE  83   7.845   0.147  -4.214
  574   1HG2  ILE  83          1HG2      ILE  83   9.842   2.963  -5.683
  575   2HG2  ILE  83          2HG2      ILE  83   9.672   3.270  -3.954
  576   3HG2  ILE  83          3HG2      ILE  83   8.724   4.204  -5.111
  577   1HD1  ILE  83          1HD1      ILE  83  10.048   0.816  -6.148
  578   2HD1  ILE  83          2HD1      ILE  83   8.502   0.071  -6.562
  579   3HD1  ILE  83          3HD1      ILE  83   9.651  -0.790  -5.535
  580    H    ALA  84           H        ALA  84   5.480   3.886  -5.260
  581    HA   ALA  84           HA       ALA  84   6.583   6.463  -4.948
  582   1HB   ALA  84          1HB       ALA  84   5.261   5.784  -6.898
  583   2HB   ALA  84          2HB       ALA  84   4.639   7.262  -6.164
  584   3HB   ALA  84          3HB       ALA  84   3.817   5.724  -5.890
  585    H    VAL  85           H        VAL  85   3.743   4.955  -3.453
  586    HA   VAL  85           HA       VAL  85   2.928   7.234  -1.970
  587    HB   VAL  85           HB       VAL  85   2.472   4.341  -1.266
  588   1HG1  VAL  85          1HG1      VAL  85   1.884   5.883   0.516
  589   2HG1  VAL  85          2HG1      VAL  85   0.428   5.184  -0.192
  590   3HG1  VAL  85          3HG1      VAL  85   0.904   6.831  -0.602
  591   1HG2  VAL  85          1HG2      VAL  85   0.392   4.499  -2.558
  592   2HG2  VAL  85          2HG2      VAL  85   1.813   4.740  -3.577
  593   3HG2  VAL  85          3HG2      VAL  85   0.843   6.126  -3.073
  594    H    ALA  86           H        ALA  86   4.780   4.334  -1.081
  595    HA   ALA  86           HA       ALA  86   5.486   5.063   1.514
  596   1HB   ALA  86          1HB       ALA  86   7.052   3.413  -0.468
  597   2HB   ALA  86          2HB       ALA  86   5.806   2.816   0.628
  598   3HB   ALA  86          3HB       ALA  86   7.315   3.457   1.274
  599    H    GLU  87           H        GLU  87   6.720   6.027  -1.573
  600    HA   GLU  87           HA       GLU  87   9.182   7.154  -0.822
  601   1HB   GLU  87          2HB       GLU  87   7.266   7.768  -3.055
  602   2HB   GLU  87          1HB       GLU  87   8.670   8.789  -2.795
  603   1HG   GLU  87          2HG       GLU  87   8.701   5.836  -3.365
  604   2HG   GLU  87          1HG       GLU  87   9.082   7.125  -4.505
  605    H    VAL  88           H        VAL  88   5.920   8.576  -0.922
  606    HA   VAL  88           HA       VAL  88   6.677  11.137  -0.013
  607    HB   VAL  88           HB       VAL  88   4.046   9.703   0.465
  608   1HG1  VAL  88          1HG1      VAL  88   4.428  11.585   2.001
  609   2HG1  VAL  88          2HG1      VAL  88   3.121  11.910   0.858
  610   3HG1  VAL  88          3HG1      VAL  88   4.704  12.646   0.614
  611   1HG2  VAL  88          1HG2      VAL  88   3.261  11.022  -1.467
  612   2HG2  VAL  88          2HG2      VAL  88   4.541   9.892  -1.902
  613   3HG2  VAL  88          3HG2      VAL  88   4.905  11.607  -1.717
  614    H    THR  89           H        THR  89   5.618   8.239   1.734
  615    HA   THR  89           HA       THR  89   5.562   9.456   4.269
  616    HB   THR  89           HB       THR  89   6.198   6.644   4.394
  617    HG1  THR  89           1HG      THR  89   3.883   7.242   2.850
  618   1HG2  THR  89          1HG2      THR  89   3.688   8.215   4.926
  619   2HG2  THR  89          2HG2      THR  89   4.997   7.937   6.073
  620   3HG2  THR  89          3HG2      THR  89   4.028   6.579   5.493
  621    H    ARG  90           H        ARG  90   8.049   7.505   2.652
  622    HA   ARG  90           HA       ARG  90   9.757   7.350   4.884
  623   1HB   ARG  90          2HB       ARG  90  11.400   6.459   3.453
  624   2HB   ARG  90          1HB       ARG  90   9.865   5.922   2.795
  625   1HG   ARG  90          2HG       ARG  90  10.044   7.235   0.926
  626   2HG   ARG  90          1HG       ARG  90  11.104   8.406   1.716
  627   1HD   ARG  90          2HD       ARG  90  12.951   6.896   1.629
  628   2HD   ARG  90          1HD       ARG  90  11.920   5.578   1.076
  629    HE   ARG  90           HE       ARG  90  11.602   6.937  -0.993
  630   1HH1  ARG  90          1HH1      ARG  90  14.472   7.331   0.989
  631   2HH1  ARG  90          2HH1      ARG  90  15.465   7.832  -0.340
  632   1HH2  ARG  90          1HH2      ARG  90  12.887   7.636  -2.713
  633   2HH2  ARG  90          2HH2      ARG  90  14.569   7.997  -2.445
  634    H    LEU  91           H        LEU  91   9.281   9.818   2.496
  635    HA   LEU  91           HA       LEU  91  11.896  10.954   2.866
  636   1HB   LEU  91          2HB       LEU  91  11.220  12.750   1.390
  637   2HB   LEU  91          1HB       LEU  91  10.833  11.190   0.706
  638    HG   LEU  91           HG       LEU  91   8.428  11.642   1.567
  639   1HD1  LEU  91          1HD1      LEU  91   9.514  14.460   1.522
  640   2HD1  LEU  91          2HD1      LEU  91   8.971  13.591   2.959
  641   3HD1  LEU  91          3HD1      LEU  91   7.820  13.998   1.686
  642   1HD2  LEU  91          1HD2      LEU  91   9.096  11.570  -0.781
  643   2HD2  LEU  91          2HD2      LEU  91   9.604  13.257  -0.690
  644   3HD2  LEU  91          3HD2      LEU  91   7.903  12.837  -0.488
  645    H    ARG  92           H        ARG  92   8.891  11.256   4.443
  646    HA   ARG  92           HA       ARG  92   9.438  13.861   5.572
  647   1HB   ARG  92          2HB       ARG  92   7.346  11.973   6.584
  648   2HB   ARG  92          1HB       ARG  92   7.331  13.730   6.570
  649   1HG   ARG  92          2HG       ARG  92   6.710  13.839   4.355
  650   2HG   ARG  92          1HG       ARG  92   7.306  12.212   4.005
  651   1HD   ARG  92          2HD       ARG  92   4.784  13.058   5.362
  652   2HD   ARG  92          1HD       ARG  92   5.022  11.883   4.064
  653    HE   ARG  92           HE       ARG  92   6.361  10.824   6.184
  654   1HH1  ARG  92          1HH1      ARG  92   3.065  11.839   5.587
  655   2HH1  ARG  92          2HH1      ARG  92   2.379  10.780   6.794
  656   1HH2  ARG  92          1HH2      ARG  92   5.471   9.470   7.828
  657   2HH2  ARG  92          2HH2      ARG  92   3.750   9.456   8.091
  658    H    GLN  93           H        GLN  93   9.344  10.484   6.557
  659    HA   GLN  93           HA       GLN  93  10.138  11.306   9.240
  660   1HB   GLN  93          2HB       GLN  93   9.272   9.172   9.999
  661   2HB   GLN  93          1HB       GLN  93   8.078  10.019   9.019
  662   1HG   GLN  93          2HG       GLN  93   9.156   8.572   7.094
  663   2HG   GLN  93          1HG       GLN  93   9.580   7.530   8.452
  664   1HE2  GLN  93          1HE2      GLN  93   7.748   7.054   6.250
  665   2HE2  GLN  93          2HE2      GLN  93   6.214   6.713   6.982
  666    H    GLY  94           H        GLY  94  11.306   9.340   6.570
  667   1HA   GLY  94          2HA       GLY  94  13.533   8.699   6.215
  668   2HA   GLY  94          1HA       GLY  94  13.908   9.203   7.860
  669    H    TRP  95           H        TRP  95  11.569   6.905   6.528
  670    HA   TRP  95           HA       TRP  95  11.193   4.713   6.850
  671   1HB   TRP  95          2HB       TRP  95  14.036   4.265   7.693
  672   2HB   TRP  95          1HB       TRP  95  12.983   3.221   6.737
  673    HD1  TRP  95           HD       TRP  95  14.999   6.486   6.372
  674    HE1  TRP  95           1HE      TRP  95  15.681   6.735   3.921
  675    HE3  TRP  95           3HE      TRP  95  12.490   2.477   4.425
  676    HZ2  TRP  95           2HZ      TRP  95  15.274   5.403   1.518
  677    HZ3  TRP  95           3HZ      TRP  95  12.699   2.039   2.010
  678    HH2  TRP  95           HH       TRP  95  14.059   3.481   0.580
  679    H    GLY  96           H        GLY  96  11.189   6.712   9.063
  680   1HA   GLY  96          2HA       GLY  96  11.796   5.301  11.465
  681   2HA   GLY  96          1HA       GLY  96  10.872   6.790  11.336
  682    H    ALA  97           H        ALA  97   9.058   5.360   9.355
  683    HA   ALA  97           HA       ALA  97   7.323   4.138  11.344
  684   1HB   ALA  97          1HB       ALA  97   6.366   5.731   9.733
  685   2HB   ALA  97          2HB       ALA  97   5.622   4.137   9.607
  686   3HB   ALA  97          3HB       ALA  97   6.814   4.651   8.415
  687    H    TRP  98           H        TRP  98   9.589   3.224   8.997
  688    HA   TRP  98           HA       TRP  98   8.539   0.511   8.827
  689   1HB   TRP  98          2HB       TRP  98  10.605   2.004   7.221
  690   2HB   TRP  98          1HB       TRP  98  10.383   0.260   7.088
  691    HD1  TRP  98           HD       TRP  98   8.024  -0.604   6.113
  692    HE1  TRP  98           1HE      TRP  98   6.333   0.524   4.531
  693    HE3  TRP  98           3HE      TRP  98   9.613   4.251   6.550
  694    HZ2  TRP  98           2HZ      TRP  98   5.765   3.142   3.580
  695    HZ3  TRP  98           3HZ      TRP  98   8.459   5.981   5.277
  696    HH2  TRP  98           HH       TRP  98   6.572   5.442   3.824
  697    HA   PRO  99           HA       PRO  99  11.148  -0.288  12.287
  698   1HB   PRO  99          2HB       PRO  99  10.409  -3.088  11.583
  699   2HB   PRO  99          1HB       PRO  99  10.251  -2.234  13.127
  700   1HG   PRO  99          2HG       PRO  99   8.102  -2.657  11.659
  701   2HG   PRO  99          1HG       PRO  99   8.350  -1.080  12.440
  702   1HD   PRO  99          2HD       PRO  99   8.829  -1.860   9.579
  703   2HD   PRO  99          1HD       PRO  99   8.029  -0.412  10.233
  704    H    VAL 100           H        VAL 100  12.243  -3.021  12.385
  705    HA   VAL 100           HA       VAL 100  14.827  -2.581  11.464
  706    HB   VAL 100           HB       VAL 100  13.495  -5.255  11.957
  707   1HG1  VAL 100          1HG1      VAL 100  15.765  -6.073  12.414
  708   2HG1  VAL 100          2HG1      VAL 100  16.417  -4.502  11.943
  709   3HG1  VAL 100          3HG1      VAL 100  15.594  -5.507  10.751
  710   1HG2  VAL 100          1HG2      VAL 100  15.019  -3.444  13.829
  711   2HG2  VAL 100          2HG2      VAL 100  14.454  -5.068  14.213
  712   3HG2  VAL 100          3HG2      VAL 100  13.290  -3.787  13.881
  713    H    CYS 101           H        CYS 101  12.061  -3.789   9.769
  714    HA   CYS 101           HA       CYS 101  13.213  -5.119   7.626
  715   1HB   CYS 101          2HB       CYS 101  10.786  -3.308   7.522
  716   2HB   CYS 101          1HB       CYS 101  11.173  -4.607   6.396
  717    H    ALA 102           H        ALA 102  12.848  -1.649   8.198
  718    HA   ALA 102           HA       ALA 102  13.679  -0.840   5.596
  719   1HB   ALA 102          1HB       ALA 102  12.397   0.629   7.093
  720   2HB   ALA 102          2HB       ALA 102  13.901   1.381   6.556
  721   3HB   ALA 102          3HB       ALA 102  13.782   0.710   8.184
  722    H    ALA 103           H        ALA 103  15.345  -1.263   8.688
  723    HA   ALA 103           HA       ALA 103  17.879  -0.372   7.832
  724   1HB   ALA 103          1HB       ALA 103  18.754  -1.456   9.817
  725   2HB   ALA 103          2HB       ALA 103  17.257  -2.366  10.006
  726   3HB   ALA 103          3HB       ALA 103  17.254  -0.614  10.202
  727    H    ARG 104           H        ARG 104  16.400  -3.564   7.960
  728    HA   ARG 104           HA       ARG 104  18.515  -5.095   6.975
  729   1HB   ARG 104          2HB       ARG 104  15.519  -5.403   6.750
  730   2HB   ARG 104          1HB       ARG 104  16.650  -6.631   6.198
  731   1HG   ARG 104          2HG       ARG 104  17.484  -6.918   8.454
  732   2HG   ARG 104          1HG       ARG 104  16.429  -5.622   9.029
  733   1HD   ARG 104          2HD       ARG 104  15.566  -7.955   9.415
  734   2HD   ARG 104          1HD       ARG 104  14.468  -6.881   8.539
  735    HE   ARG 104           HE       ARG 104  16.080  -8.293   6.709
  736   1HH1  ARG 104          1HH1      ARG 104  13.390  -8.833   8.903
  737   2HH1  ARG 104          2HH1      ARG 104  12.737 -10.154   7.968
  738   1HH2  ARG 104          1HH2      ARG 104  15.260 -10.024   5.509
  739   2HH2  ARG 104          2HH2      ARG 104  13.824 -10.851   6.041
  740    H    ALA 105           H        ALA 105  16.043  -3.219   5.335
  741    HA   ALA 105           HA       ALA 105  16.649  -4.212   2.710
  742   1HB   ALA 105          1HB       ALA 105  14.986  -1.866   3.597
  743   2HB   ALA 105          2HB       ALA 105  14.413  -3.517   3.344
  744   3HB   ALA 105          3HB       ALA 105  15.014  -2.572   1.979
  745    H    GLY 106           H        GLY 106  17.838  -1.645   4.704
  746   1HA   GLY 106          2HA       GLY 106  19.883  -0.512   4.163
  747   2HA   GLY 106          1HA       GLY 106  19.480  -0.680   2.459
  748    H    ALA 107           H        ALA 107  18.179   0.814   5.416
  749    HA   ALA 107           HA       ALA 107  16.544   2.653   4.011
  750   1HB   ALA 107          1HB       ALA 107  16.086   3.588   6.211
  751   2HB   ALA 107          2HB       ALA 107  17.404   2.638   6.902
  752   3HB   ALA 107          3HB       ALA 107  15.982   1.828   6.241
  753    H    ARG 108           H        ARG 108  16.729   4.912   3.920
  754    HA   ARG 108           HA       ARG 108  17.695   6.930   3.740
  755   1HB   ARG 108          2HB       ARG 108  19.878   5.935   5.552
  756   2HB   ARG 108          1HB       ARG 108  19.281   7.586   5.362
  757   1HG   ARG 108          2HG       ARG 108  17.269   7.109   6.453
  758   2HG   ARG 108          1HG       ARG 108  17.506   5.356   6.290
  759   1HD   ARG 108          2HD       ARG 108  19.452   5.547   7.816
  760   2HD   ARG 108          1HD       ARG 108  19.091   7.261   8.027
  761    HE   ARG 108           HE       ARG 108  17.015   5.307   8.688
  762   1HH1  ARG 108          1HH1      ARG 108  19.353   7.687   9.732
  763   2HH1  ARG 108          2HH1      ARG 108  18.750   7.747  11.356
  764   1HH2  ARG 108          1HH2      ARG 108  16.211   5.387  10.811
  765   2HH2  ARG 108          2HH2      ARG 108  16.957   6.445  11.978
  Start of MODEL   23
    1   1H    ASN   1          1HT       ASN   1  18.623  20.549 -48.322
    2   2H    ASN   1          2HT       ASN   1  18.199  19.451 -49.537
    3   3H    ASN   1          3HT       ASN   1  18.319  18.932 -47.930
    4    HA   ASN   1           HA       ASN   1  16.361  20.883 -48.968
    5   1HB   ASN   1          2HB       ASN   1  14.690  19.102 -48.489
    6   2HB   ASN   1          1HB       ASN   1  15.810  18.679 -49.776
    7   1HD2  ASN   1          1HD2      ASN   1  14.157  17.011 -47.978
    8   2HD2  ASN   1          2HD2      ASN   1  15.276  15.917 -47.234
    9    H    VAL   2           H        VAL   2  15.616  22.200 -47.499
   10    HA   VAL   2           HA       VAL   2  16.043  21.601 -44.674
   11    HB   VAL   2           HB       VAL   2  16.755  23.801 -45.612
   12   1HG1  VAL   2          1HG1      VAL   2  14.937  24.123 -47.203
   13   2HG1  VAL   2          2HG1      VAL   2  15.091  25.503 -46.115
   14   3HG1  VAL   2          3HG1      VAL   2  13.800  24.324 -45.870
   15   1HG2  VAL   2          1HG2      VAL   2  14.631  23.936 -43.474
   16   2HG2  VAL   2          2HG2      VAL   2  15.858  25.165 -43.781
   17   3HG2  VAL   2          3HG2      VAL   2  16.338  23.561 -43.227
   18    H    VAL   3           H        VAL   3  13.601  21.624 -47.035
   19    HA   VAL   3           HA       VAL   3  11.386  22.179 -45.381
   20    HB   VAL   3           HB       VAL   3  11.457  20.807 -48.063
   21   1HG1  VAL   3          1HG1      VAL   3   9.113  21.508 -48.250
   22   2HG1  VAL   3          2HG1      VAL   3   9.179  22.150 -46.609
   23   3HG1  VAL   3          3HG1      VAL   3   9.361  20.419 -46.886
   24   1HG2  VAL   3          1HG2      VAL   3  10.941  23.012 -48.988
   25   2HG2  VAL   3          2HG2      VAL   3  12.491  23.006 -48.148
   26   3HG2  VAL   3          3HG2      VAL   3  11.073  23.718 -47.378
   27    H    VAL   4           H        VAL   4  10.393  20.855 -43.991
   28    HA   VAL   4           HA       VAL   4  11.001  18.027 -43.941
   29    HB   VAL   4           HB       VAL   4   8.825  19.374 -42.368
   30   1HG1  VAL   4          1HG1      VAL   4   9.290  17.611 -40.733
   31   2HG1  VAL   4          2HG1      VAL   4  10.521  16.954 -41.813
   32   3HG1  VAL   4          3HG1      VAL   4   8.826  16.956 -42.305
   33   1HG2  VAL   4          1HG2      VAL   4  10.448  19.778 -40.575
   34   2HG2  VAL   4          2HG2      VAL   4  10.853  20.684 -42.036
   35   3HG2  VAL   4          3HG2      VAL   4  11.744  19.215 -41.632
   36    H    THR   5           H        THR   5   9.670  16.406 -44.574
   37    HA   THR   5           HA       THR   5   7.283  17.197 -46.089
   38    HB   THR   5           HB       THR   5   8.039  15.360 -47.756
   39    HG1  THR   5           1HG      THR   5  10.086  15.321 -46.071
   40   1HG2  THR   5          1HG2      THR   5   9.292  17.001 -49.069
   41   2HG2  THR   5          2HG2      THR   5   9.484  18.009 -47.637
   42   3HG2  THR   5          3HG2      THR   5   7.880  17.738 -48.315
   43    HA   PRO   6           HA       PRO   6   5.711  13.654 -43.816
   44   1HB   PRO   6          2HB       PRO   6   3.108  14.379 -44.836
   45   2HB   PRO   6          1HB       PRO   6   3.712  14.511 -43.183
   46   1HG   PRO   6          2HG       PRO   6   3.146  16.664 -44.750
   47   2HG   PRO   6          1HG       PRO   6   4.360  16.684 -43.457
   48   1HD   PRO   6          2HD       PRO   6   4.742  16.340 -46.413
   49   2HD   PRO   6          1HD       PRO   6   5.674  17.337 -45.270
   50    H    ALA   7           H        ALA   7   4.412  11.851 -44.387
   51    HA   ALA   7           HA       ALA   7   4.145   9.959 -45.603
   52   1HB   ALA   7          1HB       ALA   7   2.378  11.388 -46.596
   53   2HB   ALA   7          2HB       ALA   7   2.995  10.154 -47.697
   54   3HB   ALA   7          3HB       ALA   7   3.508  11.834 -47.874
   55    H    HIS   8           H        HIS   8   4.703   9.072 -48.033
   56    HA   HIS   8           HA       HIS   8   6.390   8.220 -49.290
   57   1HB   HIS   8          2HB       HIS   8   6.866  10.525 -49.960
   58   2HB   HIS   8          1HB       HIS   8   7.828  10.766 -48.509
   59    HD1  HIS   8           1HD      HIS   8  10.274  10.102 -48.623
   60    HD2  HIS   8           2HD      HIS   8   8.068   8.763 -51.882
   61    HE1  HIS   8           1HE      HIS   8  11.949   9.239 -50.303
   62    H    GLU   9           H        GLU   9   6.532   8.873 -46.048
   63    HA   GLU   9           HA       GLU   9   9.115   7.742 -45.459
   64   1HB   GLU   9          2HB       GLU   9   8.378   7.931 -43.108
   65   2HB   GLU   9          1HB       GLU   9   8.173   9.437 -43.993
   66   1HG   GLU   9          2HG       GLU   9   5.766   8.746 -44.343
   67   2HG   GLU   9          1HG       GLU   9   6.060   7.481 -43.152
   68    H    ALA  10           H        ALA  10   9.553   5.733 -44.641
   69    HA   ALA  10           HA       ALA  10   7.385   3.769 -44.907
   70   1HB   ALA  10          1HB       ALA  10  10.302   3.364 -45.580
   71   2HB   ALA  10          2HB       ALA  10   8.994   3.559 -46.749
   72   3HB   ALA  10          3HB       ALA  10   9.034   2.144 -45.695
   73    H    VAL  11           H        VAL  11   7.200   4.516 -42.681
   74    HA   VAL  11           HA       VAL  11   9.011   3.989 -40.651
   75    HB   VAL  11           HB       VAL  11   6.025   3.853 -40.498
   76   1HG1  VAL  11          1HG1      VAL  11   8.066   4.326 -38.333
   77   2HG1  VAL  11          2HG1      VAL  11   7.095   2.868 -38.543
   78   3HG1  VAL  11          3HG1      VAL  11   6.316   4.394 -38.126
   79   1HG2  VAL  11          1HG2      VAL  11   6.757   5.968 -41.433
   80   2HG2  VAL  11          2HG2      VAL  11   7.871   6.191 -40.086
   81   3HG2  VAL  11          3HG2      VAL  11   6.132   6.197 -39.800
   82    H    VAL  12           H        VAL  12   6.243   2.005 -41.623
   83    HA   VAL  12           HA       VAL  12   5.616  -0.055 -40.939
   84    HB   VAL  12           HB       VAL  12   6.392  -0.362 -43.123
   85   1HG1  VAL  12          1HG1      VAL  12   9.153  -0.832 -42.027
   86   2HG1  VAL  12          2HG1      VAL  12   8.621   0.589 -42.922
   87   3HG1  VAL  12          3HG1      VAL  12   8.672  -0.984 -43.717
   88   1HG2  VAL  12          1HG2      VAL  12   7.370  -2.597 -41.367
   89   2HG2  VAL  12          2HG2      VAL  12   7.032  -2.737 -43.094
   90   3HG2  VAL  12          3HG2      VAL  12   5.728  -2.368 -41.965
   91    H    ARG  13           H        ARG  13   5.807   0.059 -38.780
   92    HA   ARG  13           HA       ARG  13   7.954  -1.517 -37.613
   93   1HB   ARG  13          2HB       ARG  13   8.042  -0.041 -35.715
   94   2HB   ARG  13          1HB       ARG  13   8.195   0.939 -37.169
   95   1HG   ARG  13          2HG       ARG  13   5.883   1.600 -37.024
   96   2HG   ARG  13          1HG       ARG  13   5.643   0.541 -35.635
   97   1HD   ARG  13          2HD       ARG  13   7.364   1.895 -34.420
   98   2HD   ARG  13          1HD       ARG  13   7.351   3.019 -35.783
   99    HE   ARG  13           HE       ARG  13   4.715   2.580 -34.890
  100   1HH1  ARG  13          1HH1      ARG  13   7.650   4.305 -34.046
  101   2HH1  ARG  13          2HH1      ARG  13   6.836   5.429 -32.994
  102   1HH2  ARG  13          1HH2      ARG  13   3.643   4.070 -33.535
  103   2HH2  ARG  13          2HH2      ARG  13   4.556   5.311 -32.727
  104    H    VAL  14           H        VAL  14   7.256  -3.099 -36.320
  105    HA   VAL  14           HA       VAL  14   4.452  -3.269 -35.617
  106    HB   VAL  14           HB       VAL  14   6.547  -5.228 -34.775
  107   1HG1  VAL  14          1HG1      VAL  14   4.694  -6.830 -34.884
  108   2HG1  VAL  14          2HG1      VAL  14   3.618  -5.521 -35.376
  109   3HG1  VAL  14          3HG1      VAL  14   4.367  -5.494 -33.779
  110   1HG2  VAL  14          1HG2      VAL  14   5.168  -5.175 -37.454
  111   2HG2  VAL  14          2HG2      VAL  14   6.105  -6.534 -36.830
  112   3HG2  VAL  14          3HG2      VAL  14   6.895  -4.991 -37.157
  113    H    GLY  15           H        GLY  15   3.904  -3.656 -33.419
  114   1HA   GLY  15          2HA       GLY  15   5.512  -3.305 -31.238
  115   2HA   GLY  15          1HA       GLY  15   5.010  -1.697 -31.728
  116    H    THR  16           H        THR  16   3.796  -4.884 -30.935
  117    HA   THR  16           HA       THR  16   1.329  -3.750 -29.929
  118    HB   THR  16           HB       THR  16   2.244  -6.626 -30.089
  119    HG1  THR  16           1HG      THR  16   1.195  -6.727 -32.004
  120   1HG2  THR  16          1HG2      THR  16  -0.117  -7.165 -29.751
  121   2HG2  THR  16          2HG2      THR  16  -0.473  -5.448 -29.558
  122   3HG2  THR  16          3HG2      THR  16   0.554  -6.274 -28.387
  123    H    LYS  17           H        LYS  17   4.350  -4.938 -28.995
  124    HA   LYS  17           HA       LYS  17   4.032  -5.493 -26.288
  125   1HB   LYS  17          2HB       LYS  17   6.455  -4.286 -27.635
  126   2HB   LYS  17          1HB       LYS  17   6.435  -5.160 -26.111
  127   1HG   LYS  17          2HG       LYS  17   5.937  -6.260 -28.864
  128   2HG   LYS  17          1HG       LYS  17   7.276  -6.628 -27.777
  129   1HD   LYS  17          2HD       LYS  17   4.375  -7.284 -27.309
  130   2HD   LYS  17          1HD       LYS  17   5.628  -8.431 -27.791
  131   1HE   LYS  17          2HE       LYS  17   6.789  -8.141 -25.717
  132   2HE   LYS  17          1HE       LYS  17   5.735  -6.808 -25.255
  133   1HZ   LYS  17          1HZ       LYS  17   5.075  -8.766 -24.091
  134   2HZ   LYS  17          2HZ       LYS  17   4.972  -9.661 -25.524
  135   3HZ   LYS  17          3HZ       LYS  17   3.871  -8.403 -25.231
  136    HA   PRO  18           HA       PRO  18   3.409  -1.222 -24.935
  137   1HB   PRO  18          2HB       PRO  18   2.189  -2.257 -22.589
  138   2HB   PRO  18          1HB       PRO  18   1.388  -1.538 -23.988
  139   1HG   PRO  18          2HG       PRO  18   1.181  -4.187 -23.228
  140   2HG   PRO  18          1HG       PRO  18   0.833  -3.560 -24.846
  141   1HD   PRO  18          2HD       PRO  18   3.295  -4.927 -23.834
  142   2HD   PRO  18          1HD       PRO  18   2.488  -5.082 -25.414
  143    H    GLY  19           H        GLY  19   3.804  -0.211 -22.821
  144   1HA   GLY  19          2HA       GLY  19   6.430  -1.053 -21.898
  145   2HA   GLY  19          1HA       GLY  19   5.649   0.482 -21.533
  146    H    THR  20           H        THR  20   4.236  -2.635 -21.236
  147    HA   THR  20           HA       THR  20   3.212  -2.265 -18.659
  148    HB   THR  20           HB       THR  20   3.784  -4.983 -19.803
  149    HG1  THR  20           1HG      THR  20   1.444  -3.654 -20.570
  150   1HG2  THR  20          1HG2      THR  20   1.442  -3.801 -18.323
  151   2HG2  THR  20          2HG2      THR  20   2.701  -4.816 -17.616
  152   3HG2  THR  20          3HG2      THR  20   1.601  -5.484 -18.826
  153    H    GLU  21           H        GLU  21   6.078  -3.983 -19.801
  154    HA   GLU  21           HA       GLU  21   6.921  -4.593 -17.121
  155   1HB   GLU  21          2HB       GLU  21   8.966  -5.483 -18.293
  156   2HB   GLU  21          1HB       GLU  21   7.447  -6.294 -18.629
  157   1HG   GLU  21          2HG       GLU  21   7.259  -5.060 -20.733
  158   2HG   GLU  21          1HG       GLU  21   8.796  -4.267 -20.392
  159    H    VAL  22           H        VAL  22   6.852  -2.437 -16.574
  160    HA   VAL  22           HA       VAL  22   8.633  -0.471 -17.588
  161    HB   VAL  22           HB       VAL  22   6.548   0.185 -16.562
  162   1HG1  VAL  22          1HG1      VAL  22   7.594  -1.075 -14.037
  163   2HG1  VAL  22          2HG1      VAL  22   6.256  -1.654 -15.028
  164   3HG1  VAL  22          3HG1      VAL  22   6.117  -0.121 -14.163
  165   1HG2  VAL  22          1HG2      VAL  22   8.882   1.044 -14.854
  166   2HG2  VAL  22          2HG2      VAL  22   7.325   1.868 -14.948
  167   3HG2  VAL  22          3HG2      VAL  22   8.367   1.783 -16.369
  168    HA   PRO  23           HA       PRO  23  12.427  -1.570 -15.507
  169   1HB   PRO  23          2HB       PRO  23  12.718   1.395 -15.388
  170   2HB   PRO  23          1HB       PRO  23  13.852   0.180 -15.983
  171   1HG   PRO  23          2HG       PRO  23  12.462   1.704 -17.672
  172   2HG   PRO  23          1HG       PRO  23  12.790  -0.002 -18.033
  173   1HD   PRO  23          2HD       PRO  23  10.283   1.307 -17.121
  174   2HD   PRO  23          1HD       PRO  23  10.503  -0.080 -18.202
  175    HA   PRO  24           HA       PRO  24  11.086  -1.397 -11.308
  176   1HB   PRO  24          2HB       PRO  24  13.623  -1.757 -10.199
  177   2HB   PRO  24          1HB       PRO  24  12.516  -3.044 -10.690
  178   1HG   PRO  24          2HG       PRO  24  14.801  -1.828 -12.192
  179   2HG   PRO  24          1HG       PRO  24  14.306  -3.531 -12.085
  180   1HD   PRO  24          2HD       PRO  24  13.710  -2.131 -14.248
  181   2HD   PRO  24          1HD       PRO  24  12.499  -3.211 -13.529
  182    H    VAL  25           H        VAL  25  10.919   0.047  -9.750
  183    HA   VAL  25           HA       VAL  25  12.078   2.644 -10.181
  184    HB   VAL  25           HB       VAL  25  10.001   1.656  -8.193
  185   1HG1  VAL  25          1HG1      VAL  25   9.679   4.001  -7.571
  186   2HG1  VAL  25          2HG1      VAL  25  11.025   4.475  -8.606
  187   3HG1  VAL  25          3HG1      VAL  25  11.319   3.476  -7.182
  188   1HG2  VAL  25          1HG2      VAL  25   9.286   1.803 -10.521
  189   2HG2  VAL  25          2HG2      VAL  25   9.837   3.476 -10.596
  190   3HG2  VAL  25          3HG2      VAL  25   8.496   3.036  -9.537
  191    H    ILE  26           H        ILE  26  13.613   3.577  -9.049
  192    HA   ILE  26           HA       ILE  26  15.621   1.942  -8.070
  193    HB   ILE  26           HB       ILE  26  15.387   4.918  -7.674
  194   1HG1  ILE  26          2HG1      ILE  26  15.081   4.299 -10.030
  195   2HG1  ILE  26          1HG1      ILE  26  16.619   5.119  -9.790
  196   1HG2  ILE  26          1HG2      ILE  26  17.156   3.890  -6.332
  197   2HG2  ILE  26          2HG2      ILE  26  17.817   4.912  -7.606
  198   3HG2  ILE  26          3HG2      ILE  26  17.833   3.158  -7.787
  199   1HD1  ILE  26          1HD1      ILE  26  17.763   2.958  -9.835
  200   2HD1  ILE  26          2HD1      ILE  26  16.855   3.257 -11.316
  201   3HD1  ILE  26          3HD1      ILE  26  16.217   2.153 -10.098
  202    H    ASP  27           H        ASP  27  13.308   3.861  -6.253
  203    HA   ASP  27           HA       ASP  27  14.728   3.528  -3.783
  204   1HB   ASP  27          2HB       ASP  27  13.265   5.529  -4.501
  205   2HB   ASP  27          1HB       ASP  27  11.916   4.486  -4.081
  206    H    GLY  28           H        GLY  28  12.598   1.920  -5.641
  207   1HA   GLY  28          2HA       GLY  28  11.065   0.565  -3.645
  208   2HA   GLY  28          1HA       GLY  28  11.102   0.193  -5.364
  209    H    SER  29           H        SER  29  14.196   0.408  -4.302
  210    HA   SER  29           HA       SER  29  14.541  -2.448  -4.188
  211   1HB   SER  29          2HB       SER  29  16.472  -0.218  -3.587
  212   2HB   SER  29          1HB       SER  29  16.897  -1.921  -3.729
  213    HG   SER  29           HG       SER  29  16.974  -0.286  -5.659
  214    H    ILE  30           H        ILE  30  14.646   0.224  -1.946
  215    HA   ILE  30           HA       ILE  30  15.042  -1.370   0.391
  216    HB   ILE  30           HB       ILE  30  13.576   1.028   1.028
  217   1HG1  ILE  30          2HG1      ILE  30  14.415   1.833  -1.198
  218   2HG1  ILE  30          1HG1      ILE  30  15.022   2.759   0.163
  219   1HG2  ILE  30          1HG2      ILE  30  15.588   1.568   2.294
  220   2HG2  ILE  30          2HG2      ILE  30  16.439   0.249   1.488
  221   3HG2  ILE  30          3HG2      ILE  30  15.064  -0.100   2.536
  222   1HD1  ILE  30          1HD1      ILE  30  16.751   2.382  -1.493
  223   2HD1  ILE  30          2HD1      ILE  30  16.544   0.638  -1.332
  224   3HD1  ILE  30          3HD1      ILE  30  17.153   1.583   0.029
  225    H    TRP  31           H        TRP  31  12.383  -0.097  -1.430
  226    HA   TRP  31           HA       TRP  31  10.344  -0.733   0.413
  227   1HB   TRP  31          2HB       TRP  31  10.249  -0.112  -2.547
  228   2HB   TRP  31          1HB       TRP  31   8.822  -0.266  -1.520
  229    HD1  TRP  31           HD       TRP  31  10.586   2.457  -2.942
  230    HE1  TRP  31           1HE      TRP  31  10.616   4.558  -1.419
  231    HE3  TRP  31           3HE      TRP  31   9.288   0.266   1.430
  232    HZ2  TRP  31           2HZ      TRP  31  10.179   5.151   1.292
  233    HZ3  TRP  31           3HZ      TRP  31   9.119   1.638   3.461
  234    HH2  TRP  31           HH       TRP  31   9.554   4.035   3.387
  235    H    ASP  32           H        ASP  32  11.829  -2.453  -2.257
  236    HA   ASP  32           HA       ASP  32   9.990  -4.620  -2.229
  237   1HB   ASP  32          2HB       ASP  32  11.142  -4.306  -4.244
  238   2HB   ASP  32          1HB       ASP  32  12.703  -4.162  -3.432
  239    H    ALA  33           H        ALA  33  13.211  -4.049  -0.786
  240    HA   ALA  33           HA       ALA  33  13.394  -6.662   0.260
  241   1HB   ALA  33          1HB       ALA  33  15.278  -5.846   1.545
  242   2HB   ALA  33          2HB       ALA  33  14.815  -4.180   1.196
  243   3HB   ALA  33          3HB       ALA  33  15.354  -5.236  -0.109
  244    H    ILE  34           H        ILE  34  12.102  -3.624   1.485
  245    HA   ILE  34           HA       ILE  34  11.469  -4.547   4.097
  246    HB   ILE  34           HB       ILE  34  10.243  -2.400   2.384
  247   1HG1  ILE  34          2HG1      ILE  34  12.027  -2.278   4.829
  248   2HG1  ILE  34          1HG1      ILE  34  12.549  -2.009   3.170
  249   1HG2  ILE  34          1HG2      ILE  34   9.628  -3.040   5.270
  250   2HG2  ILE  34          2HG2      ILE  34   8.526  -3.202   3.905
  251   3HG2  ILE  34          3HG2      ILE  34   9.076  -1.604   4.405
  252   1HD1  ILE  34          1HD1      ILE  34  12.278   0.082   4.365
  253   2HD1  ILE  34          2HD1      ILE  34  10.592  -0.314   4.700
  254   3HD1  ILE  34          3HD1      ILE  34  11.122  -0.041   3.038
  255    H    ALA  35           H        ALA  35   9.640  -4.469   1.051
  256    HA   ALA  35           HA       ALA  35   7.267  -5.625   1.956
  257   1HB   ALA  35          1HB       ALA  35   7.513  -4.645  -0.269
  258   2HB   ALA  35          2HB       ALA  35   6.895  -6.291  -0.368
  259   3HB   ALA  35          3HB       ALA  35   8.586  -5.963  -0.739
  260    H    GLY  36           H        GLY  36  10.325  -7.041   1.033
  261   1HA   GLY  36          2HA       GLY  36   9.419  -9.769   1.149
  262   2HA   GLY  36          1HA       GLY  36  11.092  -9.228   1.107
  263    H    CYS  37           H        CYS  37  10.409  -7.451   3.445
  264    HA   CYS  37           HA       CYS  37  11.191  -9.373   5.459
  265   1HB   CYS  37          2HB       CYS  37  12.481  -7.382   5.394
  266   2HB   CYS  37          1HB       CYS  37  11.042  -6.369   5.362
  267    H    GLU  38           H        GLU  38   8.634  -6.937   5.060
  268    HA   GLU  38           HA       GLU  38   7.421  -7.763   7.568
  269   1HB   GLU  38          2HB       GLU  38   7.674  -5.356   6.984
  270   2HB   GLU  38          1HB       GLU  38   6.592  -5.598   5.621
  271   1HG   GLU  38          2HG       GLU  38   5.396  -4.589   7.437
  272   2HG   GLU  38          1HG       GLU  38   4.801  -6.226   7.177
  273    H    ALA  39           H        ALA  39   6.891  -7.958   4.119
  274    HA   ALA  39           HA       ALA  39   4.265  -9.124   4.619
  275   1HB   ALA  39          1HB       ALA  39   4.332  -7.207   3.088
  276   2HB   ALA  39          2HB       ALA  39   3.713  -8.669   2.320
  277   3HB   ALA  39          3HB       ALA  39   5.364  -8.142   2.006
  278    H    GLY  40           H        GLY  40   7.373 -10.085   4.005
  279   1HA   GLY  40          2HA       GLY  40   8.202 -12.224   3.627
  280   2HA   GLY  40          1HA       GLY  40   6.543 -12.787   3.417
  281    H    GLY  41           H        GLY  41   7.276 -10.016   1.719
  282   1HA   GLY  41          2HA       GLY  41   7.694  -9.535  -0.448
  283   2HA   GLY  41          1HA       GLY  41   8.268 -11.185  -0.692
  284    H    ASN  42           H        ASN  42   5.194  -9.563   0.102
  285    HA   ASN  42           HA       ASN  42   3.952 -10.813  -2.204
  286   1HB   ASN  42          2HB       ASN  42   3.696 -12.227   0.028
  287   2HB   ASN  42          1HB       ASN  42   2.464 -11.016   0.384
  288   1HD2  ASN  42          1HD2      ASN  42   0.585 -10.951  -0.881
  289   2HD2  ASN  42          2HD2      ASN  42   0.145 -12.249  -1.937
  290    H    TRP  43           H        TRP  43   3.320  -9.028  -3.183
  291    HA   TRP  43           HA       TRP  43   2.716  -6.649  -1.653
  292   1HB   TRP  43          2HB       TRP  43   2.766  -7.126  -4.632
  293   2HB   TRP  43          1HB       TRP  43   2.625  -5.558  -3.850
  294    HD1  TRP  43           HD       TRP  43   5.143  -8.505  -3.889
  295    HE1  TRP  43           1HE      TRP  43   7.530  -7.510  -3.796
  296    HE3  TRP  43           3HE      TRP  43   3.943  -3.558  -3.505
  297    HZ2  TRP  43           2HZ      TRP  43   8.737  -4.945  -3.572
  298    HZ3  TRP  43           3HZ      TRP  43   5.740  -1.894  -3.369
  299    HH2  TRP  43           HH       TRP  43   8.102  -2.598  -3.420
  300    H    ALA  44           H        ALA  44   1.020  -9.252  -2.696
  301    HA   ALA  44           HA       ALA  44  -1.502  -7.752  -2.897
  302   1HB   ALA  44          1HB       ALA  44  -0.895 -10.535  -3.890
  303   2HB   ALA  44          2HB       ALA  44  -0.972  -9.080  -4.882
  304   3HB   ALA  44          3HB       ALA  44  -2.423  -9.674  -4.076
  305    H    ILE  45           H        ILE  45   0.102  -8.913  -0.489
  306    HA   ILE  45           HA       ILE  45  -1.688 -10.863   0.597
  307    HB   ILE  45           HB       ILE  45   0.859 -10.689   1.012
  308   1HG1  ILE  45          2HG1      ILE  45  -1.002 -11.000   3.362
  309   2HG1  ILE  45          1HG1      ILE  45  -0.677 -12.234   2.152
  310   1HG2  ILE  45          1HG2      ILE  45   1.533  -9.371   2.954
  311   2HG2  ILE  45          2HG2      ILE  45  -0.088  -8.683   3.053
  312   3HG2  ILE  45          3HG2      ILE  45   0.932  -8.336   1.656
  313   1HD1  ILE  45          1HD1      ILE  45   1.673 -12.270   2.832
  314   2HD1  ILE  45          2HD1      ILE  45   0.592 -12.655   4.173
  315   3HD1  ILE  45          3HD1      ILE  45   1.324 -11.054   4.061
  316    H    ASN  46           H        ASN  46  -3.183 -10.482   2.256
  317    HA   ASN  46           HA       ASN  46  -3.574  -7.741   3.160
  318   1HB   ASN  46          2HB       ASN  46  -4.751  -8.041   0.887
  319   2HB   ASN  46          1HB       ASN  46  -5.857  -9.116   1.738
  320   1HD2  ASN  46          1HD2      ASN  46  -4.764  -5.858   1.327
  321   2HD2  ASN  46          2HD2      ASN  46  -6.055  -5.101   2.203
  322    H    THR  47           H        THR  47  -3.597  -8.115   5.214
  323    HA   THR  47           HA       THR  47  -4.824 -10.469   6.301
  324    HB   THR  47           HB       THR  47  -4.186  -9.385   8.512
  325    HG1  THR  47           1HG      THR  47  -2.961  -7.524   8.419
  326   1HG2  THR  47          1HG2      THR  47  -2.739 -11.022   7.384
  327   2HG2  THR  47          2HG2      THR  47  -1.794  -9.789   8.217
  328   3HG2  THR  47          3HG2      THR  47  -1.987  -9.719   6.467
  329    H    GLY  48           H        GLY  48  -5.648  -7.194   5.662
  330   1HA   GLY  48          2HA       GLY  48  -7.834  -6.361   5.547
  331   2HA   GLY  48          1HA       GLY  48  -8.363  -7.673   6.598
  332    H    ASN  49           H        ASN  49  -5.513  -5.902   7.420
  333    HA   ASN  49           HA       ASN  49  -6.915  -5.102   9.858
  334   1HB   ASN  49          2HB       ASN  49  -4.764  -4.860  10.908
  335   2HB   ASN  49          1HB       ASN  49  -4.787  -6.390  10.040
  336   1HD2  ASN  49          1HD2      ASN  49  -2.577  -4.661  10.918
  337   2HD2  ASN  49          2HD2      ASN  49  -1.653  -4.337   9.489
  338    H    GLY  50           H        GLY  50  -6.750  -3.670   7.089
  339   1HA   GLY  50          2HA       GLY  50  -7.232  -1.386   6.709
  340   2HA   GLY  50          1HA       GLY  50  -6.492  -0.997   8.257
  341    H    TYR  51           H        TYR  51  -4.290  -2.939   7.291
  342    HA   TYR  51           HA       TYR  51  -2.854  -1.071   5.558
  343   1HB   TYR  51          2HB       TYR  51  -1.694  -3.348   7.182
  344   2HB   TYR  51          1HB       TYR  51  -0.803  -2.152   6.281
  345    HD1  TYR  51           1HD      TYR  51   0.546  -1.743   8.249
  346    HD2  TYR  51           2HD      TYR  51  -3.650  -0.987   8.300
  347    HE1  TYR  51           1HE      TYR  51   0.823  -0.394  10.282
  348    HE2  TYR  51           2HE      TYR  51  -3.372   0.350  10.353
  349    HH   TYR  51           HH       TYR  51  -1.770   0.586  12.228
  350    H    TYR  52           H        TYR  52  -1.463  -2.236   3.901
  351    HA   TYR  52           HA       TYR  52  -2.947  -4.571   2.904
  352   1HB   TYR  52          2HB       TYR  52  -2.160  -2.190   1.228
  353   2HB   TYR  52          1HB       TYR  52  -3.089  -3.591   0.700
  354    HD1  TYR  52           1HD      TYR  52  -3.134  -0.638   2.894
  355    HD2  TYR  52           2HD      TYR  52  -5.438  -3.691   1.065
  356    HE1  TYR  52           1HE      TYR  52  -5.168   0.517   3.556
  357    HE2  TYR  52           2HE      TYR  52  -7.509  -2.538   1.729
  358    HH   TYR  52           HH       TYR  52  -8.192  -0.890   3.548
  359    H    GLY  53           H        GLY  53  -1.789  -5.455   0.856
  360   1HA   GLY  53          2HA       GLY  53   0.579  -6.538   1.876
  361   2HA   GLY  53          1HA       GLY  53  -0.009  -6.747   0.241
  362    H    GLY  54           H        GLY  54   2.530  -6.831   0.354
  363   1HA   GLY  54          2HA       GLY  54   4.310  -5.900  -0.808
  364   2HA   GLY  54          1HA       GLY  54   3.396  -4.405  -0.962
  365    H    VAL  55           H        VAL  55   3.846  -2.753   0.350
  366    HA   VAL  55           HA       VAL  55   6.102  -3.062   2.154
  367    HB   VAL  55           HB       VAL  55   4.596  -0.490   1.864
  368   1HG1  VAL  55          1HG1      VAL  55   7.549  -1.041   1.987
  369   2HG1  VAL  55          2HG1      VAL  55   6.545  -0.800   3.411
  370   3HG1  VAL  55          3HG1      VAL  55   6.727   0.501   2.236
  371   1HG2  VAL  55          1HG2      VAL  55   5.927   0.041  -0.144
  372   2HG2  VAL  55          2HG2      VAL  55   4.790  -1.279  -0.418
  373   3HG2  VAL  55          3HG2      VAL  55   6.501  -1.624  -0.178
  374    H    GLN  56           H        GLN  56   2.880  -3.463   2.319
  375    HA   GLN  56           HA       GLN  56   1.377  -3.856   3.923
  376   1HB   GLN  56          2HB       GLN  56   3.210  -5.467   4.489
  377   2HB   GLN  56          1HB       GLN  56   3.728  -4.337   5.736
  378   1HG   GLN  56          2HG       GLN  56   1.784  -4.637   6.989
  379   2HG   GLN  56          1HG       GLN  56   0.908  -5.341   5.631
  380   1HE2  GLN  56          1HE2      GLN  56   3.121  -7.037   4.865
  381   2HE2  GLN  56          2HE2      GLN  56   3.175  -8.324   6.023
  382    H    PHE  57           H        PHE  57   1.453  -1.226   3.657
  383    HA   PHE  57           HA       PHE  57   1.256  -0.398   6.455
  384   1HB   PHE  57          2HB       PHE  57   1.751   1.890   5.853
  385   2HB   PHE  57          1HB       PHE  57   3.084   0.811   5.496
  386    HD1  PHE  57           1HD      PHE  57   3.240   0.004   2.991
  387    HD2  PHE  57           2HD      PHE  57   1.081   3.432   4.300
  388    HE1  PHE  57           1HE      PHE  57   3.453   0.989   0.751
  389    HE2  PHE  57           2HE      PHE  57   1.279   4.414   2.057
  390    HZ   PHE  57           HZ       PHE  57   2.483   3.199   0.276
  391    H    ASP  58           H        ASP  58  -0.078   1.814   6.471
  392    HA   ASP  58           HA       ASP  58  -2.662   0.557   6.287
  393   1HB   ASP  58          2HB       ASP  58  -2.655   1.389   8.344
  394   2HB   ASP  58          1HB       ASP  58  -1.287   2.414   7.978
  395    H    GLN  59           H        GLN  59  -4.550   1.507   5.685
  396    HA   GLN  59           HA       GLN  59  -4.719   2.678   3.198
  397   1HB   GLN  59          2HB       GLN  59  -6.511   1.394   4.180
  398   2HB   GLN  59          1HB       GLN  59  -6.654   2.529   5.501
  399   1HG   GLN  59          2HG       GLN  59  -8.445   2.765   3.866
  400   2HG   GLN  59          1HG       GLN  59  -7.477   4.224   4.026
  401   1HE2  GLN  59          1HE2      GLN  59  -6.277   1.506   2.270
  402   2HE2  GLN  59          2HE2      GLN  59  -6.443   2.158   0.668
  403    H    GLY  60           H        GLY  60  -4.851   4.148   6.396
  404   1HA   GLY  60          2HA       GLY  60  -5.762   6.692   5.541
  405   2HA   GLY  60          1HA       GLY  60  -4.975   6.338   7.075
  406    H    THR  61           H        THR  61  -2.555   5.492   6.391
  407    HA   THR  61           HA       THR  61  -1.125   7.798   5.653
  408    HB   THR  61           HB       THR  61  -0.233   4.946   5.750
  409    HG1  THR  61           1HG      THR  61  -1.036   5.556   7.749
  410   1HG2  THR  61          1HG2      THR  61   1.382   7.487   5.905
  411   2HG2  THR  61          2HG2      THR  61   1.364   6.357   4.551
  412   3HG2  THR  61          3HG2      THR  61   2.019   5.856   6.112
  413    H    TRP  62           H        TRP  62  -1.886   4.828   3.895
  414    HA   TRP  62           HA       TRP  62  -0.536   5.327   1.516
  415   1HB   TRP  62          2HB       TRP  62  -1.537   3.182   2.042
  416   2HB   TRP  62          1HB       TRP  62  -3.134   3.913   2.104
  417    HD1  TRP  62           HD       TRP  62  -4.360   4.374  -0.204
  418    HE1  TRP  62           1HE      TRP  62  -3.973   3.474  -2.580
  419    HE3  TRP  62           3HE      TRP  62   0.320   2.451   0.419
  420    HZ2  TRP  62           2HZ      TRP  62  -1.932   2.131  -4.037
  421    HZ3  TRP  62           3HZ      TRP  62   1.432   1.379  -1.490
  422    HH2  TRP  62           HH       TRP  62   0.350   1.208  -3.666
  423    H    GLU  63           H        GLU  63  -3.808   6.151   2.526
  424    HA   GLU  63           HA       GLU  63  -4.544   7.422   0.117
  425   1HB   GLU  63          2HB       GLU  63  -6.174   6.469   1.647
  426   2HB   GLU  63          1HB       GLU  63  -5.707   7.586   2.911
  427   1HG   GLU  63          2HG       GLU  63  -6.705   8.695   0.335
  428   2HG   GLU  63          1HG       GLU  63  -7.861   7.945   1.432
  429    H    ALA  64           H        ALA  64  -2.999   8.472   3.056
  430    HA   ALA  64           HA       ALA  64  -3.380  11.266   2.776
  431   1HB   ALA  64          1HB       ALA  64  -2.757  10.186   4.896
  432   2HB   ALA  64          2HB       ALA  64  -1.649  11.489   4.464
  433   3HB   ALA  64          3HB       ALA  64  -1.170   9.809   4.222
  434    H    ASN  65           H        ASN  65  -0.706   9.117   1.832
  435    HA   ASN  65           HA       ASN  65   0.787  11.206   0.576
  436   1HB   ASN  65          2HB       ASN  65   0.999   8.228   0.102
  437   2HB   ASN  65          1HB       ASN  65   2.241   9.446  -0.194
  438   1HD2  ASN  65          1HD2      ASN  65   1.774   7.010   1.651
  439   2HD2  ASN  65          2HD2      ASN  65   2.390   7.564   3.170
  440    H    GLY  66           H        GLY  66  -1.933   9.359  -0.293
  441   1HA   GLY  66          2HA       GLY  66  -3.311   9.924  -2.126
  442   2HA   GLY  66          1HA       GLY  66  -1.912  10.605  -2.945
  443    H    GLY  67           H        GLY  67  -2.590   7.413  -1.522
  444   1HA   GLY  67          2HA       GLY  67  -1.134   6.156  -3.660
  445   2HA   GLY  67          1HA       GLY  67  -1.864   5.362  -2.274
  446    H    LEU  68           H        LEU  68  -4.455   6.764  -2.908
  447    HA   LEU  68           HA       LEU  68  -5.624   4.579  -4.100
  448   1HB   LEU  68          2HB       LEU  68  -6.574   7.341  -3.552
  449   2HB   LEU  68          1HB       LEU  68  -7.627   6.162  -4.311
  450    HG   LEU  68           HG       LEU  68  -7.081   4.677  -2.290
  451   1HD1  LEU  68          1HD1      LEU  68  -6.264   7.334  -1.172
  452   2HD1  LEU  68          2HD1      LEU  68  -5.214   5.943  -1.439
  453   3HD1  LEU  68          3HD1      LEU  68  -6.509   5.855  -0.244
  454   1HD2  LEU  68          1HD2      LEU  68  -9.262   5.720  -2.693
  455   2HD2  LEU  68          2HD2      LEU  68  -8.705   7.173  -1.863
  456   3HD2  LEU  68          3HD2      LEU  68  -8.865   5.658  -0.976
  457    H    ARG  69           H        ARG  69  -4.347   7.470  -5.543
  458    HA   ARG  69           HA       ARG  69  -5.616   7.246  -8.051
  459   1HB   ARG  69          2HB       ARG  69  -3.798   8.615  -8.916
  460   2HB   ARG  69          1HB       ARG  69  -4.362   9.248  -7.375
  461   1HG   ARG  69          2HG       ARG  69  -2.455   8.626  -6.265
  462   2HG   ARG  69          1HG       ARG  69  -2.067   7.357  -7.429
  463   1HD   ARG  69          2HD       ARG  69  -1.840  10.335  -7.854
  464   2HD   ARG  69          1HD       ARG  69  -0.513   9.192  -7.646
  465    HE   ARG  69           HE       ARG  69  -2.362   8.959  -9.930
  466   1HH1  ARG  69          1HH1      ARG  69   0.884   9.341  -8.672
  467   2HH1  ARG  69          2HH1      ARG  69   1.649   9.100 -10.214
  468   1HH2  ARG  69          1HH2      ARG  69  -1.382   8.647 -11.942
  469   2HH2  ARG  69          2HH2      ARG  69   0.353   8.702 -12.088
  470    H    TYR  70           H        TYR  70  -2.856   5.697  -6.582
  471    HA   TYR  70           HA       TYR  70  -1.939   4.392  -8.982
  472   1HB   TYR  70          2HB       TYR  70  -1.451   3.857  -6.046
  473   2HB   TYR  70          1HB       TYR  70  -0.493   3.196  -7.370
  474    HD1  TYR  70           1HD      TYR  70   1.020   4.761  -8.662
  475    HD2  TYR  70           2HD      TYR  70  -1.114   5.973  -5.197
  476    HE1  TYR  70           1HE      TYR  70   2.507   6.711  -8.433
  477    HE2  TYR  70           2HE      TYR  70   0.350   7.913  -4.960
  478    HH   TYR  70           HH       TYR  70   2.475   8.709  -5.611
  479    H    ALA  71           H        ALA  71  -3.904   3.890  -6.214
  480    HA   ALA  71           HA       ALA  71  -5.817   2.194  -7.053
  481   1HB   ALA  71          1HB       ALA  71  -3.495   0.569  -5.987
  482   2HB   ALA  71          2HB       ALA  71  -4.134   0.499  -7.629
  483   3HB   ALA  71          3HB       ALA  71  -5.123  -0.043  -6.274
  484    HA   PRO  72           HA       PRO  72  -6.815   3.683  -3.016
  485   1HB   PRO  72          2HB       PRO  72  -8.864   1.614  -2.955
  486   2HB   PRO  72          1HB       PRO  72  -9.009   3.362  -2.839
  487   1HG   PRO  72          2HG       PRO  72  -9.729   1.967  -5.046
  488   2HG   PRO  72          1HG       PRO  72  -9.164   3.642  -5.084
  489   1HD   PRO  72          2HD       PRO  72  -7.775   1.165  -5.903
  490   2HD   PRO  72          1HD       PRO  72  -7.553   2.836  -6.464
  491    H    ARG  73           H        ARG  73  -5.693   0.592  -3.640
  492    HA   ARG  73           HA       ARG  73  -4.921   0.300  -0.850
  493   1HB   ARG  73          2HB       ARG  73  -5.633  -2.003  -0.694
  494   2HB   ARG  73          1HB       ARG  73  -7.024  -1.008  -1.105
  495   1HG   ARG  73          2HG       ARG  73  -6.762  -1.649  -3.454
  496   2HG   ARG  73          1HG       ARG  73  -5.411  -2.686  -2.993
  497   1HD   ARG  73          2HD       ARG  73  -7.700  -3.261  -1.358
  498   2HD   ARG  73          1HD       ARG  73  -8.137  -3.342  -3.060
  499    HE   ARG  73           HE       ARG  73  -6.010  -4.929  -1.791
  500   1HH1  ARG  73          1HH1      ARG  73  -8.374  -4.381  -4.317
  501   2HH1  ARG  73          2HH1      ARG  73  -8.143  -5.938  -5.061
  502   1HH2  ARG  73          1HH2      ARG  73  -5.732  -7.014  -2.763
  503   2HH2  ARG  73          2HH2      ARG  73  -6.639  -7.421  -4.187
  504    H    ALA  74           H        ALA  74  -2.993  -0.746  -0.604
  505    HA   ALA  74           HA       ALA  74  -1.137  -0.569  -2.657
  506   1HB   ALA  74          1HB       ALA  74  -0.696  -0.508  -0.180
  507   2HB   ALA  74          2HB       ALA  74   0.450  -1.441  -1.139
  508   3HB   ALA  74          3HB       ALA  74  -0.793  -2.270  -0.206
  509    H    ASP  75           H        ASP  75  -3.202  -3.247  -1.789
  510    HA   ASP  75           HA       ASP  75  -1.572  -5.256  -3.011
  511   1HB   ASP  75          2HB       ASP  75  -4.448  -5.831  -2.863
  512   2HB   ASP  75          1HB       ASP  75  -3.083  -6.753  -2.255
  513    H    LEU  76           H        LEU  76  -3.921  -3.018  -4.119
  514    HA   LEU  76           HA       LEU  76  -4.437  -4.456  -6.585
  515   1HB   LEU  76          2HB       LEU  76  -6.228  -3.221  -5.449
  516   2HB   LEU  76          1HB       LEU  76  -5.331  -1.729  -5.644
  517    HG   LEU  76           HG       LEU  76  -5.550  -1.928  -8.091
  518   1HD1  LEU  76          1HD1      LEU  76  -5.703  -4.336  -8.287
  519   2HD1  LEU  76          2HD1      LEU  76  -7.116  -3.577  -9.020
  520   3HD1  LEU  76          3HD1      LEU  76  -7.244  -4.332  -7.433
  521   1HD2  LEU  76          1HD2      LEU  76  -8.169  -2.094  -6.610
  522   2HD2  LEU  76          2HD2      LEU  76  -7.919  -1.390  -8.208
  523   3HD2  LEU  76          3HD2      LEU  76  -7.177  -0.647  -6.790
  524    H    ALA  77           H        ALA  77  -2.586  -1.760  -5.407
  525    HA   ALA  77           HA       ALA  77  -1.525  -1.024  -7.981
  526   1HB   ALA  77          1HB       ALA  77  -0.693  -0.272  -5.175
  527   2HB   ALA  77          2HB       ALA  77  -1.784   0.643  -6.217
  528   3HB   ALA  77          3HB       ALA  77  -0.086   0.466  -6.658
  529    H    THR  78           H        THR  78   0.862  -1.169  -8.383
  530    HA   THR  78           HA       THR  78   1.813  -3.758  -7.397
  531    HB   THR  78           HB       THR  78   3.166  -3.975  -9.338
  532    HG1  THR  78           1HG      THR  78   2.738  -1.204  -9.596
  533   1HG2  THR  78          1HG2      THR  78   0.484  -2.788 -10.036
  534   2HG2  THR  78          2HG2      THR  78   0.849  -4.490  -9.735
  535   3HG2  THR  78          3HG2      THR  78   1.495  -3.690 -11.170
  536    H    ARG  79           H        ARG  79   4.470  -3.593  -7.833
  537    HA   ARG  79           HA       ARG  79   5.478  -2.568  -5.508
  538   1HB   ARG  79          2HB       ARG  79   6.923  -2.887  -8.139
  539   2HB   ARG  79          1HB       ARG  79   7.705  -2.691  -6.575
  540   1HG   ARG  79          2HG       ARG  79   6.625  -4.773  -5.816
  541   2HG   ARG  79          1HG       ARG  79   5.954  -4.974  -7.437
  542   1HD   ARG  79          2HD       ARG  79   7.836  -5.890  -8.149
  543   2HD   ARG  79          1HD       ARG  79   8.759  -4.480  -7.631
  544    HE   ARG  79           HE       ARG  79   9.088  -5.547  -5.503
  545   1HH1  ARG  79          1HH1      ARG  79   7.571  -7.549  -7.946
  546   2HH1  ARG  79          2HH1      ARG  79   8.145  -9.047  -7.273
  547   1HH2  ARG  79          1HH2      ARG  79   9.887  -7.543  -4.625
  548   2HH2  ARG  79          2HH2      ARG  79   9.454  -9.046  -5.401
  549    H    GLU  80           H        GLU  80   5.595  -0.993  -8.703
  550    HA   GLU  80           HA       GLU  80   7.168   1.166  -7.823
  551   1HB   GLU  80          2HB       GLU  80   6.842   2.147  -9.941
  552   2HB   GLU  80          1HB       GLU  80   6.840   0.413 -10.203
  553   1HG   GLU  80          2HG       GLU  80   4.998   0.732 -11.389
  554   2HG   GLU  80          1HG       GLU  80   4.170   1.004  -9.854
  555    H    GLU  81           H        GLU  81   3.648   0.879  -8.127
  556    HA   GLU  81           HA       GLU  81   2.963   3.468  -7.327
  557   1HB   GLU  81          2HB       GLU  81   1.551   0.844  -6.891
  558   2HB   GLU  81          1HB       GLU  81   0.845   2.401  -6.505
  559   1HG   GLU  81          2HG       GLU  81  -0.041   1.732  -8.559
  560   2HG   GLU  81          1HG       GLU  81   1.109   3.008  -8.923
  561    H    GLN  82           H        GLN  82   3.311   0.508  -5.365
  562    HA   GLN  82           HA       GLN  82   2.699   1.681  -2.889
  563   1HB   GLN  82          2HB       GLN  82   4.519  -0.660  -3.459
  564   2HB   GLN  82          1HB       GLN  82   3.901  -0.225  -1.874
  565   1HG   GLN  82          2HG       GLN  82   1.577  -0.492  -2.971
  566   2HG   GLN  82          1HG       GLN  82   2.456  -1.392  -4.211
  567   1HE2  GLN  82          1HE2      GLN  82   1.578  -3.375  -3.706
  568   2HE2  GLN  82          2HE2      GLN  82   1.903  -4.196  -2.214
  569    H    ILE  83           H        ILE  83   5.665   1.391  -4.678
  570    HA   ILE  83           HA       ILE  83   7.494   2.318  -2.788
  571    HB   ILE  83           HB       ILE  83   7.396   2.513  -5.793
  572   1HG1  ILE  83          2HG1      ILE  83   9.390   0.992  -4.158
  573   2HG1  ILE  83          1HG1      ILE  83   7.784   0.325  -4.426
  574   1HG2  ILE  83          1HG2      ILE  83   8.689   4.400  -5.198
  575   2HG2  ILE  83          2HG2      ILE  83   9.833   3.135  -5.648
  576   3HG2  ILE  83          3HG2      ILE  83   9.551   3.509  -3.950
  577   1HD1  ILE  83          1HD1      ILE  83   9.780   1.087  -6.549
  578   2HD1  ILE  83          2HD1      ILE  83   8.159   0.461  -6.849
  579   3HD1  ILE  83          3HD1      ILE  83   9.359  -0.547  -6.043
  580    H    ALA  84           H        ALA  84   5.567   4.067  -5.179
  581    HA   ALA  84           HA       ALA  84   6.623   6.613  -4.682
  582   1HB   ALA  84          1HB       ALA  84   4.680   7.442  -5.899
  583   2HB   ALA  84          2HB       ALA  84   3.905   5.864  -5.746
  584   3HB   ALA  84          3HB       ALA  84   5.376   6.034  -6.702
  585    H    VAL  85           H        VAL  85   3.759   4.989  -3.383
  586    HA   VAL  85           HA       VAL  85   2.897   7.165  -1.784
  587    HB   VAL  85           HB       VAL  85   2.395   4.246  -1.293
  588   1HG1  VAL  85          1HG1      VAL  85   0.287   5.040  -0.310
  589   2HG1  VAL  85          2HG1      VAL  85   0.784   6.705  -0.611
  590   3HG1  VAL  85          3HG1      VAL  85   1.694   5.704   0.523
  591   1HG2  VAL  85          1HG2      VAL  85   0.375   4.529  -2.692
  592   2HG2  VAL  85          2HG2      VAL  85   1.876   4.709  -3.601
  593   3HG2  VAL  85          3HG2      VAL  85   0.946   6.136  -3.141
  594    H    ALA  86           H        ALA  86   4.714   4.189  -0.953
  595    HA   ALA  86           HA       ALA  86   5.028   4.821   1.771
  596   1HB   ALA  86          1HB       ALA  86   6.735   3.039   0.041
  597   2HB   ALA  86          2HB       ALA  86   5.264   2.549   0.882
  598   3HB   ALA  86          3HB       ALA  86   6.684   3.043   1.803
  599    H    GLU  87           H        GLU  87   6.790   5.657  -1.094
  600    HA   GLU  87           HA       GLU  87   9.172   6.411   0.294
  601   1HB   GLU  87          2HB       GLU  87  10.076   7.113  -1.745
  602   2HB   GLU  87          1HB       GLU  87   9.045   5.750  -2.147
  603   1HG   GLU  87          2HG       GLU  87   8.470   7.111  -3.808
  604   2HG   GLU  87          1HG       GLU  87   7.306   7.684  -2.615
  605    H    VAL  88           H        VAL  88   6.256   8.144  -0.670
  606    HA   VAL  88           HA       VAL  88   7.095  10.723   0.057
  607    HB   VAL  88           HB       VAL  88   4.333   9.486   0.424
  608   1HG1  VAL  88          1HG1      VAL  88   5.191  12.385   0.551
  609   2HG1  VAL  88          2HG1      VAL  88   4.634  11.397   1.909
  610   3HG1  VAL  88          3HG1      VAL  88   3.526  11.798   0.591
  611   1HG2  VAL  88          1HG2      VAL  88   3.775  10.724  -1.622
  612   2HG2  VAL  88          2HG2      VAL  88   5.068   9.558  -1.907
  613   3HG2  VAL  88          3HG2      VAL  88   5.448  11.271  -1.749
  614    H    THR  89           H        THR  89   5.879   8.025   1.901
  615    HA   THR  89           HA       THR  89   5.581   9.371   4.368
  616    HB   THR  89           HB       THR  89   6.127   6.437   4.210
  617    HG1  THR  89           1HG      THR  89   4.256   7.812   2.749
  618   1HG2  THR  89          1HG2      THR  89   4.032   8.059   5.649
  619   2HG2  THR  89          2HG2      THR  89   5.559   7.533   6.348
  620   3HG2  THR  89          3HG2      THR  89   4.353   6.339   5.860
  621    H    ARG  90           H        ARG  90   8.170   7.409   2.948
  622    HA   ARG  90           HA       ARG  90   9.710   7.113   5.272
  623   1HB   ARG  90          2HB       ARG  90  11.391   6.208   3.944
  624   2HB   ARG  90          1HB       ARG  90   9.923   5.863   3.039
  625   1HG   ARG  90          2HG       ARG  90  10.406   7.500   1.427
  626   2HG   ARG  90          1HG       ARG  90  11.645   8.249   2.437
  627   1HD   ARG  90          2HD       ARG  90  13.009   6.227   2.254
  628   2HD   ARG  90          1HD       ARG  90  11.778   5.488   1.235
  629    HE   ARG  90           HE       ARG  90  12.446   6.820  -0.537
  630   1HH1  ARG  90          1HH1      ARG  90  14.139   7.723   2.394
  631   2HH1  ARG  90          2HH1      ARG  90  15.431   8.533   1.567
  632   1HH2  ARG  90          1HH2      ARG  90  14.116   7.915  -1.640
  633   2HH2  ARG  90          2HH2      ARG  90  15.418   8.648  -0.744
  634    H    LEU  91           H        LEU  91   9.496   9.703   3.000
  635    HA   LEU  91           HA       LEU  91  11.973  10.986   3.603
  636   1HB   LEU  91          2HB       LEU  91   9.501  12.419   2.663
  637   2HB   LEU  91          1HB       LEU  91  11.174  12.829   2.352
  638    HG   LEU  91           HG       LEU  91   9.727  10.452   1.208
  639   1HD1  LEU  91          1HD1      LEU  91  10.518  13.068  -0.067
  640   2HD1  LEU  91          2HD1      LEU  91   8.877  12.562   0.325
  641   3HD1  LEU  91          3HD1      LEU  91   9.799  11.691  -0.899
  642   1HD2  LEU  91          1HD2      LEU  91  12.122  10.065   1.456
  643   2HD2  LEU  91          2HD2      LEU  91  12.466  11.587   0.635
  644   3HD2  LEU  91          3HD2      LEU  91  11.699  10.265  -0.245
  645    H    ARG  92           H        ARG  92   8.941  10.807   5.137
  646    HA   ARG  92           HA       ARG  92   9.191  13.365   6.475
  647   1HB   ARG  92          2HB       ARG  92   7.023  11.354   6.921
  648   2HB   ARG  92          1HB       ARG  92   6.954  13.105   7.096
  649   1HG   ARG  92          2HG       ARG  92   6.981  13.431   4.754
  650   2HG   ARG  92          1HG       ARG  92   7.374  11.734   4.461
  651   1HD   ARG  92          2HD       ARG  92   4.794  12.966   5.289
  652   2HD   ARG  92          1HD       ARG  92   5.125  11.783   4.025
  653    HE   ARG  92           HE       ARG  92   5.754  10.545   6.403
  654   1HH1  ARG  92          1HH1      ARG  92   2.931  11.906   4.837
  655   2HH1  ARG  92          2HH1      ARG  92   1.788  10.989   5.771
  656   1HH2  ARG  92          1HH2      ARG  92   4.231   9.325   7.656
  657   2HH2  ARG  92          2HH2      ARG  92   2.529   9.493   7.345
  658    H    GLN  93           H        GLN  93   8.851   9.943   7.297
  659    HA   GLN  93           HA       GLN  93   9.395  10.675  10.049
  660   1HB   GLN  93          2HB       GLN  93   8.158   8.903  10.739
  661   2HB   GLN  93          1HB       GLN  93   7.446   9.162   9.151
  662   1HG   GLN  93          2HG       GLN  93   9.605   7.146   9.704
  663   2HG   GLN  93          1HG       GLN  93   7.880   6.789   9.763
  664   1HE2  GLN  93          1HE2      GLN  93   6.680   6.895   7.852
  665   2HE2  GLN  93          2HE2      GLN  93   7.446   6.788   6.303
  666    H    GLY  94           H        GLY  94  10.960   8.972   7.441
  667   1HA   GLY  94          2HA       GLY  94  13.242   8.479   7.303
  668   2HA   GLY  94          1HA       GLY  94  13.413   8.977   8.987
  669    H    TRP  95           H        TRP  95  11.404   6.566   7.403
  670    HA   TRP  95           HA       TRP  95  11.191   4.337   7.597
  671   1HB   TRP  95          2HB       TRP  95  14.002   4.083   8.614
  672   2HB   TRP  95          1HB       TRP  95  13.107   3.013   7.531
  673    HD1  TRP  95           HD       TRP  95  14.851   6.441   7.491
  674    HE1  TRP  95           1HE      TRP  95  15.602   6.933   5.101
  675    HE3  TRP  95           3HE      TRP  95  12.786   2.398   5.144
  676    HZ2  TRP  95           2HZ      TRP  95  15.428   5.759   2.587
  677    HZ3  TRP  95           3HZ      TRP  95  13.135   2.166   2.718
  678    HH2  TRP  95           HH       TRP  95  14.420   3.820   1.464
  679    H    GLY  96           H        GLY  96  10.887   6.176   9.963
  680   1HA   GLY  96          2HA       GLY  96  11.249   4.478  12.247
  681   2HA   GLY  96          1HA       GLY  96  10.296   5.954  12.189
  682    H    ALA  97           H        ALA  97   8.918   4.706   9.759
  683    HA   ALA  97           HA       ALA  97   6.846   3.315  11.240
  684   1HB   ALA  97          1HB       ALA  97   6.200   5.007   9.593
  685   2HB   ALA  97          2HB       ALA  97   5.574   3.417   9.151
  686   3HB   ALA  97          3HB       ALA  97   6.984   4.072   8.318
  687    H    TRP  98           H        TRP  98   9.504   2.639   9.188
  688    HA   TRP  98           HA       TRP  98   8.667  -0.161   8.909
  689   1HB   TRP  98          2HB       TRP  98  10.663   1.466   7.319
  690   2HB   TRP  98          1HB       TRP  98  10.342  -0.250   7.072
  691    HD1  TRP  98           HD       TRP  98   7.871  -0.894   6.145
  692    HE1  TRP  98           1HE      TRP  98   6.255   0.434   4.643
  693    HE3  TRP  98           3HE      TRP  98   9.864   3.784   6.741
  694    HZ2  TRP  98           2HZ      TRP  98   5.888   3.129   3.804
  695    HZ3  TRP  98           3HZ      TRP  98   8.838   5.663   5.572
  696    HH2  TRP  98           HH       TRP  98   6.886   5.344   4.139
  697    HA   PRO  99           HA       PRO  99  11.552  -0.631  12.285
  698   1HB   PRO  99          2HB       PRO  99  10.847  -3.480  11.770
  699   2HB   PRO  99          1HB       PRO  99  10.800  -2.564  13.282
  700   1HG   PRO  99          2HG       PRO  99   8.545  -3.115  12.044
  701   2HG   PRO  99          1HG       PRO  99   8.812  -1.485  12.702
  702   1HD   PRO  99          2HD       PRO  99   9.094  -2.436   9.866
  703   2HD   PRO  99          1HD       PRO  99   8.269  -0.985  10.484
  704    H    VAL 100           H        VAL 100  12.601  -3.529  12.131
  705    HA   VAL 100           HA       VAL 100  15.178  -2.971  11.252
  706    HB   VAL 100           HB       VAL 100  13.936  -5.722  11.333
  707   1HG1  VAL 100          1HG1      VAL 100  16.209  -6.451  11.898
  708   2HG1  VAL 100          2HG1      VAL 100  16.779  -4.791  11.730
  709   3HG1  VAL 100          3HG1      VAL 100  16.152  -5.655  10.327
  710   1HG2  VAL 100          1HG2      VAL 100  14.661  -5.819  13.681
  711   2HG2  VAL 100          2HG2      VAL 100  13.433  -4.580  13.415
  712   3HG2  VAL 100          3HG2      VAL 100  15.126  -4.119  13.594
  713    H    CYS 101           H        CYS 101  12.385  -3.935   9.476
  714    HA   CYS 101           HA       CYS 101  13.432  -5.068   7.183
  715   1HB   CYS 101          2HB       CYS 101  11.112  -3.129   7.368
  716   2HB   CYS 101          1HB       CYS 101  11.429  -4.228   6.027
  717    H    ALA 102           H        ALA 102  13.237  -1.659   8.104
  718    HA   ALA 102           HA       ALA 102  14.020  -0.633   5.566
  719   1HB   ALA 102          1HB       ALA 102  14.214   0.658   8.288
  720   2HB   ALA 102          2HB       ALA 102  12.814   0.720   7.217
  721   3HB   ALA 102          3HB       ALA 102  14.329   1.483   6.733
  722    H    ALA 103           H        ALA 103  15.771  -1.286   8.583
  723    HA   ALA 103           HA       ALA 103  18.292  -0.393   7.699
  724   1HB   ALA 103          1HB       ALA 103  17.683  -2.494   9.778
  725   2HB   ALA 103          2HB       ALA 103  17.743  -0.756  10.066
  726   3HB   ALA 103          3HB       ALA 103  19.203  -1.621   9.589
  727    H    ARG 104           H        ARG 104  16.641  -3.467   7.483
  728    HA   ARG 104           HA       ARG 104  18.810  -4.960   6.414
  729   1HB   ARG 104          2HB       ARG 104  15.818  -5.363   6.368
  730   2HB   ARG 104          1HB       ARG 104  16.951  -6.526   5.691
  731   1HG   ARG 104          2HG       ARG 104  17.060  -5.621   8.552
  732   2HG   ARG 104          1HG       ARG 104  16.084  -6.988   8.014
  733   1HD   ARG 104          2HD       ARG 104  18.102  -7.915   8.783
  734   2HD   ARG 104          1HD       ARG 104  18.212  -7.938   7.026
  735    HE   ARG 104           HE       ARG 104  19.394  -5.619   8.268
  736   1HH1  ARG 104          1HH1      ARG 104  19.911  -8.886   7.109
  737   2HH1  ARG 104          2HH1      ARG 104  21.642  -8.706   7.027
  738   1HH2  ARG 104          1HH2      ARG 104  21.647  -5.381   8.158
  739   2HH2  ARG 104          2HH2      ARG 104  22.627  -6.724   7.642
  740    H    ALA 105           H        ALA 105  16.406  -2.856   5.034
  741    HA   ALA 105           HA       ALA 105  16.768  -3.883   2.339
  742   1HB   ALA 105          1HB       ALA 105  14.991  -2.330   1.756
  743   2HB   ALA 105          2HB       ALA 105  15.039  -1.657   3.387
  744   3HB   ALA 105          3HB       ALA 105  14.544  -3.333   3.138
  745    H    GLY 106           H        GLY 106  17.949  -1.247   4.270
  746   1HA   GLY 106          2HA       GLY 106  19.955  -0.115   3.423
  747   2HA   GLY 106          1HA       GLY 106  19.191  -0.100   1.844
  748    H    ALA 107           H        ALA 107  18.396   0.926   5.144
  749    HA   ALA 107           HA       ALA 107  16.575   2.939   4.355
  750   1HB   ALA 107          1HB       ALA 107  16.440   1.818   6.517
  751   2HB   ALA 107          2HB       ALA 107  16.570   3.568   6.712
  752   3HB   ALA 107          3HB       ALA 107  17.976   2.542   6.993
  753    H    ARG 108           H        ARG 108  16.736   5.210   4.646
  754    HA   ARG 108           HA       ARG 108  17.668   7.258   4.521
  755   1HB   ARG 108          2HB       ARG 108  20.295   6.107   5.434
  756   2HB   ARG 108          1HB       ARG 108  19.649   7.722   5.709
  757   1HG   ARG 108          2HG       ARG 108  18.297   5.285   6.797
  758   2HG   ARG 108          1HG       ARG 108  19.632   6.066   7.665
  759   1HD   ARG 108          2HD       ARG 108  18.308   8.202   7.548
  760   2HD   ARG 108          1HD       ARG 108  16.962   7.253   6.911
  761    HE   ARG 108           HE       ARG 108  17.794   6.022   9.269
  762   1HH1  ARG 108          1HH1      ARG 108  16.321   9.044   8.253
  763   2HH1  ARG 108          2HH1      ARG 108  15.575   9.334   9.796
  764   1HH2  ARG 108          1HH2      ARG 108  16.804   6.405  11.282
  765   2HH2  ARG 108          2HH2      ARG 108  15.840   7.836  11.520
  Start of MODEL   24
    1   1H    ASN   1          1HT       ASN   1  55.426 -15.987   8.609
    2   2H    ASN   1          2HT       ASN   1  56.249 -16.267   7.155
    3   3H    ASN   1          3HT       ASN   1  54.771 -17.046   7.457
    4    HA   ASN   1           HA       ASN   1  55.146 -14.126   7.144
    5   1HB   ASN   1          2HB       ASN   1  54.221 -16.265   5.255
    6   2HB   ASN   1          1HB       ASN   1  53.623 -14.617   5.099
    7   1HD2  ASN   1          1HD2      ASN   1  55.329 -16.260   3.326
    8   2HD2  ASN   1          2HD2      ASN   1  56.763 -15.310   3.072
    9    H    VAL   2           H        VAL   2  53.826 -13.253   8.573
   10    HA   VAL   2           HA       VAL   2  51.162 -14.367   8.975
   11    HB   VAL   2           HB       VAL   2  52.545 -13.569  10.918
   12   1HG1  VAL   2          1HG1      VAL   2  53.537 -11.600   9.918
   13   2HG1  VAL   2          2HG1      VAL   2  52.643 -11.165  11.376
   14   3HG1  VAL   2          3HG1      VAL   2  51.949 -10.844   9.787
   15   1HG2  VAL   2          1HG2      VAL   2  50.130 -13.856  11.107
   16   2HG2  VAL   2          2HG2      VAL   2  49.882 -12.203  10.547
   17   3HG2  VAL   2          3HG2      VAL   2  50.686 -12.502  12.088
   18    H    VAL   3           H        VAL   3  52.776 -12.123   7.087
   19    HA   VAL   3           HA       VAL   3  50.802 -10.195   6.644
   20    HB   VAL   3           HB       VAL   3  53.119  -9.801   6.027
   21   1HG1  VAL   3          1HG1      VAL   3  54.159 -10.909   4.122
   22   2HG1  VAL   3          2HG1      VAL   3  52.730 -11.921   3.922
   23   3HG1  VAL   3          3HG1      VAL   3  53.720 -12.073   5.373
   24   1HG2  VAL   3          1HG2      VAL   3  51.437  -8.526   4.830
   25   2HG2  VAL   3          2HG2      VAL   3  51.301  -9.801   3.621
   26   3HG2  VAL   3          3HG2      VAL   3  52.799  -8.885   3.769
   27    H    VAL   4           H        VAL   4  49.155 -10.065   5.160
   28    HA   VAL   4           HA       VAL   4  48.622 -12.495   3.573
   29    HB   VAL   4           HB       VAL   4  46.585 -10.441   4.418
   30   1HG1  VAL   4          1HG1      VAL   4  44.955 -12.171   3.804
   31   2HG1  VAL   4          2HG1      VAL   4  46.276 -13.207   3.267
   32   3HG1  VAL   4          3HG1      VAL   4  45.958 -11.684   2.438
   33   1HG2  VAL   4          1HG2      VAL   4  47.465 -11.524   6.408
   34   2HG2  VAL   4          2HG2      VAL   4  47.183 -13.107   5.687
   35   3HG2  VAL   4          3HG2      VAL   4  45.817 -12.067   6.090
   36    H    THR   5           H        THR   5  47.960 -12.233   1.451
   37    HA   THR   5           HA       THR   5  48.476  -9.569   0.306
   38    HB   THR   5           HB       THR   5  49.277 -10.869  -1.750
   39    HG1  THR   5           1HG      THR   5  48.450 -12.919  -0.594
   40   1HG2  THR   5          1HG2      THR   5  51.548 -11.143  -0.859
   41   2HG2  THR   5          2HG2      THR   5  50.915 -11.021   0.783
   42   3HG2  THR   5          3HG2      THR   5  50.815  -9.637  -0.306
   43    HA   PRO   6           HA       PRO   6  44.269 -10.576  -1.023
   44   1HB   PRO   6          2HB       PRO   6  43.464  -8.092  -1.477
   45   2HB   PRO   6          1HB       PRO   6  43.611  -8.730   0.166
   46   1HG   PRO   6          2HG       PRO   6  45.523  -7.016  -1.374
   47   2HG   PRO   6          1HG       PRO   6  44.978  -6.827   0.305
   48   1HD   PRO   6          2HD       PRO   6  47.349  -7.978  -0.357
   49   2HD   PRO   6          1HD       PRO   6  46.419  -8.462   1.076
   50    H    ALA   7           H        ALA   7  44.760 -11.515  -2.819
   51    HA   ALA   7           HA       ALA   7  44.458 -10.160  -5.314
   52   1HB   ALA   7          1HB       ALA   7  46.611 -10.878  -6.281
   53   2HB   ALA   7          2HB       ALA   7  47.117 -11.446  -4.689
   54   3HB   ALA   7          3HB       ALA   7  46.833  -9.728  -4.962
   55    H    HIS   8           H        HIS   8  45.437 -12.088  -7.007
   56    HA   HIS   8           HA       HIS   8  44.849 -14.041  -7.990
   57   1HB   HIS   8          2HB       HIS   8  45.706 -15.042  -5.859
   58   2HB   HIS   8          1HB       HIS   8  44.070 -14.977  -5.221
   59    HD1  HIS   8           1HD      HIS   8  46.266 -16.939  -7.512
   60    HD2  HIS   8           2HD      HIS   8  42.298 -16.880  -6.274
   61    HE1  HIS   8           1HE      HIS   8  45.251 -19.128  -8.266
   62    H    GLU   9           H        GLU   9  42.788 -12.042  -6.303
   63    HA   GLU   9           HA       GLU   9  40.310 -13.390  -6.729
   64   1HB   GLU   9          2HB       GLU   9  39.276 -11.245  -6.143
   65   2HB   GLU   9          1HB       GLU   9  40.536 -11.685  -5.000
   66   1HG   GLU   9          2HG       GLU   9  42.078 -10.165  -6.215
   67   2HG   GLU   9          1HG       GLU   9  40.711  -9.653  -7.205
   68    H    ALA  10           H        ALA  10  38.857 -13.225  -8.347
   69    HA   ALA  10           HA       ALA  10  39.447 -11.534 -10.640
   70   1HB   ALA  10          1HB       ALA  10  40.658 -13.592 -11.131
   71   2HB   ALA  10          2HB       ALA  10  39.274 -13.416 -12.209
   72   3HB   ALA  10          3HB       ALA  10  39.195 -14.535 -10.850
   73    H    VAL  11           H        VAL  11  37.589 -10.524  -9.759
   74    HA   VAL  11           HA       VAL  11  35.046 -11.744  -9.708
   75    HB   VAL  11           HB       VAL  11  35.717  -8.853 -10.107
   76   1HG1  VAL  11          1HG1      VAL  11  33.461  -8.399  -9.283
   77   2HG1  VAL  11          2HG1      VAL  11  33.146 -10.131  -9.198
   78   3HG1  VAL  11          3HG1      VAL  11  33.424  -9.362 -10.759
   79   1HG2  VAL  11          1HG2      VAL  11  35.306  -8.642  -7.686
   80   2HG2  VAL  11          2HG2      VAL  11  36.690  -9.667  -8.060
   81   3HG2  VAL  11          3HG2      VAL  11  35.156 -10.399  -7.588
   82    H    VAL  12           H        VAL  12  36.506  -9.538 -12.037
   83    HA   VAL  12           HA       VAL  12  35.800  -8.895 -14.100
   84    HB   VAL  12           HB       VAL  12  36.825 -11.665 -14.192
   85   1HG1  VAL  12          1HG1      VAL  12  35.709 -11.245 -16.325
   86   2HG1  VAL  12          2HG1      VAL  12  37.459 -11.245 -16.554
   87   3HG1  VAL  12          3HG1      VAL  12  36.574  -9.719 -16.486
   88   1HG2  VAL  12          1HG2      VAL  12  38.305 -10.076 -13.172
   89   2HG2  VAL  12          2HG2      VAL  12  38.146  -8.999 -14.558
   90   3HG2  VAL  12          3HG2      VAL  12  38.953 -10.557 -14.743
   91    H    ARG  13           H        ARG  13  33.591  -8.699 -13.765
   92    HA   ARG  13           HA       ARG  13  32.053 -10.428 -15.484
   93   1HB   ARG  13          2HB       ARG  13  30.261 -10.616 -13.885
   94   2HB   ARG  13          1HB       ARG  13  31.762 -11.152 -13.142
   95   1HG   ARG  13          2HG       ARG  13  31.982  -9.016 -12.006
   96   2HG   ARG  13          1HG       ARG  13  30.470  -8.476 -12.736
   97   1HD   ARG  13          2HD       ARG  13  29.277 -10.273 -11.603
   98   2HD   ARG  13          1HD       ARG  13  30.789 -10.830 -10.885
   99    HE   ARG  13           HE       ARG  13  30.453  -8.129 -10.242
  100   1HH1  ARG  13          1HH1      ARG  13  29.004 -11.248  -9.549
  101   2HH1  ARG  13          2HH1      ARG  13  28.397 -10.761  -7.990
  102   1HH2  ARG  13          1HH2      ARG  13  29.683  -7.496  -8.186
  103   2HH2  ARG  13          2HH2      ARG  13  28.811  -8.638  -7.208
  104    H    VAL  14           H        VAL  14  30.934  -9.252 -16.887
  105    HA   VAL  14           HA       VAL  14  30.079  -6.553 -16.154
  106    HB   VAL  14           HB       VAL  14  30.755  -7.336 -18.957
  107   1HG1  VAL  14          1HG1      VAL  14  30.640  -4.654 -17.597
  108   2HG1  VAL  14          2HG1      VAL  14  29.407  -5.335 -18.657
  109   3HG1  VAL  14          3HG1      VAL  14  30.999  -4.930 -19.301
  110   1HG2  VAL  14          1HG2      VAL  14  32.959  -6.266 -18.707
  111   2HG2  VAL  14          2HG2      VAL  14  32.802  -7.720 -17.719
  112   3HG2  VAL  14          3HG2      VAL  14  32.670  -6.124 -16.974
  113    H    GLY  15           H        GLY  15  28.217  -5.862 -17.365
  114   1HA   GLY  15          2HA       GLY  15  26.601  -6.807 -19.097
  115   2HA   GLY  15          1HA       GLY  15  26.420  -8.099 -17.925
  116    H    THR  16           H        THR  16  25.512  -4.932 -18.838
  117    HA   THR  16           HA       THR  16  24.114  -4.312 -16.423
  118    HB   THR  16           HB       THR  16  23.783  -3.066 -19.147
  119    HG1  THR  16           1HG      THR  16  25.977  -2.979 -18.567
  120   1HG2  THR  16          1HG2      THR  16  22.079  -2.457 -17.516
  121   2HG2  THR  16          2HG2      THR  16  23.131  -1.089 -17.865
  122   3HG2  THR  16          3HG2      THR  16  23.333  -1.995 -16.367
  123    H    LYS  17           H        LYS  17  23.347  -5.425 -19.611
  124    HA   LYS  17           HA       LYS  17  21.468  -6.198 -20.618
  125   1HB   LYS  17          2HB       LYS  17  21.835  -7.795 -18.132
  126   2HB   LYS  17          1HB       LYS  17  20.489  -8.154 -19.205
  127   1HG   LYS  17          2HG       LYS  17  22.246  -9.598 -19.829
  128   2HG   LYS  17          1HG       LYS  17  22.168  -8.343 -21.065
  129   1HD   LYS  17          2HD       LYS  17  24.006  -7.154 -19.882
  130   2HD   LYS  17          1HD       LYS  17  24.143  -8.540 -18.800
  131   1HE   LYS  17          2HE       LYS  17  24.483  -8.611 -21.796
  132   2HE   LYS  17          1HE       LYS  17  25.795  -8.606 -20.619
  133   1HZ   LYS  17          1HZ       LYS  17  25.007 -10.714 -19.763
  134   2HZ   LYS  17          2HZ       LYS  17  25.307 -10.834 -21.428
  135   3HZ   LYS  17          3HZ       LYS  17  23.715 -10.715 -20.865
  136    HA   PRO  18           HA       PRO  18  18.032  -4.060 -18.428
  137   1HB   PRO  18          2HB       PRO  18  18.077  -1.955 -20.357
  138   2HB   PRO  18          1HB       PRO  18  18.390  -1.837 -18.624
  139   1HG   PRO  18          2HG       PRO  18  20.266  -1.422 -20.582
  140   2HG   PRO  18          1HG       PRO  18  20.634  -1.872 -18.911
  141   1HD   PRO  18          2HD       PRO  18  20.514  -3.596 -21.355
  142   2HD   PRO  18          1HD       PRO  18  21.667  -3.645 -20.002
  143    H    GLY  19           H        GLY  19  15.989  -3.688 -19.400
  144   1HA   GLY  19          2HA       GLY  19  14.389  -3.907 -21.155
  145   2HA   GLY  19          1HA       GLY  19  15.631  -4.699 -22.129
  146    H    THR  20           H        THR  20  16.619  -6.463 -20.394
  147    HA   THR  20           HA       THR  20  14.748  -8.565 -20.140
  148    HB   THR  20           HB       THR  20  17.390  -8.171 -18.710
  149    HG1  THR  20           1HG      THR  20  17.102  -9.739 -21.045
  150   1HG2  THR  20          1HG2      THR  20  15.810 -10.652 -19.356
  151   2HG2  THR  20          2HG2      THR  20  16.031  -9.932 -17.760
  152   3HG2  THR  20          3HG2      THR  20  17.409 -10.619 -18.620
  153    H    GLU  21           H        GLU  21  16.183  -6.257 -17.892
  154    HA   GLU  21           HA       GLU  21  14.040  -6.804 -15.988
  155   1HB   GLU  21          2HB       GLU  21  16.835  -5.771 -15.502
  156   2HB   GLU  21          1HB       GLU  21  15.576  -5.806 -14.277
  157   1HG   GLU  21          2HG       GLU  21  15.489  -8.205 -14.374
  158   2HG   GLU  21          1HG       GLU  21  16.647  -8.223 -15.704
  159    H    VAL  22           H        VAL  22  12.545  -5.290 -16.158
  160    HA   VAL  22           HA       VAL  22  13.065  -2.632 -17.075
  161    HB   VAL  22           HB       VAL  22  10.644  -3.680 -15.583
  162   1HG1  VAL  22          1HG1      VAL  22  10.774  -1.252 -15.546
  163   2HG1  VAL  22          2HG1      VAL  22   9.467  -1.780 -16.606
  164   3HG1  VAL  22          3HG1      VAL  22  10.990  -1.219 -17.296
  165   1HG2  VAL  22          1HG2      VAL  22   9.614  -3.934 -17.792
  166   2HG2  VAL  22          2HG2      VAL  22  11.041  -4.957 -17.617
  167   3HG2  VAL  22          3HG2      VAL  22  11.135  -3.465 -18.552
  168    HA   PRO  23           HA       PRO  23  15.055  -1.377 -13.352
  169   1HB   PRO  23          2HB       PRO  23  14.215   1.341 -14.210
  170   2HB   PRO  23          1HB       PRO  23  15.822   0.738 -13.796
  171   1HG   PRO  23          2HG       PRO  23  15.110   1.175 -16.338
  172   2HG   PRO  23          1HG       PRO  23  16.164  -0.178 -15.888
  173   1HD   PRO  23          2HD       PRO  23  13.293  -0.170 -16.651
  174   2HD   PRO  23          1HD       PRO  23  14.539  -1.396 -16.949
  175    HA   PRO  24           HA       PRO  24  11.626  -0.961 -10.470
  176   1HB   PRO  24          2HB       PRO  24  13.382  -0.639  -8.347
  177   2HB   PRO  24          1HB       PRO  24  12.775  -2.193  -8.936
  178   1HG   PRO  24          2HG       PRO  24  15.343  -0.796  -9.580
  179   2HG   PRO  24          1HG       PRO  24  15.059  -2.514  -9.226
  180   1HD   PRO  24          2HD       PRO  24  15.366  -1.739 -11.729
  181   2HD   PRO  24          1HD       PRO  24  14.086  -2.896 -11.313
  182    H    VAL  25           H        VAL  25  11.019   0.671  -8.947
  183    HA   VAL  25           HA       VAL  25  11.734   3.297  -9.817
  184    HB   VAL  25           HB       VAL  25   9.769   2.392  -7.665
  185   1HG1  VAL  25          1HG1      VAL  25  10.607   4.673  -7.218
  186   2HG1  VAL  25          2HG1      VAL  25   8.917   4.682  -7.716
  187   3HG1  VAL  25          3HG1      VAL  25  10.174   5.147  -8.862
  188   1HG2  VAL  25          1HG2      VAL  25   9.351   3.402 -10.478
  189   2HG2  VAL  25          2HG2      VAL  25   8.081   3.005  -9.318
  190   3HG2  VAL  25          3HG2      VAL  25   9.150   1.740  -9.925
  191    H    ILE  26           H        ILE  26  12.278   4.963  -8.079
  192    HA   ILE  26           HA       ILE  26  14.971   4.436  -7.862
  193    HB   ILE  26           HB       ILE  26  13.472   6.617  -6.415
  194   1HG1  ILE  26          2HG1      ILE  26  12.922   6.574  -8.796
  195   2HG1  ILE  26          1HG1      ILE  26  13.924   7.971  -8.421
  196   1HG2  ILE  26          1HG2      ILE  26  15.576   7.878  -6.617
  197   2HG2  ILE  26          2HG2      ILE  26  16.356   6.447  -7.290
  198   3HG2  ILE  26          3HG2      ILE  26  15.760   6.428  -5.630
  199   1HD1  ILE  26          1HD1      ILE  26  14.865   5.413  -9.698
  200   2HD1  ILE  26          2HD1      ILE  26  15.875   6.806  -9.318
  201   3HD1  ILE  26          3HD1      ILE  26  14.590   6.950 -10.518
  202    H    ASP  27           H        ASP  27  12.598   3.817  -5.442
  203    HA   ASP  27           HA       ASP  27  14.747   3.140  -3.571
  204   1HB   ASP  27          2HB       ASP  27  12.174   4.557  -2.908
  205   2HB   ASP  27          1HB       ASP  27  13.150   3.734  -1.698
  206    H    GLY  28           H        GLY  28  12.898   1.807  -5.549
  207   1HA   GLY  28          2HA       GLY  28  11.098   0.181  -4.087
  208   2HA   GLY  28          1HA       GLY  28  11.653  -0.102  -5.733
  209    H    SER  29           H        SER  29  14.406   0.229  -4.189
  210    HA   SER  29           HA       SER  29  14.891  -2.598  -3.985
  211   1HB   SER  29          2HB       SER  29  16.636  -0.411  -2.899
  212   2HB   SER  29          1HB       SER  29  17.125  -2.007  -3.457
  213    HG   SER  29           HG       SER  29  17.542  -0.217  -4.943
  214    H    ILE  30           H        ILE  30  14.630   0.090  -1.798
  215    HA   ILE  30           HA       ILE  30  14.947  -1.391   0.610
  216    HB   ILE  30           HB       ILE  30  13.344   0.989   1.016
  217   1HG1  ILE  30          2HG1      ILE  30  14.358   1.732  -1.145
  218   2HG1  ILE  30          1HG1      ILE  30  14.852   2.710   0.228
  219   1HG2  ILE  30          1HG2      ILE  30  15.220   1.638   2.436
  220   2HG2  ILE  30          2HG2      ILE  30  16.165   0.298   1.784
  221   3HG2  ILE  30          3HG2      ILE  30  14.703  -0.026   2.715
  222   1HD1  ILE  30          1HD1      ILE  30  16.707   2.286  -1.280
  223   2HD1  ILE  30          2HD1      ILE  30  16.500   0.547  -1.058
  224   3HD1  ILE  30          3HD1      ILE  30  16.990   1.558   0.302
  225    H    TRP  31           H        TRP  31  12.307  -0.320  -1.389
  226    HA   TRP  31           HA       TRP  31  10.245  -1.032   0.431
  227   1HB   TRP  31          2HB       TRP  31  10.199  -0.420  -2.529
  228   2HB   TRP  31          1HB       TRP  31   8.750  -0.716  -1.565
  229    HD1  TRP  31           HD       TRP  31  10.118   2.144  -2.941
  230    HE1  TRP  31           1HE      TRP  31   9.945   4.249  -1.447
  231    HE3  TRP  31           3HE      TRP  31   9.282  -0.147   1.467
  232    HZ2  TRP  31           2HZ      TRP  31   9.556   4.809   1.282
  233    HZ3  TRP  31           3HZ      TRP  31   9.032   1.213   3.500
  234    HH2  TRP  31           HH       TRP  31   9.166   3.643   3.402
  235    H    ASP  32           H        ASP  32  11.870  -2.680  -2.218
  236    HA   ASP  32           HA       ASP  32  10.110  -4.915  -2.214
  237   1HB   ASP  32          2HB       ASP  32  11.265  -4.596  -4.219
  238   2HB   ASP  32          1HB       ASP  32  12.810  -4.338  -3.394
  239    H    ALA  33           H        ALA  33  13.214  -4.154  -0.652
  240    HA   ALA  33           HA       ALA  33  13.537  -6.738   0.432
  241   1HB   ALA  33          1HB       ALA  33  15.259  -5.747   1.839
  242   2HB   ALA  33          2HB       ALA  33  14.718  -4.134   1.376
  243   3HB   ALA  33          3HB       ALA  33  15.419  -5.210   0.167
  244    H    ILE  34           H        ILE  34  12.025  -3.763   1.632
  245    HA   ILE  34           HA       ILE  34  11.398  -4.785   4.212
  246    HB   ILE  34           HB       ILE  34  10.061  -2.629   2.592
  247   1HG1  ILE  34          2HG1      ILE  34  11.964  -2.494   4.947
  248   2HG1  ILE  34          1HG1      ILE  34  12.396  -2.183   3.270
  249   1HG2  ILE  34          1HG2      ILE  34   8.465  -3.538   4.187
  250   2HG2  ILE  34          2HG2      ILE  34   8.981  -1.930   4.693
  251   3HG2  ILE  34          3HG2      ILE  34   9.638  -3.358   5.491
  252   1HD1  ILE  34          1HD1      ILE  34  10.455  -0.577   4.911
  253   2HD1  ILE  34          2HD1      ILE  34  10.906  -0.260   3.236
  254   3HD1  ILE  34          3HD1      ILE  34  12.112  -0.121   4.516
  255    H    ALA  35           H        ALA  35   9.570  -4.669   1.165
  256    HA   ALA  35           HA       ALA  35   7.246  -5.937   2.085
  257   1HB   ALA  35          1HB       ALA  35   6.794  -6.456  -0.252
  258   2HB   ALA  35          2HB       ALA  35   8.460  -6.065  -0.671
  259   3HB   ALA  35          3HB       ALA  35   7.381  -4.803  -0.079
  260    H    GLY  36           H        GLY  36  10.350  -7.162   1.081
  261   1HA   GLY  36          2HA       GLY  36   9.542  -9.934   1.048
  262   2HA   GLY  36          1HA       GLY  36  11.192  -9.323   0.987
  263    H    CYS  37           H        CYS  37  10.558  -7.675   3.410
  264    HA   CYS  37           HA       CYS  37  11.496  -9.564   5.330
  265   1HB   CYS  37          2HB       CYS  37  12.354  -7.288   5.334
  266   2HB   CYS  37          1HB       CYS  37  10.733  -6.650   5.574
  267    H    GLU  38           H        GLU  38   8.575  -7.523   5.131
  268    HA   GLU  38           HA       GLU  38   7.539  -8.873   7.488
  269   1HB   GLU  38          2HB       GLU  38   6.385  -6.530   5.970
  270   2HB   GLU  38          1HB       GLU  38   5.830  -7.139   7.527
  271   1HG   GLU  38          2HG       GLU  38   8.286  -6.697   8.261
  272   2HG   GLU  38          1HG       GLU  38   8.313  -5.632   6.858
  273    H    ALA  39           H        ALA  39   6.914  -8.607   4.059
  274    HA   ALA  39           HA       ALA  39   4.506 -10.202   4.411
  275   1HB   ALA  39          1HB       ALA  39   5.435  -8.753   1.958
  276   2HB   ALA  39          2HB       ALA  39   4.235  -8.168   3.110
  277   3HB   ALA  39          3HB       ALA  39   3.903  -9.605   2.143
  278    H    GLY  40           H        GLY  40   7.732 -10.503   3.443
  279   1HA   GLY  40          2HA       GLY  40   8.871 -12.428   2.786
  280   2HA   GLY  40          1HA       GLY  40   7.321 -13.260   2.649
  281    H    GLY  41           H        GLY  41   7.287 -10.262   1.241
  282   1HA   GLY  41          2HA       GLY  41   7.547  -9.494  -0.905
  283   2HA   GLY  41          1HA       GLY  41   8.124 -11.084  -1.412
  284    H    ASN  42           H        ASN  42   5.169  -9.545  -0.145
  285    HA   ASN  42           HA       ASN  42   3.615 -10.935  -2.200
  286   1HB   ASN  42          2HB       ASN  42   3.664 -12.118   0.153
  287   2HB   ASN  42          1HB       ASN  42   2.560 -10.826   0.607
  288   1HD2  ASN  42          1HD2      ASN  42   0.507 -10.766  -0.300
  289   2HD2  ASN  42          2HD2      ASN  42  -0.183 -12.131  -1.106
  290    H    TRP  43           H        TRP  43   3.315  -8.965  -3.222
  291    HA   TRP  43           HA       TRP  43   2.663  -6.589  -1.734
  292   1HB   TRP  43          2HB       TRP  43   2.658  -7.081  -4.711
  293   2HB   TRP  43          1HB       TRP  43   2.535  -5.508  -3.929
  294    HD1  TRP  43           HD       TRP  43   5.032  -8.469  -4.038
  295    HE1  TRP  43           1HE      TRP  43   7.427  -7.505  -3.975
  296    HE3  TRP  43           3HE      TRP  43   3.889  -3.520  -3.555
  297    HZ2  TRP  43           2HZ      TRP  43   8.669  -4.954  -3.735
  298    HZ3  TRP  43           3HZ      TRP  43   5.705  -1.875  -3.428
  299    HH2  TRP  43           HH       TRP  43   8.065  -2.606  -3.534
  300    H    ALA  44           H        ALA  44   0.900  -9.161  -2.899
  301    HA   ALA  44           HA       ALA  44  -1.563  -7.568  -3.159
  302   1HB   ALA  44          1HB       ALA  44  -1.074 -10.451  -3.908
  303   2HB   ALA  44          2HB       ALA  44  -1.080  -9.082  -5.021
  304   3HB   ALA  44          3HB       ALA  44  -2.563  -9.544  -4.183
  305    H    ILE  45           H        ILE  45  -0.036  -8.537  -0.676
  306    HA   ILE  45           HA       ILE  45  -1.788 -10.402   0.564
  307    HB   ILE  45           HB       ILE  45   0.728 -10.101   0.975
  308   1HG1  ILE  45          2HG1      ILE  45  -1.143 -10.260   3.337
  309   2HG1  ILE  45          1HG1      ILE  45  -0.754 -11.587   2.250
  310   1HG2  ILE  45          1HG2      ILE  45   1.306  -8.582   2.828
  311   2HG2  ILE  45          2HG2      ILE  45  -0.321  -7.905   2.753
  312   3HG2  ILE  45          3HG2      ILE  45   0.773  -7.724   1.382
  313   1HD1  ILE  45          1HD1      ILE  45   1.163 -10.160   4.075
  314   2HD1  ILE  45          2HD1      ILE  45   1.592 -11.449   2.951
  315   3HD1  ILE  45          3HD1      ILE  45   0.504 -11.779   4.301
  316    H    ASN  46           H        ASN  46  -3.325 -10.034   2.041
  317    HA   ASN  46           HA       ASN  46  -3.792  -7.372   3.110
  318   1HB   ASN  46          2HB       ASN  46  -4.972  -7.569   0.850
  319   2HB   ASN  46          1HB       ASN  46  -6.010  -8.768   1.611
  320   1HD2  ASN  46          1HD2      ASN  46  -6.442  -6.033   0.490
  321   2HD2  ASN  46          2HD2      ASN  46  -7.296  -5.182   1.732
  322    H    THR  47           H        THR  47  -3.450  -8.197   5.118
  323    HA   THR  47           HA       THR  47  -4.616 -10.651   5.991
  324    HB   THR  47           HB       THR  47  -3.736  -9.807   8.262
  325    HG1  THR  47           1HG      THR  47  -2.127  -8.108   7.943
  326   1HG2  THR  47          1HG2      THR  47  -2.563 -11.447   6.845
  327   2HG2  THR  47          2HG2      THR  47  -1.435 -10.368   7.665
  328   3HG2  THR  47          3HG2      THR  47  -1.805 -10.125   5.957
  329    H    GLY  48           H        GLY  48  -5.712  -7.436   5.821
  330   1HA   GLY  48          2HA       GLY  48  -7.941  -6.791   6.235
  331   2HA   GLY  48          1HA       GLY  48  -8.106  -8.156   7.334
  332    H    ASN  49           H        ASN  49  -5.297  -6.205   7.534
  333    HA   ASN  49           HA       ASN  49  -6.067  -5.417  10.215
  334   1HB   ASN  49          2HB       ASN  49  -3.454  -5.313   8.715
  335   2HB   ASN  49          1HB       ASN  49  -3.653  -4.606  10.313
  336   1HD2  ASN  49          1HD2      ASN  49  -2.147  -5.975  11.211
  337   2HD2  ASN  49          2HD2      ASN  49  -2.469  -7.650  11.495
  338    H    GLY  50           H        GLY  50  -6.581  -4.093   7.305
  339   1HA   GLY  50          2HA       GLY  50  -7.190  -1.901   6.762
  340   2HA   GLY  50          1HA       GLY  50  -6.539  -1.363   8.307
  341    H    TYR  51           H        TYR  51  -4.182  -3.206   7.364
  342    HA   TYR  51           HA       TYR  51  -2.849  -1.201   5.670
  343   1HB   TYR  51          2HB       TYR  51  -1.487  -3.246   7.443
  344   2HB   TYR  51          1HB       TYR  51  -0.730  -1.945   6.561
  345    HD1  TYR  51           1HD      TYR  51  -3.808  -1.155   8.351
  346    HD2  TYR  51           2HD      TYR  51   0.424  -1.343   8.610
  347    HE1  TYR  51           1HE      TYR  51  -3.877   0.214  10.403
  348    HE2  TYR  51           2HE      TYR  51   0.373   0.040  10.645
  349    HH   TYR  51           HH       TYR  51  -1.269   1.802  11.629
  350    H    TYR  52           H        TYR  52  -1.753  -2.012   3.824
  351    HA   TYR  52           HA       TYR  52  -2.303  -4.835   3.203
  352   1HB   TYR  52          2HB       TYR  52  -2.973  -2.974   1.013
  353   2HB   TYR  52          1HB       TYR  52  -3.731  -4.485   1.476
  354    HD1  TYR  52           1HD      TYR  52  -5.677  -4.512   2.794
  355    HD2  TYR  52           2HD      TYR  52  -3.559  -0.873   2.227
  356    HE1  TYR  52           1HE      TYR  52  -7.569  -3.273   3.755
  357    HE2  TYR  52           2HE      TYR  52  -5.441   0.391   3.203
  358    HH   TYR  52           HH       TYR  52  -7.924   0.037   3.459
  359    H    GLY  53           H        GLY  53  -1.278  -5.643   1.327
  360   1HA   GLY  53          2HA       GLY  53   0.100  -5.744  -0.481
  361   2HA   GLY  53          1HA       GLY  53   0.010  -4.000  -0.551
  362    H    GLY  54           H        GLY  54   1.940  -6.731   0.280
  363   1HA   GLY  54          2HA       GLY  54   4.218  -6.893   0.311
  364   2HA   GLY  54          1HA       GLY  54   4.233  -5.313  -0.443
  365    H    VAL  55           H        VAL  55   4.296  -3.439   0.921
  366    HA   VAL  55           HA       VAL  55   5.897  -3.872   3.299
  367    HB   VAL  55           HB       VAL  55   5.841  -1.318   3.390
  368   1HG1  VAL  55          1HG1      VAL  55   7.496  -1.083   1.590
  369   2HG1  VAL  55          2HG1      VAL  55   7.003  -2.649   0.941
  370   3HG1  VAL  55          3HG1      VAL  55   7.765  -2.551   2.529
  371   1HG2  VAL  55          1HG2      VAL  55   3.805  -1.116   1.973
  372   2HG2  VAL  55          2HG2      VAL  55   4.780  -1.617   0.592
  373   3HG2  VAL  55          3HG2      VAL  55   5.159  -0.120   1.442
  374    H    GLN  56           H        GLN  56   2.670  -3.594   2.548
  375    HA   GLN  56           HA       GLN  56   0.785  -3.662   3.791
  376   1HB   GLN  56          2HB       GLN  56   2.718  -4.722   5.846
  377   2HB   GLN  56          1HB       GLN  56   0.972  -4.925   5.879
  378   1HG   GLN  56          2HG       GLN  56   0.979  -6.376   4.059
  379   2HG   GLN  56          1HG       GLN  56   2.594  -5.878   3.551
  380   1HE2  GLN  56          1HE2      GLN  56   3.658  -5.938   6.234
  381   2HE2  GLN  56          2HE2      GLN  56   3.841  -7.612   6.652
  382    H    PHE  57           H        PHE  57   1.551  -1.050   3.785
  383    HA   PHE  57           HA       PHE  57   1.210  -0.329   6.599
  384   1HB   PHE  57          2HB       PHE  57   1.803   1.945   6.054
  385   2HB   PHE  57          1HB       PHE  57   3.072   0.824   5.609
  386    HD1  PHE  57           1HD      PHE  57   1.362   3.668   4.624
  387    HD2  PHE  57           2HD      PHE  57   2.911   0.038   3.039
  388    HE1  PHE  57           1HE      PHE  57   1.541   4.716   2.402
  389    HE2  PHE  57           2HE      PHE  57   3.090   1.077   0.817
  390    HZ   PHE  57           HZ       PHE  57   2.424   3.423   0.497
  391    H    ASP  58           H        ASP  58  -0.178   1.799   6.834
  392    HA   ASP  58           HA       ASP  58  -2.706   0.532   6.458
  393   1HB   ASP  58          2HB       ASP  58  -3.611   2.180   7.951
  394   2HB   ASP  58          1HB       ASP  58  -2.092   1.572   8.592
  395    H    GLN  59           H        GLN  59  -4.602   1.455   5.819
  396    HA   GLN  59           HA       GLN  59  -4.699   2.449   3.253
  397   1HB   GLN  59          2HB       GLN  59  -6.440   1.184   4.475
  398   2HB   GLN  59          1HB       GLN  59  -6.749   2.602   5.462
  399   1HG   GLN  59          2HG       GLN  59  -8.427   2.526   3.821
  400   2HG   GLN  59          1HG       GLN  59  -7.328   3.829   3.382
  401   1HE2  GLN  59          1HE2      GLN  59  -5.981   3.580   1.585
  402   2HE2  GLN  59          2HE2      GLN  59  -6.297   2.383   0.367
  403    H    GLY  60           H        GLY  60  -4.863   4.097   6.339
  404   1HA   GLY  60          2HA       GLY  60  -5.793   6.595   5.356
  405   2HA   GLY  60          1HA       GLY  60  -5.065   6.307   6.932
  406    H    THR  61           H        THR  61  -2.590   5.500   6.393
  407    HA   THR  61           HA       THR  61  -1.176   7.812   5.659
  408    HB   THR  61           HB       THR  61  -0.262   4.975   5.877
  409    HG1  THR  61           1HG      THR  61  -0.518   5.346   7.930
  410   1HG2  THR  61          1HG2      THR  61   1.315   6.332   4.578
  411   2HG2  THR  61          2HG2      THR  61   1.989   5.873   6.140
  412   3HG2  THR  61          3HG2      THR  61   1.372   7.505   5.893
  413    H    TRP  62           H        TRP  62  -1.882   4.825   3.918
  414    HA   TRP  62           HA       TRP  62  -0.515   5.277   1.541
  415   1HB   TRP  62          2HB       TRP  62  -1.641   3.178   2.052
  416   2HB   TRP  62          1HB       TRP  62  -3.197   4.001   2.082
  417    HD1  TRP  62           HD       TRP  62  -4.345   4.563  -0.238
  418    HE1  TRP  62           1HE      TRP  62  -3.954   3.677  -2.619
  419    HE3  TRP  62           3HE      TRP  62   0.231   2.392   0.454
  420    HZ2  TRP  62           2HZ      TRP  62  -1.962   2.248  -4.039
  421    HZ3  TRP  62           3HZ      TRP  62   1.320   1.291  -1.453
  422    HH2  TRP  62           HH       TRP  62   0.273   1.207  -3.649
  423    H    GLU  63           H        GLU  63  -3.776   6.170   2.518
  424    HA   GLU  63           HA       GLU  63  -4.483   7.566   0.195
  425   1HB   GLU  63          2HB       GLU  63  -6.156   6.793   1.710
  426   2HB   GLU  63          1HB       GLU  63  -5.464   7.705   3.042
  427   1HG   GLU  63          2HG       GLU  63  -6.041   9.793   1.801
  428   2HG   GLU  63          1HG       GLU  63  -6.897   8.787   0.631
  429    H    ALA  64           H        ALA  64  -2.856   8.516   3.149
  430    HA   ALA  64           HA       ALA  64  -3.086  11.320   2.847
  431   1HB   ALA  64          1HB       ALA  64  -1.319  11.455   4.535
  432   2HB   ALA  64          2HB       ALA  64  -1.014   9.726   4.352
  433   3HB   ALA  64          3HB       ALA  64  -2.560  10.288   4.991
  434    H    ASN  65           H        ASN  65  -0.576   9.005   1.893
  435    HA   ASN  65           HA       ASN  65   1.060  11.039   0.697
  436   1HB   ASN  65          2HB       ASN  65   1.227   8.041   0.346
  437   2HB   ASN  65          1HB       ASN  65   2.499   9.219   0.041
  438   1HD2  ASN  65          1HD2      ASN  65   1.921  10.778   2.433
  439   2HD2  ASN  65          2HD2      ASN  65   2.487   9.837   3.772
  440    H    GLY  66           H        GLY  66  -1.741   9.431  -0.187
  441   1HA   GLY  66          2HA       GLY  66  -3.014  10.006  -2.063
  442   2HA   GLY  66          1HA       GLY  66  -1.562  10.636  -2.828
  443    H    GLY  67           H        GLY  67  -2.369   7.420  -1.487
  444   1HA   GLY  67          2HA       GLY  67  -0.956   6.194  -3.674
  445   2HA   GLY  67          1HA       GLY  67  -1.742   5.370  -2.332
  446    H    LEU  68           H        LEU  68  -4.220   6.963  -2.906
  447    HA   LEU  68           HA       LEU  68  -5.590   4.981  -4.202
  448   1HB   LEU  68          2HB       LEU  68  -6.241   7.828  -3.625
  449   2HB   LEU  68          1HB       LEU  68  -7.394   6.783  -4.431
  450    HG   LEU  68           HG       LEU  68  -7.073   5.233  -2.410
  451   1HD1  LEU  68          1HD1      LEU  68  -6.002   7.790  -1.269
  452   2HD1  LEU  68          2HD1      LEU  68  -5.124   6.270  -1.464
  453   3HD1  LEU  68          3HD1      LEU  68  -6.475   6.371  -0.334
  454   1HD2  LEU  68          1HD2      LEU  68  -8.771   6.439  -1.135
  455   2HD2  LEU  68          2HD2      LEU  68  -9.122   6.465  -2.864
  456   3HD2  LEU  68          3HD2      LEU  68  -8.442   7.891  -2.081
  457    H    ARG  69           H        ARG  69  -3.867   7.636  -5.558
  458    HA   ARG  69           HA       ARG  69  -5.198   7.717  -8.066
  459   1HB   ARG  69          2HB       ARG  69  -3.285   9.022  -8.820
  460   2HB   ARG  69          1HB       ARG  69  -3.816   9.578  -7.239
  461   1HG   ARG  69          2HG       ARG  69  -2.025   8.424  -6.161
  462   2HG   ARG  69          1HG       ARG  69  -1.546   7.668  -7.676
  463   1HD   ARG  69          2HD       ARG  69  -0.031   9.460  -7.273
  464   2HD   ARG  69          1HD       ARG  69  -1.101   9.973  -8.575
  465    HE   ARG  69           HE       ARG  69  -2.366  11.135  -6.665
  466   1HH1  ARG  69          1HH1      ARG  69   1.107  10.634  -6.711
  467   2HH1  ARG  69          2HH1      ARG  69   1.461  12.089  -5.824
  468   1HH2  ARG  69          1HH2      ARG  69  -1.906  13.055  -5.510
  469   2HH2  ARG  69          2HH2      ARG  69  -0.257  13.468  -5.154
  470    H    TYR  70           H        TYR  70  -2.666   5.823  -6.641
  471    HA   TYR  70           HA       TYR  70  -1.907   4.580  -9.160
  472   1HB   TYR  70          2HB       TYR  70  -1.180   3.833  -6.317
  473   2HB   TYR  70          1HB       TYR  70  -0.315   3.381  -7.788
  474    HD1  TYR  70           1HD      TYR  70   0.874   5.235  -9.081
  475    HD2  TYR  70           2HD      TYR  70  -0.679   5.756  -5.161
  476    HE1  TYR  70           1HE      TYR  70   2.306   7.215  -8.787
  477    HE2  TYR  70           2HE      TYR  70   0.740   7.725  -4.852
  478    HH   TYR  70           HH       TYR  70   2.726   8.737  -5.712
  479    H    ALA  71           H        ALA  71  -3.739   4.163  -6.288
  480    HA   ALA  71           HA       ALA  71  -5.653   2.386  -7.131
  481   1HB   ALA  71          1HB       ALA  71  -3.354   0.924  -5.810
  482   2HB   ALA  71          2HB       ALA  71  -3.870   0.729  -7.485
  483   3HB   ALA  71          3HB       ALA  71  -4.938   0.238  -6.170
  484    HA   PRO  72           HA       PRO  72  -6.802   4.135  -3.206
  485   1HB   PRO  72          2HB       PRO  72  -9.054   2.325  -3.264
  486   2HB   PRO  72          1HB       PRO  72  -9.020   4.080  -3.279
  487   1HG   PRO  72          2HG       PRO  72  -9.675   2.527  -5.442
  488   2HG   PRO  72          1HG       PRO  72  -9.069   4.189  -5.541
  489   1HD   PRO  72          2HD       PRO  72  -7.719   1.652  -6.157
  490   2HD   PRO  72          1HD       PRO  72  -7.360   3.298  -6.717
  491    H    ARG  73           H        ARG  73  -5.858   1.004  -3.763
  492    HA   ARG  73           HA       ARG  73  -5.526   0.559  -0.899
  493   1HB   ARG  73          2HB       ARG  73  -6.276  -1.747  -1.014
  494   2HB   ARG  73          1HB       ARG  73  -7.578  -0.694  -1.560
  495   1HG   ARG  73          2HG       ARG  73  -6.777  -1.136  -3.902
  496   2HG   ARG  73          1HG       ARG  73  -5.746  -2.394  -3.213
  497   1HD   ARG  73          2HD       ARG  73  -8.729  -2.306  -2.797
  498   2HD   ARG  73          1HD       ARG  73  -7.968  -3.144  -4.148
  499    HE   ARG  73           HE       ARG  73  -6.703  -4.097  -1.900
  500   1HH1  ARG  73          1HH1      ARG  73 -10.027  -3.951  -3.040
  501   2HH1  ARG  73          2HH1      ARG  73 -10.469  -5.473  -2.319
  502   1HH2  ARG  73          1HH2      ARG  73  -7.254  -6.115  -1.050
  503   2HH2  ARG  73          2HH2      ARG  73  -8.880  -6.722  -1.198
  504    H    ALA  74           H        ALA  74  -3.652  -0.389  -0.435
  505    HA   ALA  74           HA       ALA  74  -1.540  -0.172  -2.206
  506   1HB   ALA  74          1HB       ALA  74  -0.175  -1.120  -0.476
  507   2HB   ALA  74          2HB       ALA  74  -1.590  -1.797   0.324
  508   3HB   ALA  74          3HB       ALA  74  -1.372  -0.050   0.252
  509    H    ASP  75           H        ASP  75  -3.591  -2.925  -1.516
  510    HA   ASP  75           HA       ASP  75  -1.709  -4.721  -2.789
  511   1HB   ASP  75          2HB       ASP  75  -3.249  -6.518  -2.182
  512   2HB   ASP  75          1HB       ASP  75  -2.781  -5.553  -0.789
  513    H    LEU  76           H        LEU  76  -3.729  -2.602  -4.004
  514    HA   LEU  76           HA       LEU  76  -4.432  -4.303  -6.301
  515   1HB   LEU  76          2HB       LEU  76  -6.244  -2.901  -5.458
  516   2HB   LEU  76          1HB       LEU  76  -5.236  -1.476  -5.602
  517    HG   LEU  76           HG       LEU  76  -5.217  -1.757  -8.060
  518   1HD1  LEU  76          1HD1      LEU  76  -5.547  -4.168  -8.154
  519   2HD1  LEU  76          2HD1      LEU  76  -6.773  -3.324  -9.099
  520   3HD1  LEU  76          3HD1      LEU  76  -7.178  -3.978  -7.512
  521   1HD2  LEU  76          1HD2      LEU  76  -7.513  -1.048  -8.431
  522   2HD2  LEU  76          2HD2      LEU  76  -6.864  -0.307  -6.967
  523   3HD2  LEU  76          3HD2      LEU  76  -7.976  -1.671  -6.848
  524    H    ALA  77           H        ALA  77  -2.492  -1.706  -5.165
  525    HA   ALA  77           HA       ALA  77  -1.358  -0.992  -7.695
  526   1HB   ALA  77          1HB       ALA  77  -0.482  -0.361  -4.875
  527   2HB   ALA  77          2HB       ALA  77  -1.576   0.617  -5.856
  528   3HB   ALA  77          3HB       ALA  77   0.106   0.417  -6.344
  529    H    THR  78           H        THR  78   0.855  -1.354  -8.279
  530    HA   THR  78           HA       THR  78   1.864  -3.901  -7.234
  531    HB   THR  78           HB       THR  78   3.088  -4.175  -9.263
  532    HG1  THR  78           1HG      THR  78   2.404  -1.449  -9.786
  533   1HG2  THR  78          1HG2      THR  78   0.349  -3.032  -9.825
  534   2HG2  THR  78          2HG2      THR  78   0.741  -4.714  -9.461
  535   3HG2  THR  78          3HG2      THR  78   1.288  -3.988 -10.975
  536    H    ARG  79           H        ARG  79   4.510  -3.749  -7.895
  537    HA   ARG  79           HA       ARG  79   5.634  -2.667  -5.617
  538   1HB   ARG  79          2HB       ARG  79   7.072  -2.960  -8.251
  539   2HB   ARG  79          1HB       ARG  79   7.777  -2.997  -6.641
  540   1HG   ARG  79          2HG       ARG  79   6.485  -5.057  -6.181
  541   2HG   ARG  79          1HG       ARG  79   5.945  -5.037  -7.861
  542   1HD   ARG  79          2HD       ARG  79   7.762  -6.216  -8.337
  543   2HD   ARG  79          1HD       ARG  79   8.687  -4.746  -8.035
  544    HE   ARG  79           HE       ARG  79   8.966  -5.536  -5.721
  545   1HH1  ARG  79          1HH1      ARG  79   7.952  -7.791  -8.195
  546   2HH1  ARG  79          2HH1      ARG  79   8.601  -9.193  -7.407
  547   1HH2  ARG  79          1HH2      ARG  79   9.896  -7.415  -4.675
  548   2HH2  ARG  79          2HH2      ARG  79   9.706  -8.978  -5.425
  549    H    GLU  80           H        GLU  80   5.609  -1.293  -8.880
  550    HA   GLU  80           HA       GLU  80   7.168   0.947  -8.298
  551   1HB   GLU  80          2HB       GLU  80   6.199   1.867 -10.425
  552   2HB   GLU  80          1HB       GLU  80   6.906   0.264 -10.555
  553   1HG   GLU  80          2HG       GLU  80   4.638  -0.704 -10.395
  554   2HG   GLU  80          1HG       GLU  80   3.979   0.930 -10.398
  555    H    GLU  81           H        GLU  81   3.654   0.567  -8.222
  556    HA   GLU  81           HA       GLU  81   3.017   3.226  -7.541
  557   1HB   GLU  81          2HB       GLU  81   1.618   0.611  -7.088
  558   2HB   GLU  81          1HB       GLU  81   0.948   2.133  -6.535
  559   1HG   GLU  81          2HG       GLU  81  -0.079   1.556  -8.557
  560   2HG   GLU  81          1HG       GLU  81   0.966   2.928  -8.875
  561    H    GLN  82           H        GLN  82   3.368   0.309  -5.521
  562    HA   GLN  82           HA       GLN  82   2.761   1.628  -3.101
  563   1HB   GLN  82          2HB       GLN  82   4.157  -0.978  -3.672
  564   2HB   GLN  82          1HB       GLN  82   3.839  -0.406  -2.038
  565   1HG   GLN  82          2HG       GLN  82   1.390  -0.178  -2.895
  566   2HG   GLN  82          1HG       GLN  82   1.928  -1.314  -4.132
  567   1HE2  GLN  82          1HE2      GLN  82   2.293  -3.421  -3.588
  568   2HE2  GLN  82          2HE2      GLN  82   1.945  -4.073  -2.027
  569    H    ILE  83           H        ILE  83   5.733   1.068  -4.815
  570    HA   ILE  83           HA       ILE  83   7.561   2.000  -2.927
  571    HB   ILE  83           HB       ILE  83   7.493   2.102  -5.932
  572   1HG1  ILE  83          2HG1      ILE  83   9.510   0.689  -4.222
  573   2HG1  ILE  83          1HG1      ILE  83   7.917  -0.016  -4.471
  574   1HG2  ILE  83          1HG2      ILE  83   9.944   2.756  -5.763
  575   2HG2  ILE  83          2HG2      ILE  83   9.577   3.274  -4.118
  576   3HG2  ILE  83          3HG2      ILE  83   8.753   4.022  -5.479
  577   1HD1  ILE  83          1HD1      ILE  83   8.302   0.003  -6.889
  578   2HD1  ILE  83          2HD1      ILE  83   9.545  -0.913  -6.036
  579   3HD1  ILE  83          3HD1      ILE  83   9.895   0.712  -6.626
  580    H    ALA  84           H        ALA  84   5.660   3.744  -5.351
  581    HA   ALA  84           HA       ALA  84   6.700   6.302  -4.853
  582   1HB   ALA  84          1HB       ALA  84   4.812   7.128  -6.126
  583   2HB   ALA  84          2HB       ALA  84   3.982   5.582  -5.938
  584   3HB   ALA  84          3HB       ALA  84   5.467   5.674  -6.884
  585    H    VAL  85           H        VAL  85   3.839   4.673  -3.516
  586    HA   VAL  85           HA       VAL  85   2.936   6.932  -2.047
  587    HB   VAL  85           HB       VAL  85   2.415   4.046  -1.401
  588   1HG1  VAL  85          1HG1      VAL  85   0.795   6.548  -0.907
  589   2HG1  VAL  85          2HG1      VAL  85   1.699   5.636   0.304
  590   3HG1  VAL  85          3HG1      VAL  85   0.303   4.906  -0.490
  591   1HG2  VAL  85          1HG2      VAL  85   0.984   5.823  -3.375
  592   2HG2  VAL  85          2HG2      VAL  85   0.440   4.224  -2.863
  593   3HG2  VAL  85          3HG2      VAL  85   1.953   4.398  -3.754
  594    H    ALA  86           H        ALA  86   4.708   4.000  -1.078
  595    HA   ALA  86           HA       ALA  86   5.007   4.738   1.620
  596   1HB   ALA  86          1HB       ALA  86   6.643   2.822  -0.038
  597   2HB   ALA  86          2HB       ALA  86   5.182   2.424   0.866
  598   3HB   ALA  86          3HB       ALA  86   6.641   2.924   1.723
  599    H    GLU  87           H        GLU  87   6.801   5.432  -1.286
  600    HA   GLU  87           HA       GLU  87   9.197   6.204   0.059
  601   1HB   GLU  87          2HB       GLU  87  10.033   7.066  -1.989
  602   2HB   GLU  87          1HB       GLU  87   9.099   5.633  -2.401
  603   1HG   GLU  87          2HG       GLU  87   7.358   6.879  -3.279
  604   2HG   GLU  87          1HG       GLU  87   7.926   8.379  -2.549
  605    H    VAL  88           H        VAL  88   6.247   7.939  -0.835
  606    HA   VAL  88           HA       VAL  88   7.130  10.511  -0.077
  607    HB   VAL  88           HB       VAL  88   4.361   9.313   0.245
  608   1HG1  VAL  88          1HG1      VAL  88   3.571  11.615   0.430
  609   2HG1  VAL  88          2HG1      VAL  88   5.230  12.205   0.346
  610   3HG1  VAL  88          3HG1      VAL  88   4.709  11.238   1.729
  611   1HG2  VAL  88          1HG2      VAL  88   5.500  11.097  -1.912
  612   2HG2  VAL  88          2HG2      VAL  88   3.835  10.524  -1.810
  613   3HG2  VAL  88          3HG2      VAL  88   5.146   9.377  -2.080
  614    H    THR  89           H        THR  89   5.671   7.878   1.757
  615    HA   THR  89           HA       THR  89   5.490   9.163   4.228
  616    HB   THR  89           HB       THR  89   6.116   6.335   4.432
  617    HG1  THR  89           1HG      THR  89   3.829   6.950   2.857
  618   1HG2  THR  89          1HG2      THR  89   3.948   6.301   5.509
  619   2HG2  THR  89          2HG2      THR  89   3.607   7.923   4.904
  620   3HG2  THR  89          3HG2      THR  89   4.900   7.673   6.076
  621    H    ARG  90           H        ARG  90   8.046   7.162   2.826
  622    HA   ARG  90           HA       ARG  90   9.673   7.004   5.103
  623   1HB   ARG  90          2HB       ARG  90  11.347   6.100   3.699
  624   2HB   ARG  90          1HB       ARG  90   9.815   5.590   3.010
  625   1HG   ARG  90          2HG       ARG  90  10.779   6.229   1.092
  626   2HG   ARG  90          1HG       ARG  90  10.225   7.830   1.597
  627   1HD   ARG  90          2HD       ARG  90  12.352   8.453   2.352
  628   2HD   ARG  90          1HD       ARG  90  12.927   6.786   2.384
  629    HE   ARG  90           HE       ARG  90  12.515   7.057  -0.204
  630   1HH1  ARG  90          1HH1      ARG  90  13.912   9.361   2.019
  631   2HH1  ARG  90          2HH1      ARG  90  14.968  10.065   0.827
  632   1HH2  ARG  90          1HH2      ARG  90  13.914   7.934  -1.773
  633   2HH2  ARG  90          2HH2      ARG  90  14.970   9.249  -1.328
  634    H    LEU  91           H        LEU  91   9.289   9.484   2.715
  635    HA   LEU  91           HA       LEU  91  11.759  10.858   3.042
  636   1HB   LEU  91          2HB       LEU  91   9.118  12.190   2.454
  637   2HB   LEU  91          1HB       LEU  91  10.716  12.767   2.033
  638    HG   LEU  91           HG       LEU  91   9.369  10.354   0.836
  639   1HD1  LEU  91          1HD1      LEU  91   9.142  11.750  -1.161
  640   2HD1  LEU  91          2HD1      LEU  91   9.792  13.126  -0.269
  641   3HD1  LEU  91          3HD1      LEU  91   8.249  12.418   0.208
  642   1HD2  LEU  91          1HD2      LEU  91  11.939  11.773   0.129
  643   2HD2  LEU  91          2HD2      LEU  91  11.197  10.477  -0.806
  644   3HD2  LEU  91          3HD2      LEU  91  11.795  10.158   0.822
  645    H    ARG  92           H        ARG  92   8.698  10.981   4.656
  646    HA   ARG  92           HA       ARG  92   9.173  13.516   5.915
  647   1HB   ARG  92          2HB       ARG  92   6.989  11.621   6.668
  648   2HB   ARG  92          1HB       ARG  92   6.971  13.379   6.656
  649   1HG   ARG  92          2HG       ARG  92   6.651  13.491   4.367
  650   2HG   ARG  92          1HG       ARG  92   7.252  11.852   4.102
  651   1HD   ARG  92          2HD       ARG  92   4.593  12.768   5.076
  652   2HD   ARG  92          1HD       ARG  92   4.993  11.545   3.866
  653    HE   ARG  92           HE       ARG  92   5.963  10.494   6.167
  654   1HH1  ARG  92          1HH1      ARG  92   2.833  11.678   5.129
  655   2HH1  ARG  92          2HH1      ARG  92   1.935  10.749   6.300
  656   1HH2  ARG  92          1HH2      ARG  92   4.773   9.266   7.739
  657   2HH2  ARG  92          2HH2      ARG  92   3.039   9.366   7.767
  658    H    GLN  93           H        GLN  93   8.996  10.154   6.831
  659    HA   GLN  93           HA       GLN  93   9.478  10.909   9.596
  660   1HB   GLN  93          2HB       GLN  93   8.588   8.741  10.190
  661   2HB   GLN  93          1HB       GLN  93   7.493   9.581   9.094
  662   1HG   GLN  93          2HG       GLN  93   8.743   8.251   7.253
  663   2HG   GLN  93          1HG       GLN  93   9.202   7.199   8.593
  664   1HE2  GLN  93          1HE2      GLN  93   7.470   6.751   6.274
  665   2HE2  GLN  93          2HE2      GLN  93   5.954   6.231   6.930
  666    H    GLY  94           H        GLY  94  10.935   9.074   6.989
  667   1HA   GLY  94          2HA       GLY  94  13.246   8.724   6.801
  668   2HA   GLY  94          1HA       GLY  94  13.420   9.080   8.514
  669    H    TRP  95           H        TRP  95  11.247   6.779   6.983
  670    HA   TRP  95           HA       TRP  95  10.980   4.546   7.138
  671   1HB   TRP  95          2HB       TRP  95  13.895   4.328   7.911
  672   2HB   TRP  95          1HB       TRP  95  12.886   3.109   7.130
  673    HD1  TRP  95           HD       TRP  95  14.657   6.421   6.367
  674    HE1  TRP  95           1HE      TRP  95  15.013   6.593   3.831
  675    HE3  TRP  95           3HE      TRP  95  12.044   2.286   4.939
  676    HZ2  TRP  95           2HZ      TRP  95  14.263   5.149   1.517
  677    HZ3  TRP  95           3HZ      TRP  95  11.904   1.753   2.544
  678    HH2  TRP  95           HH       TRP  95  12.991   3.156   0.871
  679    H    GLY  96           H        GLY  96  11.063   6.464   9.495
  680   1HA   GLY  96          2HA       GLY  96  11.542   4.962  11.829
  681   2HA   GLY  96          1HA       GLY  96  10.485   6.360  11.717
  682    H    ALA  97           H        ALA  97   8.767   5.067   9.686
  683    HA   ALA  97           HA       ALA  97   7.081   3.608  11.521
  684   1HB   ALA  97          1HB       ALA  97   5.444   3.583   9.729
  685   2HB   ALA  97          2HB       ALA  97   6.647   4.197   8.595
  686   3HB   ALA  97          3HB       ALA  97   6.102   5.205   9.936
  687    H    TRP  98           H        TRP  98   9.397   2.880   9.110
  688    HA   TRP  98           HA       TRP  98   8.521   0.097   8.958
  689   1HB   TRP  98          2HB       TRP  98  10.508   1.704   7.354
  690   2HB   TRP  98          1HB       TRP  98  10.362  -0.046   7.214
  691    HD1  TRP  98           HD       TRP  98   8.061  -1.006   6.195
  692    HE1  TRP  98           1HE      TRP  98   6.344   0.068   4.595
  693    HE3  TRP  98           3HE      TRP  98   9.441   3.920   6.685
  694    HZ2  TRP  98           2HZ      TRP  98   5.680   2.659   3.642
  695    HZ3  TRP  98           3HZ      TRP  98   8.226   5.606   5.400
  696    HH2  TRP  98           HH       TRP  98   6.382   4.994   3.917
  697    HA   PRO  99           HA       PRO  99  11.311  -0.417  12.376
  698   1HB   PRO  99          2HB       PRO  99  10.501  -3.248  11.956
  699   2HB   PRO  99          1HB       PRO  99  10.451  -2.269  13.428
  700   1HG   PRO  99          2HG       PRO  99   8.209  -2.790  12.142
  701   2HG   PRO  99          1HG       PRO  99   8.520  -1.150  12.760
  702   1HD   PRO  99          2HD       PRO  99   8.846  -2.197   9.960
  703   2HD   PRO  99          1HD       PRO  99   8.057  -0.700  10.511
  704    H    VAL 100           H        VAL 100  12.264  -3.306  12.405
  705    HA   VAL 100           HA       VAL 100  14.885  -2.822  11.671
  706    HB   VAL 100           HB       VAL 100  13.547  -5.528  11.864
  707   1HG1  VAL 100          1HG1      VAL 100  16.431  -4.724  12.233
  708   2HG1  VAL 100          2HG1      VAL 100  15.772  -5.645  10.882
  709   3HG1  VAL 100          3HG1      VAL 100  15.768  -6.336  12.504
  710   1HG2  VAL 100          1HG2      VAL 100  14.788  -3.805  14.003
  711   2HG2  VAL 100          2HG2      VAL 100  14.277  -5.479  14.222
  712   3HG2  VAL 100          3HG2      VAL 100  13.085  -4.233  13.849
  713    H    CYS 101           H        CYS 101  12.250  -3.847   9.701
  714    HA   CYS 101           HA       CYS 101  13.640  -5.122   7.619
  715   1HB   CYS 101          2HB       CYS 101  11.050  -3.561   7.466
  716   2HB   CYS 101          1HB       CYS 101  11.625  -4.742   6.290
  717    H    ALA 102           H        ALA 102  13.111  -1.735   8.348
  718    HA   ALA 102           HA       ALA 102  13.680  -0.749   5.736
  719   1HB   ALA 102          1HB       ALA 102  13.872   1.439   6.829
  720   2HB   ALA 102          2HB       ALA 102  13.799   0.650   8.405
  721   3HB   ALA 102          3HB       ALA 102  12.412   0.579   7.318
  722    H    ALA 103           H        ALA 103  15.624  -1.079   8.695
  723    HA   ALA 103           HA       ALA 103  17.975   0.032   7.589
  724   1HB   ALA 103          1HB       ALA 103  19.133  -0.900   9.505
  725   2HB   ALA 103          2HB       ALA 103  17.748  -1.930   9.867
  726   3HB   ALA 103          3HB       ALA 103  17.605  -0.178  10.009
  727    H    ARG 104           H        ARG 104  16.707  -3.233   7.747
  728    HA   ARG 104           HA       ARG 104  18.982  -4.504   6.620
  729   1HB   ARG 104          2HB       ARG 104  16.192  -5.248   7.270
  730   2HB   ARG 104          1HB       ARG 104  16.972  -6.201   6.016
  731   1HG   ARG 104          2HG       ARG 104  17.284  -7.328   8.079
  732   2HG   ARG 104          1HG       ARG 104  18.835  -6.646   7.605
  733   1HD   ARG 104          2HD       ARG 104  17.025  -5.163   9.470
  734   2HD   ARG 104          1HD       ARG 104  18.049  -6.464  10.068
  735    HE   ARG 104           HE       ARG 104  19.469  -4.482   8.531
  736   1HH1  ARG 104          1HH1      ARG 104  18.389  -5.472  11.714
  737   2HH1  ARG 104          2HH1      ARG 104  19.497  -4.426  12.556
  738   1HH2  ARG 104          1HH2      ARG 104  20.943  -3.113   9.640
  739   2HH2  ARG 104          2HH2      ARG 104  20.947  -3.103  11.378
  740    H    ALA 105           H        ALA 105  16.352  -2.722   5.294
  741    HA   ALA 105           HA       ALA 105  16.655  -3.796   2.606
  742   1HB   ALA 105          1HB       ALA 105  14.918  -1.565   3.642
  743   2HB   ALA 105          2HB       ALA 105  14.442  -3.258   3.499
  744   3HB   ALA 105          3HB       ALA 105  14.816  -2.321   2.052
  745    H    GLY 106           H        GLY 106  17.836  -1.163   4.495
  746   1HA   GLY 106          2HA       GLY 106  19.796   0.026   3.637
  747   2HA   GLY 106          1HA       GLY 106  19.007   0.040   2.065
  748    H    ALA 107           H        ALA 107  18.295   1.042   5.395
  749    HA   ALA 107           HA       ALA 107  16.424   3.008   4.814
  750   1HB   ALA 107          1HB       ALA 107  16.848   3.848   7.067
  751   2HB   ALA 107          2HB       ALA 107  18.311   2.868   7.158
  752   3HB   ALA 107          3HB       ALA 107  16.733   2.089   7.047
  753    H    ARG 108           H        ARG 108  16.547   5.256   4.602
  754    HA   ARG 108           HA       ARG 108  19.096   6.513   4.171
  755   1HB   ARG 108          2HB       ARG 108  18.291   6.999   1.696
  756   2HB   ARG 108          1HB       ARG 108  19.229   5.562   2.087
  757   1HG   ARG 108          2HG       ARG 108  17.282   4.189   2.097
  758   2HG   ARG 108          1HG       ARG 108  16.223   5.599   1.975
  759   1HD   ARG 108          2HD       ARG 108  16.450   4.435  -0.169
  760   2HD   ARG 108          1HD       ARG 108  17.068   6.083  -0.245
  761    HE   ARG 108           HE       ARG 108  19.190   4.334   0.357
  762   1HH1  ARG 108          1HH1      ARG 108  16.994   5.074  -2.275
  763   2HH1  ARG 108          2HH1      ARG 108  18.166   4.717  -3.514
  764   1HH2  ARG 108          1HH2      ARG 108  20.715   3.834  -1.262
  765   2HH2  ARG 108          2HH2      ARG 108  20.274   3.984  -2.936
  Start of MODEL   25
    1   1H    ASN   1          1HT       ASN   1 -31.020  21.026  -7.409
    2   2H    ASN   1          2HT       ASN   1 -29.679  21.453  -6.470
    3   3H    ASN   1          3HT       ASN   1 -29.666  20.010  -7.363
    4    HA   ASN   1           HA       ASN   1 -29.714  22.760  -8.462
    5   1HB   ASN   1          2HB       ASN   1 -27.594  20.603  -8.566
    6   2HB   ASN   1          1HB       ASN   1 -27.501  22.161  -9.379
    7   1HD2  ASN   1          1HD2      ASN   1 -25.706  21.024  -7.432
    8   2HD2  ASN   1          2HD2      ASN   1 -25.675  22.123  -6.094
    9    H    VAL   2           H        VAL   2 -30.506  22.934 -10.446
   10    HA   VAL   2           HA       VAL   2 -31.472  20.522 -11.754
   11    HB   VAL   2           HB       VAL   2 -32.903  22.574 -11.440
   12   1HG1  VAL   2          1HG1      VAL   2 -31.281  24.289 -11.944
   13   2HG1  VAL   2          2HG1      VAL   2 -32.642  24.407 -13.059
   14   3HG1  VAL   2          3HG1      VAL   2 -31.121  23.693 -13.596
   15   1HG2  VAL   2          1HG2      VAL   2 -33.515  20.832 -13.028
   16   2HG2  VAL   2          2HG2      VAL   2 -32.540  21.611 -14.276
   17   3HG2  VAL   2          3HG2      VAL   2 -33.968  22.425 -13.634
   18    H    VAL   3           H        VAL   3 -28.719  22.376 -11.842
   19    HA   VAL   3           HA       VAL   3 -28.120  22.641 -14.519
   20    HB   VAL   3           HB       VAL   3 -26.798  23.757 -12.850
   21   1HG1  VAL   3          1HG1      VAL   3 -26.853  22.118 -11.071
   22   2HG1  VAL   3          2HG1      VAL   3 -25.184  22.558 -11.439
   23   3HG1  VAL   3          3HG1      VAL   3 -25.838  21.025 -12.014
   24   1HG2  VAL   3          1HG2      VAL   3 -25.167  21.782 -14.436
   25   2HG2  VAL   3          2HG2      VAL   3 -24.528  23.234 -13.662
   26   3HG2  VAL   3          3HG2      VAL   3 -25.711  23.375 -14.965
   27    H    VAL   4           H        VAL   4 -27.725  21.259 -16.079
   28    HA   VAL   4           HA       VAL   4 -27.213  18.442 -15.409
   29    HB   VAL   4           HB       VAL   4 -27.942  19.579 -18.115
   30   1HG1  VAL   4          1HG1      VAL   4 -28.131  16.784 -16.998
   31   2HG1  VAL   4          2HG1      VAL   4 -26.956  17.361 -18.178
   32   3HG1  VAL   4          3HG1      VAL   4 -28.665  17.287 -18.601
   33   1HG2  VAL   4          1HG2      VAL   4 -29.723  20.174 -16.591
   34   2HG2  VAL   4          2HG2      VAL   4 -29.792  18.522 -15.977
   35   3HG2  VAL   4          3HG2      VAL   4 -30.262  18.865 -17.643
   36    H    THR   5           H        THR   5 -25.581  17.307 -16.555
   37    HA   THR   5           HA       THR   5 -23.238  18.938 -17.109
   38    HB   THR   5           HB       THR   5 -22.213  16.545 -17.348
   39    HG1  THR   5           1HG      THR   5 -24.068  15.607 -15.558
   40   1HG2  THR   5          1HG2      THR   5 -21.935  16.414 -14.895
   41   2HG2  THR   5          2HG2      THR   5 -23.199  17.631 -14.709
   42   3HG2  THR   5          3HG2      THR   5 -21.687  18.046 -15.515
   43    HA   PRO   6           HA       PRO   6 -24.232  18.480 -21.513
   44   1HB   PRO   6          2HB       PRO   6 -21.982  20.346 -21.760
   45   2HB   PRO   6          1HB       PRO   6 -23.636  20.476 -22.364
   46   1HG   PRO   6          2HG       PRO   6 -22.864  21.982 -20.324
   47   2HG   PRO   6          1HG       PRO   6 -24.464  21.216 -20.334
   48   1HD   PRO   6          2HD       PRO   6 -21.962  20.274 -18.948
   49   2HD   PRO   6          1HD       PRO   6 -23.598  20.475 -18.274
   50    H    ALA   7           H        ALA   7 -23.554  16.570 -21.810
   51    HA   ALA   7           HA       ALA   7 -20.699  16.074 -22.307
   52   1HB   ALA   7          1HB       ALA   7 -20.966  13.816 -21.444
   53   2HB   ALA   7          2HB       ALA   7 -22.662  14.142 -21.096
   54   3HB   ALA   7          3HB       ALA   7 -21.402  15.009 -20.220
   55    H    HIS   8           H        HIS   8 -22.326  16.913 -24.250
   56    HA   HIS   8           HA       HIS   8 -23.001  14.651 -25.908
   57   1HB   HIS   8          2HB       HIS   8 -24.170  16.940 -25.926
   58   2HB   HIS   8          1HB       HIS   8 -22.753  17.526 -26.790
   59    HD1  HIS   8           1HD      HIS   8 -25.507  14.928 -27.184
   60    HD2  HIS   8           2HD      HIS   8 -22.811  17.130 -29.462
   61    HE1  HIS   8           1HE      HIS   8 -26.093  14.489 -29.609
   62    H    GLU   9           H        GLU   9 -20.284  16.210 -24.915
   63    HA   GLU   9           HA       GLU   9 -18.739  15.484 -27.309
   64   1HB   GLU   9          2HB       GLU   9 -17.205  17.268 -26.732
   65   2HB   GLU   9          1HB       GLU   9 -18.839  17.911 -26.830
   66   1HG   GLU   9          2HG       GLU   9 -19.016  17.807 -24.387
   67   2HG   GLU   9          1HG       GLU   9 -17.353  17.229 -24.308
   68    H    ALA  10           H        ALA  10 -16.578  14.739 -26.904
   69    HA   ALA  10           HA       ALA  10 -16.051  13.835 -24.174
   70   1HB   ALA  10          1HB       ALA  10 -15.862  11.999 -26.558
   71   2HB   ALA  10          2HB       ALA  10 -17.124  11.946 -25.327
   72   3HB   ALA  10          3HB       ALA  10 -15.452  11.596 -24.890
   73    H    VAL  11           H        VAL  11 -14.787  15.828 -24.696
   74    HA   VAL  11           HA       VAL  11 -12.229  15.143 -25.903
   75    HB   VAL  11           HB       VAL  11 -13.289  17.846 -25.176
   76   1HG1  VAL  11          1HG1      VAL  11 -10.776  17.090 -26.657
   77   2HG1  VAL  11          2HG1      VAL  11 -10.857  17.751 -25.024
   78   3HG1  VAL  11          3HG1      VAL  11 -11.361  18.733 -26.400
   79   1HG2  VAL  11          1HG2      VAL  11 -14.499  16.913 -27.055
   80   2HG2  VAL  11          2HG2      VAL  11 -12.979  16.549 -27.873
   81   3HG2  VAL  11          3HG2      VAL  11 -13.452  18.225 -27.596
   82    H    VAL  12           H        VAL  12 -13.191  17.388 -23.369
   83    HA   VAL  12           HA       VAL  12 -12.072  17.986 -21.488
   84    HB   VAL  12           HB       VAL  12 -13.992  16.834 -20.777
   85   1HG1  VAL  12          1HG1      VAL  12 -14.045  14.449 -20.245
   86   2HG1  VAL  12          2HG1      VAL  12 -12.407  14.281 -20.880
   87   3HG1  VAL  12          3HG1      VAL  12 -13.728  14.740 -21.957
   88   1HG2  VAL  12          1HG2      VAL  12 -11.626  16.041 -19.105
   89   2HG2  VAL  12          2HG2      VAL  12 -13.300  16.062 -18.551
   90   3HG2  VAL  12          3HG2      VAL  12 -12.509  17.564 -19.029
   91    H    ARG  13           H        ARG  13  -9.998  18.116 -22.205
   92    HA   ARG  13           HA       ARG  13  -8.265  15.844 -21.686
   93   1HB   ARG  13          2HB       ARG  13  -6.493  17.160 -22.759
   94   2HB   ARG  13          1HB       ARG  13  -7.876  16.869 -23.801
   95   1HG   ARG  13          2HG       ARG  13  -8.689  19.135 -23.282
   96   2HG   ARG  13          1HG       ARG  13  -7.219  19.401 -22.342
   97   1HD   ARG  13          2HD       ARG  13  -5.858  19.061 -24.325
   98   2HD   ARG  13          1HD       ARG  13  -7.293  18.690 -25.276
   99    HE   ARG  13           HE       ARG  13  -7.276  21.302 -24.020
  100   1HH1  ARG  13          1HH1      ARG  13  -6.503  19.443 -26.888
  101   2HH1  ARG  13          2HH1      ARG  13  -6.557  20.814 -27.946
  102   1HH2  ARG  13          1HH2      ARG  13  -7.337  23.100 -25.394
  103   2HH2  ARG  13          2HH2      ARG  13  -7.028  22.908 -27.098
  104    H    VAL  14           H        VAL  14  -8.069  15.715 -19.666
  105    HA   VAL  14           HA       VAL  14  -6.819  17.857 -18.125
  106    HB   VAL  14           HB       VAL  14  -8.608  15.762 -16.931
  107   1HG1  VAL  14          1HG1      VAL  14  -7.146  16.822 -15.347
  108   2HG1  VAL  14          2HG1      VAL  14  -8.792  17.390 -15.074
  109   3HG1  VAL  14          3HG1      VAL  14  -7.632  18.421 -15.914
  110   1HG2  VAL  14          1HG2      VAL  14 -10.427  17.395 -16.858
  111   2HG2  VAL  14          2HG2      VAL  14  -9.966  17.016 -18.518
  112   3HG2  VAL  14          3HG2      VAL  14  -9.440  18.530 -17.780
  113    H    GLY  15           H        GLY  15  -5.595  16.959 -16.302
  114   1HA   GLY  15          2HA       GLY  15  -4.120  15.394 -15.385
  115   2HA   GLY  15          1HA       GLY  15  -4.549  14.270 -16.675
  116    H    THR  16           H        THR  16  -2.760  17.166 -15.894
  117    HA   THR  16           HA       THR  16  -1.589  17.594 -18.381
  118    HB   THR  16           HB       THR  16  -0.324  18.343 -15.763
  119    HG1  THR  16           1HG      THR  16  -2.711  19.281 -16.965
  120   1HG2  THR  16          1HG2      THR  16   0.904  18.898 -17.786
  121   2HG2  THR  16          2HG2      THR  16   0.306  20.358 -16.999
  122   3HG2  THR  16          3HG2      THR  16  -0.511  19.727 -18.429
  123    H    LYS  17           H        LYS  17  -0.613  15.741 -15.634
  124    HA   LYS  17           HA       LYS  17   1.547  14.542 -17.226
  125   1HB   LYS  17          2HB       LYS  17   1.509  14.836 -14.214
  126   2HB   LYS  17          1HB       LYS  17   2.818  14.174 -15.184
  127   1HG   LYS  17          2HG       LYS  17   3.636  16.262 -14.876
  128   2HG   LYS  17          1HG       LYS  17   2.665  16.564 -16.319
  129   1HD   LYS  17          2HD       LYS  17   0.789  17.238 -14.804
  130   2HD   LYS  17          1HD       LYS  17   1.927  17.139 -13.460
  131   1HE   LYS  17          2HE       LYS  17   2.192  18.920 -15.880
  132   2HE   LYS  17          1HE       LYS  17   1.695  19.434 -14.270
  133   1HZ   LYS  17          1HZ       LYS  17   3.850  18.872 -13.418
  134   2HZ   LYS  17          2HZ       LYS  17   4.046  19.889 -14.765
  135   3HZ   LYS  17          3HZ       LYS  17   4.332  18.223 -14.910
  136    HA   PRO  18           HA       PRO  18  -1.332  11.112 -16.475
  137   1HB   PRO  18          2HB       PRO  18   0.052   9.876 -18.719
  138   2HB   PRO  18          1HB       PRO  18  -1.647  10.334 -18.573
  139   1HG   PRO  18          2HG       PRO  18   0.048  11.627 -20.213
  140   2HG   PRO  18          1HG       PRO  18  -1.280  12.453 -19.377
  141   1HD   PRO  18          2HD       PRO  18   1.629  12.337 -18.645
  142   2HD   PRO  18          1HD       PRO  18   0.541  13.743 -18.677
  143    H    GLY  19           H        GLY  19  -1.050   8.868 -16.194
  144   1HA   GLY  19          2HA       GLY  19   1.491   8.320 -14.829
  145   2HA   GLY  19          1HA       GLY  19  -0.038   7.516 -14.484
  146    H    THR  20           H        THR  20   1.289   8.194 -17.590
  147    HA   THR  20           HA       THR  20   0.809   5.645 -18.642
  148    HB   THR  20           HB       THR  20   2.843   7.583 -19.733
  149    HG1  THR  20           1HG      THR  20   1.192   8.803 -20.524
  150   1HG2  THR  20          1HG2      THR  20   2.668   5.425 -20.856
  151   2HG2  THR  20          2HG2      THR  20   2.040   6.716 -21.883
  152   3HG2  THR  20          3HG2      THR  20   0.926   5.647 -21.027
  153    H    GLU  21           H        GLU  21   3.850   7.160 -17.597
  154    HA   GLU  21           HA       GLU  21   4.980   4.486 -17.314
  155   1HB   GLU  21          2HB       GLU  21   6.323   6.878 -18.565
  156   2HB   GLU  21          1HB       GLU  21   7.185   5.434 -18.054
  157   1HG   GLU  21          2HG       GLU  21   5.857   4.101 -19.626
  158   2HG   GLU  21          1HG       GLU  21   5.044   5.572 -20.162
  159    H    VAL  22           H        VAL  22   5.340   4.206 -15.228
  160    HA   VAL  22           HA       VAL  22   6.100   6.443 -13.533
  161    HB   VAL  22           HB       VAL  22   5.846   3.508 -12.830
  162   1HG1  VAL  22          1HG1      VAL  22   5.731   4.307 -10.510
  163   2HG1  VAL  22          2HG1      VAL  22   6.026   5.953 -11.071
  164   3HG1  VAL  22          3HG1      VAL  22   7.268   4.716 -11.273
  165   1HG2  VAL  22          1HG2      VAL  22   3.721   4.447 -13.610
  166   2HG2  VAL  22          2HG2      VAL  22   3.864   5.747 -12.428
  167   3HG2  VAL  22          3HG2      VAL  22   3.675   4.080 -11.887
  168    HA   PRO  23           HA       PRO  23  10.401   5.774 -14.631
  169   1HB   PRO  23          2HB       PRO  23  10.707   7.592 -12.299
  170   2HB   PRO  23          1HB       PRO  23  11.437   7.696 -13.907
  171   1HG   PRO  23          2HG       PRO  23   9.420   9.287 -13.259
  172   2HG   PRO  23          1HG       PRO  23   9.493   8.547 -14.869
  173   1HD   PRO  23          2HD       PRO  23   7.840   7.772 -12.518
  174   2HD   PRO  23          1HD       PRO  23   7.398   7.831 -14.231
  175    HA   PRO  24           HA       PRO  24  11.167   2.408 -11.884
  176   1HB   PRO  24          2HB       PRO  24  13.924   2.313 -12.330
  177   2HB   PRO  24          1HB       PRO  24  12.695   1.473 -13.282
  178   1HG   PRO  24          2HG       PRO  24  14.038   4.091 -13.808
  179   2HG   PRO  24          1HG       PRO  24  13.612   2.797 -14.948
  180   1HD   PRO  24          2HD       PRO  24  12.109   4.970 -14.816
  181   2HD   PRO  24          1HD       PRO  24  11.346   3.372 -14.925
  182    H    VAL  25           H        VAL  25  11.715   2.180  -9.861
  183    HA   VAL  25           HA       VAL  25  12.681   4.510  -8.453
  184    HB   VAL  25           HB       VAL  25  10.634   3.500  -7.664
  185   1HG1  VAL  25          1HG1      VAL  25  12.263   1.004  -7.332
  186   2HG1  VAL  25          2HG1      VAL  25  10.885   1.254  -8.404
  187   3HG1  VAL  25          3HG1      VAL  25  10.652   1.238  -6.655
  188   1HG2  VAL  25          1HG2      VAL  25  12.201   4.531  -6.033
  189   2HG2  VAL  25          2HG2      VAL  25  12.818   2.916  -5.681
  190   3HG2  VAL  25          3HG2      VAL  25  11.138   3.312  -5.332
  191    H    ILE  26           H        ILE  26  14.594   4.708  -7.597
  192    HA   ILE  26           HA       ILE  26  16.599   2.694  -7.982
  193    HB   ILE  26           HB       ILE  26  16.790   5.337  -6.531
  194   1HG1  ILE  26          2HG1      ILE  26  16.083   5.646  -8.844
  195   2HG1  ILE  26          1HG1      ILE  26  17.744   6.189  -8.639
  196   1HG2  ILE  26          1HG2      ILE  26  19.206   5.155  -6.978
  197   2HG2  ILE  26          2HG2      ILE  26  18.946   3.534  -7.621
  198   3HG2  ILE  26          3HG2      ILE  26  18.615   3.872  -5.921
  199   1HD1  ILE  26          1HD1      ILE  26  16.883   3.566  -9.838
  200   2HD1  ILE  26          2HD1      ILE  26  18.547   4.118  -9.643
  201   3HD1  ILE  26          3HD1      ILE  26  17.453   4.981 -10.724
  202    H    ASP  27           H        ASP  27  14.547   3.624  -5.390
  203    HA   ASP  27           HA       ASP  27  16.136   2.056  -3.499
  204   1HB   ASP  27          2HB       ASP  27  14.093   4.199  -2.895
  205   2HB   ASP  27          1HB       ASP  27  14.984   3.260  -1.703
  206    H    GLY  28           H        GLY  28  13.987   1.415  -5.556
  207   1HA   GLY  28          2HA       GLY  28  11.754   0.438  -4.079
  208   2HA   GLY  28          1HA       GLY  28  12.200  -0.025  -5.719
  209    H    SER  29           H        SER  29  14.941  -0.425  -4.290
  210    HA   SER  29           HA       SER  29  14.696  -3.249  -3.871
  211   1HB   SER  29          2HB       SER  29  16.972  -1.459  -3.051
  212   2HB   SER  29          1HB       SER  29  17.040  -3.186  -3.410
  213    HG   SER  29           HG       SER  29  17.732  -2.279  -5.252
  214    H    ILE  30           H        ILE  30  14.992  -0.398  -1.917
  215    HA   ILE  30           HA       ILE  30  15.129  -1.686   0.621
  216    HB   ILE  30           HB       ILE  30  13.805   0.972   0.536
  217   1HG1  ILE  30          2HG1      ILE  30  15.400   1.246  -1.319
  218   2HG1  ILE  30          1HG1      ILE  30  15.858   2.218   0.075
  219   1HG2  ILE  30          1HG2      ILE  30  15.367   1.454   2.347
  220   2HG2  ILE  30          2HG2      ILE  30  16.125  -0.120   2.100
  221   3HG2  ILE  30          3HG2      ILE  30  14.444  -0.022   2.624
  222   1HD1  ILE  30          1HD1      ILE  30  17.091  -0.419  -0.687
  223   2HD1  ILE  30          2HD1      ILE  30  17.566   0.596   0.675
  224   3HD1  ILE  30          3HD1      ILE  30  17.790   1.172  -0.977
  225    H    TRP  31           H        TRP  31  12.666  -0.470  -1.490
  226    HA   TRP  31           HA       TRP  31  10.508  -0.755   0.335
  227   1HB   TRP  31          2HB       TRP  31  10.621  -0.318  -2.665
  228   2HB   TRP  31          1HB       TRP  31   9.113  -0.443  -1.765
  229    HD1  TRP  31           HD       TRP  31  11.103   2.164  -3.128
  230    HE1  TRP  31           1HE      TRP  31  10.808   4.388  -1.832
  231    HE3  TRP  31           3HE      TRP  31   9.126   0.306   1.146
  232    HZ2  TRP  31           2HZ      TRP  31   9.919   5.189   0.724
  233    HZ3  TRP  31           3HZ      TRP  31   8.600   1.838   2.994
  234    HH2  TRP  31           HH       TRP  31   8.991   4.229   2.780
  235    H    ASP  32           H        ASP  32  11.952  -2.755  -2.158
  236    HA   ASP  32           HA       ASP  32   9.875  -4.735  -1.994
  237   1HB   ASP  32          2HB       ASP  32  10.895  -4.454  -4.115
  238   2HB   ASP  32          1HB       ASP  32  12.519  -4.647  -3.436
  239    H    ALA  33           H        ALA  33  13.124  -4.289  -0.630
  240    HA   ALA  33           HA       ALA  33  13.276  -6.891   0.467
  241   1HB   ALA  33          1HB       ALA  33  15.073  -6.003   1.869
  242   2HB   ALA  33          2HB       ALA  33  14.649  -4.365   1.366
  243   3HB   ALA  33          3HB       ALA  33  15.266  -5.519   0.184
  244    H    ILE  34           H        ILE  34  11.924  -3.833   1.572
  245    HA   ILE  34           HA       ILE  34  11.139  -4.644   4.154
  246    HB   ILE  34           HB       ILE  34   9.867  -2.742   2.199
  247   1HG1  ILE  34          2HG1      ILE  34  11.423  -2.271   4.756
  248   2HG1  ILE  34          1HG1      ILE  34  12.069  -2.109   3.128
  249   1HG2  ILE  34          1HG2      ILE  34   8.494  -1.901   4.070
  250   2HG2  ILE  34          2HG2      ILE  34   9.075  -3.232   5.070
  251   3HG2  ILE  34          3HG2      ILE  34   8.098  -3.565   3.640
  252   1HD1  ILE  34          1HD1      ILE  34  10.498  -0.285   2.696
  253   2HD1  ILE  34          2HD1      ILE  34  11.542   0.054   4.077
  254   3HD1  ILE  34          3HD1      ILE  34   9.871  -0.447   4.337
  255    H    ALA  35           H        ALA  35   9.499  -4.927   1.018
  256    HA   ALA  35           HA       ALA  35   7.189  -6.228   1.928
  257   1HB   ALA  35          1HB       ALA  35   6.864  -6.940  -0.349
  258   2HB   ALA  35          2HB       ALA  35   8.541  -6.558  -0.736
  259   3HB   ALA  35          3HB       ALA  35   7.417  -5.267  -0.312
  260    H    GLY  36           H        GLY  36  10.359  -7.400   1.080
  261   1HA   GLY  36          2HA       GLY  36   9.663 -10.185   1.180
  262   2HA   GLY  36          1HA       GLY  36  11.293  -9.518   1.171
  263    H    CYS  37           H        CYS  37  10.295  -7.781   3.469
  264    HA   CYS  37           HA       CYS  37  11.335  -9.455   5.527
  265   1HB   CYS  37          2HB       CYS  37  12.026  -7.199   5.586
  266   2HB   CYS  37          1HB       CYS  37  10.381  -6.608   5.404
  267    H    GLU  38           H        GLU  38   8.283  -7.572   5.439
  268    HA   GLU  38           HA       GLU  38   7.348  -9.344   7.577
  269   1HB   GLU  38          2HB       GLU  38   6.417  -6.667   6.606
  270   2HB   GLU  38          1HB       GLU  38   5.370  -7.675   7.597
  271   1HG   GLU  38          2HG       GLU  38   8.145  -6.866   8.406
  272   2HG   GLU  38          1HG       GLU  38   6.697  -5.955   8.828
  273    H    ALA  39           H        ALA  39   6.660  -8.482   4.285
  274    HA   ALA  39           HA       ALA  39   4.180  -9.926   4.306
  275   1HB   ALA  39          1HB       ALA  39   5.613  -8.685   1.975
  276   2HB   ALA  39          2HB       ALA  39   4.409  -7.875   2.979
  277   3HB   ALA  39          3HB       ALA  39   3.946  -9.267   1.995
  278    H    GLY  40           H        GLY  40   7.455 -10.651   3.829
  279   1HA   GLY  40          2HA       GLY  40   8.459 -12.690   3.356
  280   2HA   GLY  40          1HA       GLY  40   6.853 -13.388   3.138
  281    H    GLY  41           H        GLY  41   7.353 -10.500   1.546
  282   1HA   GLY  41          2HA       GLY  41   7.855  -9.963  -0.623
  283   2HA   GLY  41          1HA       GLY  41   8.188 -11.660  -0.976
  284    H    ASN  42           H        ASN  42   5.483  -9.571  -0.007
  285    HA   ASN  42           HA       ASN  42   3.827 -10.697  -2.103
  286   1HB   ASN  42          2HB       ASN  42   3.315 -11.039   0.827
  287   2HB   ASN  42          1HB       ASN  42   1.951 -10.816  -0.261
  288   1HD2  ASN  42          1HD2      ASN  42   1.436 -12.409  -1.725
  289   2HD2  ASN  42          2HD2      ASN  42   2.102 -14.002  -1.643
  290    H    TRP  43           H        TRP  43   3.499  -8.837  -3.117
  291    HA   TRP  43           HA       TRP  43   2.886  -6.410  -1.662
  292   1HB   TRP  43          2HB       TRP  43   3.026  -7.033  -4.607
  293   2HB   TRP  43          1HB       TRP  43   2.752  -5.426  -3.940
  294    HD1  TRP  43           HD       TRP  43   5.421  -8.212  -3.707
  295    HE1  TRP  43           1HE      TRP  43   7.735  -7.084  -3.532
  296    HE3  TRP  43           3HE      TRP  43   3.921  -3.358  -3.574
  297    HZ2  TRP  43           2HZ      TRP  43   8.775  -4.434  -3.367
  298    HZ3  TRP  43           3HZ      TRP  43   5.587  -1.574  -3.410
  299    HH2  TRP  43           HH       TRP  43   7.977  -2.100  -3.317
  300    H    ALA  44           H        ALA  44   1.250  -9.067  -2.671
  301    HA   ALA  44           HA       ALA  44  -1.316  -7.627  -2.898
  302   1HB   ALA  44          1HB       ALA  44  -0.778  -9.046  -4.810
  303   2HB   ALA  44          2HB       ALA  44  -2.203  -9.640  -3.956
  304   3HB   ALA  44          3HB       ALA  44  -0.648 -10.445  -3.743
  305    H    ILE  45           H        ILE  45   0.319  -8.651  -0.446
  306    HA   ILE  45           HA       ILE  45  -1.499 -10.533   0.742
  307    HB   ILE  45           HB       ILE  45   1.062 -10.548   0.979
  308   1HG1  ILE  45          2HG1      ILE  45  -0.630 -10.670   3.472
  309   2HG1  ILE  45          1HG1      ILE  45  -0.506 -11.944   2.266
  310   1HG2  ILE  45          1HG2      ILE  45   0.403  -8.409   3.004
  311   2HG2  ILE  45          2HG2      ILE  45   1.398  -8.216   1.559
  312   3HG2  ILE  45          3HG2      ILE  45   1.947  -9.252   2.878
  313   1HD1  ILE  45          1HD1      ILE  45   0.883 -12.447   4.183
  314   2HD1  ILE  45          2HD1      ILE  45   1.732 -10.912   3.994
  315   3HD1  ILE  45          3HD1      ILE  45   1.885 -12.163   2.759
  316    H    ASN  46           H        ASN  46  -2.853 -10.095   2.454
  317    HA   ASN  46           HA       ASN  46  -2.707  -7.653   3.911
  318   1HB   ASN  46          2HB       ASN  46  -5.170  -7.057   3.328
  319   2HB   ASN  46          1HB       ASN  46  -3.884  -6.537   2.251
  320   1HD2  ASN  46          1HD2      ASN  46  -5.145  -6.376   0.468
  321   2HD2  ASN  46          2HD2      ASN  46  -5.829  -7.748  -0.340
  322    H    THR  47           H        THR  47  -3.037  -8.283   5.887
  323    HA   THR  47           HA       THR  47  -4.371 -10.773   6.391
  324    HB   THR  47           HB       THR  47  -3.703 -10.306   8.782
  325    HG1  THR  47           1HG      THR  47  -2.798  -8.437   9.261
  326   1HG2  THR  47          1HG2      THR  47  -1.320 -10.707   8.385
  327   2HG2  THR  47          2HG2      THR  47  -1.510 -10.205   6.704
  328   3HG2  THR  47          3HG2      THR  47  -2.312 -11.664   7.285
  329    H    GLY  48           H        GLY  48  -5.209  -7.472   6.439
  330   1HA   GLY  48          2HA       GLY  48  -7.470  -6.745   6.740
  331   2HA   GLY  48          1HA       GLY  48  -7.714  -8.090   7.853
  332    H    ASN  49           H        ASN  49  -4.807  -6.235   7.981
  333    HA   ASN  49           HA       ASN  49  -5.535  -5.310  10.662
  334   1HB   ASN  49          2HB       ASN  49  -3.328  -6.537   9.989
  335   2HB   ASN  49          1HB       ASN  49  -2.827  -4.953   9.412
  336   1HD2  ASN  49          1HD2      ASN  49  -2.468  -3.300  10.914
  337   2HD2  ASN  49          2HD2      ASN  49  -2.263  -3.626  12.602
  338    H    GLY  50           H        GLY  50  -5.693  -4.183   7.591
  339   1HA   GLY  50          2HA       GLY  50  -6.561  -2.051   7.042
  340   2HA   GLY  50          1HA       GLY  50  -5.812  -1.405   8.497
  341    H    TYR  51           H        TYR  51  -3.379  -3.065   7.649
  342    HA   TYR  51           HA       TYR  51  -2.262  -1.140   5.770
  343   1HB   TYR  51          2HB       TYR  51  -0.643  -3.334   7.027
  344   2HB   TYR  51          1HB       TYR  51  -0.132  -1.740   6.509
  345    HD1  TYR  51           1HD      TYR  51   0.752  -2.829   9.056
  346    HD2  TYR  51           2HD      TYR  51  -2.795  -0.654   8.126
  347    HE1  TYR  51           1HE      TYR  51   0.638  -2.047  11.384
  348    HE2  TYR  51           2HE      TYR  51  -2.903   0.141  10.465
  349    HH   TYR  51           HH       TYR  51  -0.315  -0.391  12.730
  350    H    TYR  52           H        TYR  52  -1.496  -1.747   3.786
  351    HA   TYR  52           HA       TYR  52  -2.543  -4.355   2.951
  352   1HB   TYR  52          2HB       TYR  52  -2.328  -1.772   1.414
  353   2HB   TYR  52          1HB       TYR  52  -2.781  -3.315   0.680
  354    HD1  TYR  52           1HD      TYR  52  -5.017  -3.868   0.576
  355    HD2  TYR  52           2HD      TYR  52  -3.739  -1.106   3.538
  356    HE1  TYR  52           1HE      TYR  52  -7.353  -3.557   1.290
  357    HE2  TYR  52           2HE      TYR  52  -6.059  -0.779   4.266
  358    HH   TYR  52           HH       TYR  52  -8.346  -1.034   3.312
  359    H    GLY  53           H        GLY  53  -1.510  -5.057   0.764
  360   1HA   GLY  53          2HA       GLY  53   0.898  -6.120   1.698
  361   2HA   GLY  53          1HA       GLY  53   0.229  -6.359   0.099
  362    H    GLY  54           H        GLY  54   2.847  -6.371   0.397
  363   1HA   GLY  54          2HA       GLY  54   4.567  -5.557  -0.923
  364   2HA   GLY  54          1HA       GLY  54   3.607  -4.125  -1.264
  365    H    VAL  55           H        VAL  55   3.680  -2.383   0.117
  366    HA   VAL  55           HA       VAL  55   6.138  -2.266   1.666
  367    HB   VAL  55           HB       VAL  55   5.391   0.249   1.786
  368   1HG1  VAL  55          1HG1      VAL  55   6.586   0.634  -0.333
  369   2HG1  VAL  55          2HG1      VAL  55   6.407  -1.073  -0.733
  370   3HG1  VAL  55          3HG1      VAL  55   7.383  -0.591   0.652
  371   1HG2  VAL  55          1HG2      VAL  55   3.953  -0.685  -0.698
  372   2HG2  VAL  55          2HG2      VAL  55   4.113   0.973  -0.126
  373   3HG2  VAL  55          3HG2      VAL  55   3.159  -0.188   0.798
  374    H    GLN  56           H        GLN  56   2.926  -2.845   2.218
  375    HA   GLN  56           HA       GLN  56   1.872  -3.443   4.151
  376   1HB   GLN  56          2HB       GLN  56   4.602  -3.190   5.404
  377   2HB   GLN  56          1HB       GLN  56   3.240  -4.110   6.021
  378   1HG   GLN  56          2HG       GLN  56   3.621  -5.840   4.666
  379   2HG   GLN  56          1HG       GLN  56   4.078  -4.815   3.303
  380   1HE2  GLN  56          1HE2      GLN  56   5.878  -6.018   2.812
  381   2HE2  GLN  56          2HE2      GLN  56   7.302  -6.004   3.795
  382    H    PHE  57           H        PHE  57   1.590  -0.681   3.684
  383    HA   PHE  57           HA       PHE  57   1.497   0.121   6.495
  384   1HB   PHE  57          2HB       PHE  57   1.872   2.441   5.976
  385   2HB   PHE  57          1HB       PHE  57   3.208   1.456   5.420
  386    HD1  PHE  57           1HD      PHE  57   1.535   4.264   4.699
  387    HD2  PHE  57           2HD      PHE  57   2.602   0.615   2.787
  388    HE1  PHE  57           1HE      PHE  57   1.465   5.389   2.514
  389    HE2  PHE  57           2HE      PHE  57   2.520   1.738   0.604
  390    HZ   PHE  57           HZ       PHE  57   1.976   4.129   0.455
  391    H    ASP  58           H        ASP  58  -0.118   1.759   6.987
  392    HA   ASP  58           HA       ASP  58  -2.553   0.435   6.497
  393   1HB   ASP  58          2HB       ASP  58  -2.065   1.402   8.646
  394   2HB   ASP  58          1HB       ASP  58  -1.931   2.995   7.939
  395    H    GLN  59           H        GLN  59  -4.358   1.007   5.518
  396    HA   GLN  59           HA       GLN  59  -4.360   2.254   3.075
  397   1HB   GLN  59          2HB       GLN  59  -6.085   0.798   3.500
  398   2HB   GLN  59          1HB       GLN  59  -6.419   1.474   5.087
  399   1HG   GLN  59          2HG       GLN  59  -8.247   2.132   3.863
  400   2HG   GLN  59          1HG       GLN  59  -7.203   3.543   3.749
  401   1HE2  GLN  59          1HE2      GLN  59  -5.428   2.204   1.796
  402   2HE2  GLN  59          2HE2      GLN  59  -6.297   2.219   0.299
  403    H    GLY  60           H        GLY  60  -5.020   3.598   6.244
  404   1HA   GLY  60          2HA       GLY  60  -6.072   6.092   5.351
  405   2HA   GLY  60          1HA       GLY  60  -5.422   5.756   6.952
  406    H    THR  61           H        THR  61  -2.848   5.014   6.292
  407    HA   THR  61           HA       THR  61  -1.578   7.514   5.817
  408    HB   THR  61           HB       THR  61  -0.417   4.760   5.940
  409    HG1  THR  61           1HG      THR  61  -1.450   6.413   7.839
  410   1HG2  THR  61          1HG2      THR  61   1.121   6.366   4.908
  411   2HG2  THR  61          2HG2      THR  61   1.693   5.884   6.504
  412   3HG2  THR  61          3HG2      THR  61   0.911   7.450   6.285
  413    H    TRP  62           H        TRP  62  -2.039   4.569   3.917
  414    HA   TRP  62           HA       TRP  62  -0.690   5.262   1.581
  415   1HB   TRP  62          2HB       TRP  62  -1.717   3.077   1.931
  416   2HB   TRP  62          1HB       TRP  62  -3.311   3.819   2.007
  417    HD1  TRP  62           HD       TRP  62  -4.471   4.506  -0.265
  418    HE1  TRP  62           1HE      TRP  62  -4.079   3.760  -2.691
  419    HE3  TRP  62           3HE      TRP  62   0.166   2.438   0.285
  420    HZ2  TRP  62           2HZ      TRP  62  -2.048   2.433  -4.203
  421    HZ3  TRP  62           3HZ      TRP  62   1.276   1.461  -1.678
  422    HH2  TRP  62           HH       TRP  62   0.210   1.455  -3.873
  423    H    GLU  63           H        GLU  63  -3.993   5.941   2.605
  424    HA   GLU  63           HA       GLU  63  -4.747   7.492   0.403
  425   1HB   GLU  63          2HB       GLU  63  -6.381   6.543   1.900
  426   2HB   GLU  63          1HB       GLU  63  -5.729   7.438   3.262
  427   1HG   GLU  63          2HG       GLU  63  -6.388   9.540   2.061
  428   2HG   GLU  63          1HG       GLU  63  -7.237   8.518   0.902
  429    H    ALA  64           H        ALA  64  -3.049   8.229   3.375
  430    HA   ALA  64           HA       ALA  64  -3.402  11.022   3.400
  431   1HB   ALA  64          1HB       ALA  64  -2.674   9.726   5.356
  432   2HB   ALA  64          2HB       ALA  64  -1.600  11.083   5.016
  433   3HB   ALA  64          3HB       ALA  64  -1.119   9.444   4.573
  434    H    ASN  65           H        ASN  65  -0.731   9.024   2.084
  435    HA   ASN  65           HA       ASN  65   0.594  11.287   0.939
  436   1HB   ASN  65          2HB       ASN  65   0.862   8.459  -0.082
  437   2HB   ASN  65          1HB       ASN  65   2.046   9.758  -0.149
  438   1HD2  ASN  65          1HD2      ASN  65   0.827   7.138   1.610
  439   2HD2  ASN  65          2HD2      ASN  65   1.892   7.255   2.975
  440    H    GLY  66           H        GLY  66  -2.117   9.415   0.096
  441   1HA   GLY  66          2HA       GLY  66  -3.695  10.057  -1.533
  442   2HA   GLY  66          1HA       GLY  66  -2.431  10.945  -2.376
  443    H    GLY  67           H        GLY  67  -2.750   7.562  -1.293
  444   1HA   GLY  67          2HA       GLY  67  -1.332   6.703  -3.646
  445   2HA   GLY  67          1HA       GLY  67  -1.891   5.689  -2.325
  446    H    LEU  68           H        LEU  68  -4.612   7.148  -2.849
  447    HA   LEU  68           HA       LEU  68  -5.737   4.916  -4.044
  448   1HB   LEU  68          2HB       LEU  68  -6.864   7.647  -3.546
  449   2HB   LEU  68          1HB       LEU  68  -7.824   6.330  -4.187
  450    HG   LEU  68           HG       LEU  68  -7.064   5.059  -2.067
  451   1HD1  LEU  68          1HD1      LEU  68  -6.714   6.560  -0.136
  452   2HD1  LEU  68          2HD1      LEU  68  -6.522   7.902  -1.267
  453   3HD1  LEU  68          3HD1      LEU  68  -5.382   6.556  -1.289
  454   1HD2  LEU  68          1HD2      LEU  68  -9.355   5.746  -2.520
  455   2HD2  LEU  68          2HD2      LEU  68  -9.002   7.357  -1.895
  456   3HD2  LEU  68          3HD2      LEU  68  -8.952   5.962  -0.816
  457    H    ARG  69           H        ARG  69  -4.482   7.802  -5.460
  458    HA   ARG  69           HA       ARG  69  -5.768   7.563  -7.973
  459   1HB   ARG  69          2HB       ARG  69  -3.955   9.041  -8.783
  460   2HB   ARG  69          1HB       ARG  69  -4.774   9.650  -7.352
  461   1HG   ARG  69          2HG       ARG  69  -2.958   9.404  -6.025
  462   2HG   ARG  69          1HG       ARG  69  -2.339   8.024  -6.943
  463   1HD   ARG  69          2HD       ARG  69  -1.227   9.334  -8.413
  464   2HD   ARG  69          1HD       ARG  69  -2.437  10.618  -8.363
  465    HE   ARG  69           HE       ARG  69  -1.008  10.472  -5.913
  466   1HH1  ARG  69          1HH1      ARG  69  -0.713  11.569  -9.233
  467   2HH1  ARG  69          2HH1      ARG  69   0.427  12.830  -8.847
  468   1HH2  ARG  69          1HH2      ARG  69   0.495  12.119  -5.412
  469   2HH2  ARG  69          2HH2      ARG  69   1.137  13.122  -6.680
  470    H    TYR  70           H        TYR  70  -2.958   6.108  -6.503
  471    HA   TYR  70           HA       TYR  70  -1.973   4.925  -8.949
  472   1HB   TYR  70          2HB       TYR  70  -1.428   4.267  -6.044
  473   2HB   TYR  70          1HB       TYR  70  -0.474   3.705  -7.412
  474    HD1  TYR  70           1HD      TYR  70   1.145   5.189  -8.466
  475    HD2  TYR  70           2HD      TYR  70  -1.306   6.531  -5.260
  476    HE1  TYR  70           1HE      TYR  70   2.606   7.144  -8.175
  477    HE2  TYR  70           2HE      TYR  70   0.142   8.490  -4.970
  478    HH   TYR  70           HH       TYR  70   2.498   9.141  -5.465
  479    H    ALA  71           H        ALA  71  -3.982   4.303  -6.256
  480    HA   ALA  71           HA       ALA  71  -5.827   2.579  -7.206
  481   1HB   ALA  71          1HB       ALA  71  -5.135   0.341  -6.448
  482   2HB   ALA  71          2HB       ALA  71  -3.543   0.971  -6.031
  483   3HB   ALA  71          3HB       ALA  71  -4.062   0.935  -7.716
  484    HA   PRO  72           HA       PRO  72  -6.988   3.998  -3.167
  485   1HB   PRO  72          2HB       PRO  72  -9.103   2.030  -3.219
  486   2HB   PRO  72          1HB       PRO  72  -9.192   3.780  -3.157
  487   1HG   PRO  72          2HG       PRO  72  -9.800   2.255  -5.368
  488   2HG   PRO  72          1HG       PRO  72  -9.379   3.975  -5.397
  489   1HD   PRO  72          2HD       PRO  72  -7.819   1.657  -6.267
  490   2HD   PRO  72          1HD       PRO  72  -7.609   3.377  -6.652
  491    H    ARG  73           H        ARG  73  -5.881   0.923  -3.869
  492    HA   ARG  73           HA       ARG  73  -5.316   0.483  -1.050
  493   1HB   ARG  73          2HB       ARG  73  -6.018  -1.835  -1.067
  494   2HB   ARG  73          1HB       ARG  73  -7.385  -0.832  -1.535
  495   1HG   ARG  73          2HG       ARG  73  -6.722  -1.328  -3.932
  496   2HG   ARG  73          1HG       ARG  73  -5.666  -2.575  -3.260
  497   1HD   ARG  73          2HD       ARG  73  -8.620  -2.412  -2.691
  498   2HD   ARG  73          1HD       ARG  73  -7.942  -3.341  -4.024
  499    HE   ARG  73           HE       ARG  73  -6.592  -4.198  -1.784
  500   1HH1  ARG  73          1HH1      ARG  73  -9.909  -4.108  -2.907
  501   2HH1  ARG  73          2HH1      ARG  73 -10.403  -5.490  -1.973
  502   1HH2  ARG  73          1HH2      ARG  73  -7.215  -6.050  -0.608
  503   2HH2  ARG  73          2HH2      ARG  73  -8.858  -6.607  -0.665
  504    H    ALA  74           H        ALA  74  -3.372  -0.482  -0.747
  505    HA   ALA  74           HA       ALA  74  -1.417  -0.147  -2.680
  506   1HB   ALA  74          1HB       ALA  74   0.103  -1.173  -1.136
  507   2HB   ALA  74          2HB       ALA  74  -1.224  -1.943  -0.272
  508   3HB   ALA  74          3HB       ALA  74  -1.042  -0.189  -0.223
  509    H    ASP  75           H        ASP  75  -3.322  -2.968  -1.853
  510    HA   ASP  75           HA       ASP  75  -1.548  -4.743  -3.282
  511   1HB   ASP  75          2HB       ASP  75  -3.031  -6.524  -2.544
  512   2HB   ASP  75          1HB       ASP  75  -2.606  -5.482  -1.194
  513    H    LEU  76           H        LEU  76  -3.810  -2.636  -4.253
  514    HA   LEU  76           HA       LEU  76  -4.653  -4.242  -6.561
  515   1HB   LEU  76          2HB       LEU  76  -6.336  -2.804  -5.439
  516   2HB   LEU  76          1HB       LEU  76  -5.348  -1.401  -5.785
  517    HG   LEU  76           HG       LEU  76  -5.654  -1.868  -8.224
  518   1HD1  LEU  76          1HD1      LEU  76  -7.528  -3.338  -8.857
  519   2HD1  LEU  76          2HD1      LEU  76  -7.639  -3.883  -7.183
  520   3HD1  LEU  76          3HD1      LEU  76  -6.186  -4.218  -8.126
  521   1HD2  LEU  76          1HD2      LEU  76  -6.977  -0.180  -7.070
  522   2HD2  LEU  76          2HD2      LEU  76  -8.157  -1.406  -6.606
  523   3HD2  LEU  76          3HD2      LEU  76  -7.936  -0.994  -8.307
  524    H    ALA  77           H        ALA  77  -2.713  -1.530  -5.551
  525    HA   ALA  77           HA       ALA  77  -1.712  -0.883  -8.152
  526   1HB   ALA  77          1HB       ALA  77  -1.883   0.795  -6.380
  527   2HB   ALA  77          2HB       ALA  77  -0.212   0.598  -6.908
  528   3HB   ALA  77          3HB       ALA  77  -0.748  -0.128  -5.393
  529    H    THR  78           H        THR  78   0.638  -1.018  -8.609
  530    HA   THR  78           HA       THR  78   1.656  -3.613  -7.707
  531    HB   THR  78           HB       THR  78   3.021  -3.631  -9.696
  532    HG1  THR  78           1HG      THR  78   2.004  -0.991 -10.163
  533   1HG2  THR  78          1HG2      THR  78   1.233  -3.452 -11.435
  534   2HG2  THR  78          2HG2      THR  78   0.186  -2.725 -10.209
  535   3HG2  THR  78          3HG2      THR  78   0.760  -4.382 -10.013
  536    H    ARG  79           H        ARG  79   4.219  -3.571  -7.877
  537    HA   ARG  79           HA       ARG  79   5.229  -2.485  -5.607
  538   1HB   ARG  79          2HB       ARG  79   6.732  -2.939  -8.190
  539   2HB   ARG  79          1HB       ARG  79   7.484  -2.691  -6.623
  540   1HG   ARG  79          2HG       ARG  79   6.356  -4.736  -5.811
  541   2HG   ARG  79          1HG       ARG  79   5.740  -4.996  -7.446
  542   1HD   ARG  79          2HD       ARG  79   7.779  -6.297  -6.999
  543   2HD   ARG  79          1HD       ARG  79   7.993  -5.138  -8.311
  544    HE   ARG  79           HE       ARG  79   8.865  -4.411  -5.608
  545   1HH1  ARG  79          1HH1      ARG  79   9.630  -5.190  -8.926
  546   2HH1  ARG  79          2HH1      ARG  79  11.292  -4.707  -8.792
  547   1HH2  ARG  79          1HH2      ARG  79  11.057  -3.725  -5.438
  548   2HH2  ARG  79          2HH2      ARG  79  12.115  -3.884  -6.806
  549    H    GLU  80           H        GLU  80   5.444  -1.064  -8.827
  550    HA   GLU  80           HA       GLU  80   6.948   1.169  -8.089
  551   1HB   GLU  80          2HB       GLU  80   6.179   2.099 -10.290
  552   2HB   GLU  80          1HB       GLU  80   6.940   0.517 -10.339
  553   1HG   GLU  80          2HG       GLU  80   4.528  -0.387 -10.272
  554   2HG   GLU  80          1HG       GLU  80   4.083   1.245 -10.773
  555    H    GLU  81           H        GLU  81   3.356   0.887  -8.379
  556    HA   GLU  81           HA       GLU  81   2.834   3.526  -7.549
  557   1HB   GLU  81          2HB       GLU  81   1.262   0.986  -7.292
  558   2HB   GLU  81          1HB       GLU  81   0.655   2.534  -6.737
  559   1HG   GLU  81          2HG       GLU  81  -0.288   2.260  -8.799
  560   2HG   GLU  81          1HG       GLU  81   1.052   3.346  -9.115
  561    H    GLN  82           H        GLN  82   3.000   0.498  -5.684
  562    HA   GLN  82           HA       GLN  82   2.329   1.550  -3.179
  563   1HB   GLN  82          2HB       GLN  82   3.862  -0.837  -4.112
  564   2HB   GLN  82          1HB       GLN  82   3.897  -0.428  -2.406
  565   1HG   GLN  82          2HG       GLN  82   1.811  -1.151  -2.061
  566   2HG   GLN  82          1HG       GLN  82   1.219  -0.494  -3.588
  567   1HE2  GLN  82          1HE2      GLN  82   1.050  -3.219  -2.179
  568   2HE2  GLN  82          2HE2      GLN  82   1.456  -4.314  -3.457
  569    H    ILE  83           H        ILE  83   5.408   1.208  -4.803
  570    HA   ILE  83           HA       ILE  83   7.080   2.100  -2.739
  571    HB   ILE  83           HB       ILE  83   7.317   1.897  -5.711
  572   1HG1  ILE  83          2HG1      ILE  83   9.196   0.854  -3.611
  573   2HG1  ILE  83          1HG1      ILE  83   7.682   0.029  -3.938
  574   1HG2  ILE  83          1HG2      ILE  83   8.403   4.014  -5.201
  575   2HG2  ILE  83          2HG2      ILE  83   9.588   2.784  -5.647
  576   3HG2  ILE  83          3HG2      ILE  83   9.371   3.227  -3.953
  577   1HD1  ILE  83          1HD1      ILE  83   8.362  -0.267  -6.269
  578   2HD1  ILE  83          2HD1      ILE  83   9.506  -0.996  -5.141
  579   3HD1  ILE  83          3HD1      ILE  83   9.888   0.544  -5.913
  580    H    ALA  84           H        ALA  84   5.432   3.858  -5.352
  581    HA   ALA  84           HA       ALA  84   6.609   6.361  -4.861
  582   1HB   ALA  84          1HB       ALA  84   5.461   5.831  -6.941
  583   2HB   ALA  84          2HB       ALA  84   4.782   7.280  -6.200
  584   3HB   ALA  84          3HB       ALA  84   3.923   5.744  -6.085
  585    H    VAL  85           H        VAL  85   3.560   4.961  -3.689
  586    HA   VAL  85           HA       VAL  85   2.744   7.225  -2.211
  587    HB   VAL  85           HB       VAL  85   2.088   4.350  -1.618
  588   1HG1  VAL  85          1HG1      VAL  85   1.374   5.945   0.098
  589   2HG1  VAL  85          2HG1      VAL  85  -0.015   5.265  -0.749
  590   3HG1  VAL  85          3HG1      VAL  85   0.538   6.896  -1.129
  591   1HG2  VAL  85          1HG2      VAL  85   1.711   4.783  -3.976
  592   2HG2  VAL  85          2HG2      VAL  85   0.767   6.218  -3.578
  593   3HG2  VAL  85          3HG2      VAL  85   0.174   4.621  -3.128
  594    H    ALA  86           H        ALA  86   4.393   4.224  -1.181
  595    HA   ALA  86           HA       ALA  86   4.670   4.945   1.518
  596   1HB   ALA  86          1HB       ALA  86   6.356   3.066  -0.132
  597   2HB   ALA  86          2HB       ALA  86   4.872   2.642   0.723
  598   3HB   ALA  86          3HB       ALA  86   6.304   3.136   1.630
  599    H    GLU  87           H        GLU  87   6.503   5.669  -1.338
  600    HA   GLU  87           HA       GLU  87   8.834   6.476   0.108
  601   1HB   GLU  87          2HB       GLU  87   9.883   6.946  -1.890
  602   2HB   GLU  87          1HB       GLU  87   8.786   5.641  -2.294
  603   1HG   GLU  87          2HG       GLU  87   8.458   6.929  -4.066
  604   2HG   GLU  87          1HG       GLU  87   7.247   7.660  -3.014
  605    H    VAL  88           H        VAL  88   5.951   8.171  -0.972
  606    HA   VAL  88           HA       VAL  88   6.787  10.745  -0.175
  607    HB   VAL  88           HB       VAL  88   4.026   9.509   0.109
  608   1HG1  VAL  88          1HG1      VAL  88   3.210  11.783   0.364
  609   2HG1  VAL  88          2HG1      VAL  88   4.852  12.413   0.243
  610   3HG1  VAL  88          3HG1      VAL  88   4.392  11.415   1.630
  611   1HG2  VAL  88          1HG2      VAL  88   3.496  10.763  -1.925
  612   2HG2  VAL  88          2HG2      VAL  88   4.808   9.617  -2.209
  613   3HG2  VAL  88          3HG2      VAL  88   5.164  11.333  -2.016
  614    H    THR  89           H        THR  89   5.579   7.961   1.576
  615    HA   THR  89           HA       THR  89   5.355   9.219   4.098
  616    HB   THR  89           HB       THR  89   5.883   6.279   3.730
  617    HG1  THR  89           1HG      THR  89   3.852   7.791   2.654
  618   1HG2  THR  89          1HG2      THR  89   5.609   7.258   6.006
  619   2HG2  THR  89          2HG2      THR  89   4.393   6.047   5.600
  620   3HG2  THR  89          3HG2      THR  89   3.987   7.763   5.545
  621    H    ARG  90           H        ARG  90   7.933   7.351   2.531
  622    HA   ARG  90           HA       ARG  90   9.625   7.011   4.740
  623   1HB   ARG  90          2HB       ARG  90  11.335   6.391   3.212
  624   2HB   ARG  90          1HB       ARG  90   9.815   5.849   2.513
  625   1HG   ARG  90          2HG       ARG  90   9.800   7.632   0.948
  626   2HG   ARG  90          1HG       ARG  90  11.132   8.444   1.763
  627   1HD   ARG  90          2HD       ARG  90  12.676   6.793   1.063
  628   2HD   ARG  90          1HD       ARG  90  11.388   5.736   0.485
  629    HE   ARG  90           HE       ARG  90  11.038   7.996  -0.972
  630   1HH1  ARG  90          1HH1      ARG  90  13.884   6.059  -0.376
  631   2HH1  ARG  90          2HH1      ARG  90  14.532   6.279  -1.974
  632   1HH2  ARG  90          1HH2      ARG  90  11.853   8.274  -3.073
  633   2HH2  ARG  90          2HH2      ARG  90  13.366   7.529  -3.513
  634    H    LEU  91           H        LEU  91   9.212   9.692   2.583
  635    HA   LEU  91           HA       LEU  91  11.713  10.931   3.230
  636   1HB   LEU  91          2HB       LEU  91  10.999  12.806   1.892
  637   2HB   LEU  91          1HB       LEU  91  10.673  11.309   1.051
  638    HG   LEU  91           HG       LEU  91   8.250  11.645   2.041
  639   1HD1  LEU  91          1HD1      LEU  91   7.626  14.009   2.130
  640   2HD1  LEU  91          2HD1      LEU  91   9.321  14.463   1.956
  641   3HD1  LEU  91          3HD1      LEU  91   8.785  13.596   3.395
  642   1HD2  LEU  91          1HD2      LEU  91   8.818  11.536  -0.318
  643   2HD2  LEU  91          2HD2      LEU  91   9.346  13.218  -0.282
  644   3HD2  LEU  91          3HD2      LEU  91   7.648  12.820  -0.015
  645    H    ARG  92           H        ARG  92   8.657  10.822   4.696
  646    HA   ARG  92           HA       ARG  92   8.913  13.364   6.051
  647   1HB   ARG  92          2HB       ARG  92   6.876  11.260   6.654
  648   2HB   ARG  92          1HB       ARG  92   6.758  13.001   6.881
  649   1HG   ARG  92          2HG       ARG  92   6.444  13.392   4.599
  650   2HG   ARG  92          1HG       ARG  92   7.004  11.771   4.166
  651   1HD   ARG  92          2HD       ARG  92   4.397  12.633   5.318
  652   2HD   ARG  92          1HD       ARG  92   4.732  11.517   3.987
  653    HE   ARG  92           HE       ARG  92   5.779  10.199   6.033
  654   1HH1  ARG  92          1HH1      ARG  92   2.688  11.833   5.730
  655   2HH1  ARG  92          2HH1      ARG  92   1.888  10.796   6.872
  656   1HH2  ARG  92          1HH2      ARG  92   4.709   8.843   7.571
  657   2HH2  ARG  92          2HH2      ARG  92   3.022   9.095   7.909
  658    H    GLN  93           H        GLN  93   8.818   9.920   6.847
  659    HA   GLN  93           HA       GLN  93   9.477  10.648   9.580
  660   1HB   GLN  93          2HB       GLN  93   8.336   8.845  10.334
  661   2HB   GLN  93          1HB       GLN  93   7.514   9.076   8.796
  662   1HG   GLN  93          2HG       GLN  93   9.784   7.148   9.210
  663   2HG   GLN  93          1HG       GLN  93   8.084   6.718   9.377
  664   1HE2  GLN  93          1HE2      GLN  93   6.790   6.630   7.537
  665   2HE2  GLN  93          2HE2      GLN  93   7.490   6.540   5.946
  666    H    GLY  94           H        GLY  94  10.896   8.893   6.902
  667   1HA   GLY  94          2HA       GLY  94  13.245   8.767   6.650
  668   2HA   GLY  94          1HA       GLY  94  13.421   9.002   8.384
  669    H    TRP  95           H        TRP  95  11.359   6.716   6.710
  670    HA   TRP  95           HA       TRP  95  11.187   4.480   6.691
  671   1HB   TRP  95          2HB       TRP  95  14.088   4.239   7.471
  672   2HB   TRP  95          1HB       TRP  95  13.106   3.112   6.542
  673    HD1  TRP  95           HD       TRP  95  14.891   6.482   6.172
  674    HE1  TRP  95           1HE      TRP  95  15.400   6.862   3.694
  675    HE3  TRP  95           3HE      TRP  95  12.361   2.494   4.239
  676    HZ2  TRP  95           2HZ      TRP  95  14.783   5.636   1.220
  677    HZ3  TRP  95           3HZ      TRP  95  12.359   2.174   1.801
  678    HH2  TRP  95           HH       TRP  95  13.546   3.713   0.324
  679    H    GLY  96           H        GLY  96  11.390   6.245   9.270
  680   1HA   GLY  96          2HA       GLY  96  11.930   4.402  11.373
  681   2HA   GLY  96          1HA       GLY  96  11.073   5.929  11.531
  682    H    ALA  97           H        ALA  97   9.087   5.124   9.489
  683    HA   ALA  97           HA       ALA  97   7.185   3.899  11.214
  684   1HB   ALA  97          1HB       ALA  97   7.034   4.385   8.239
  685   2HB   ALA  97          2HB       ALA  97   6.515   5.506   9.497
  686   3HB   ALA  97          3HB       ALA  97   5.680   3.968   9.289
  687    H    TRP  98           H        TRP  98   9.336   2.785   8.722
  688    HA   TRP  98           HA       TRP  98   8.280   0.061   8.953
  689   1HB   TRP  98          2HB       TRP  98  10.368   1.282   7.117
  690   2HB   TRP  98          1HB       TRP  98   9.862  -0.403   7.075
  691    HD1  TRP  98           HD       TRP  98   7.397  -0.925   6.152
  692    HE1  TRP  98           1HE      TRP  98   5.857   0.371   4.556
  693    HE3  TRP  98           3HE      TRP  98   9.648   3.704   6.396
  694    HZ2  TRP  98           2HZ      TRP  98   5.616   2.995   3.520
  695    HZ3  TRP  98           3HZ      TRP  98   8.686   5.533   5.055
  696    HH2  TRP  98           HH       TRP  98   6.719   5.178   3.667
  697    HA   PRO  99           HA       PRO  99  11.341   0.033  12.195
  698   1HB   PRO  99          2HB       PRO  99  10.207  -2.612  12.839
  699   2HB   PRO  99          1HB       PRO  99  10.322  -1.158  13.828
  700   1HG   PRO  99          2HG       PRO  99   7.980  -1.918  12.840
  701   2HG   PRO  99          1HG       PRO  99   8.447  -0.204  12.881
  702   1HD   PRO  99          2HD       PRO  99   8.594  -2.124  10.565
  703   2HD   PRO  99          1HD       PRO  99   7.886  -0.488  10.617
  704    H    VAL 100           H        VAL 100  11.117  -3.444  11.801
  705    HA   VAL 100           HA       VAL 100  13.971  -3.588  11.735
  706    HB   VAL 100           HB       VAL 100  11.951  -5.801  11.293
  707   1HG1  VAL 100          1HG1      VAL 100  13.749  -7.300  11.986
  708   2HG1  VAL 100          2HG1      VAL 100  14.849  -5.926  12.114
  709   3HG1  VAL 100          3HG1      VAL 100  14.193  -6.388  10.542
  710   1HG2  VAL 100          1HG2      VAL 100  11.578  -4.687  13.428
  711   2HG2  VAL 100          2HG2      VAL 100  13.280  -4.898  13.846
  712   3HG2  VAL 100          3HG2      VAL 100  12.233  -6.307  13.667
  713    H    CYS 101           H        CYS 101  11.434  -3.577   9.435
  714    HA   CYS 101           HA       CYS 101  12.737  -5.098   7.420
  715   1HB   CYS 101          2HB       CYS 101  10.378  -3.225   7.202
  716   2HB   CYS 101          1HB       CYS 101  10.870  -4.409   5.992
  717    H    ALA 102           H        ALA 102  12.418  -1.620   8.031
  718    HA   ALA 102           HA       ALA 102  13.572  -0.858   5.543
  719   1HB   ALA 102          1HB       ALA 102  12.189   0.691   6.800
  720   2HB   ALA 102          2HB       ALA 102  13.799   1.362   6.536
  721   3HB   ALA 102          3HB       ALA 102  13.367   0.702   8.112
  722    H    ALA 103           H        ALA 103  14.866  -1.288   8.812
  723    HA   ALA 103           HA       ALA 103  17.497  -0.488   8.258
  724   1HB   ALA 103          1HB       ALA 103  16.639  -0.758  10.532
  725   2HB   ALA 103          2HB       ALA 103  18.109  -1.704  10.288
  726   3HB   ALA 103          3HB       ALA 103  16.534  -2.502  10.286
  727    H    ARG 104           H        ARG 104  15.863  -3.571   7.945
  728    HA   ARG 104           HA       ARG 104  18.131  -5.062   7.118
  729   1HB   ARG 104          2HB       ARG 104  15.159  -5.481   6.925
  730   2HB   ARG 104          1HB       ARG 104  16.289  -6.613   6.191
  731   1HG   ARG 104          2HG       ARG 104  16.217  -5.884   9.111
  732   2HG   ARG 104          1HG       ARG 104  15.498  -7.330   8.403
  733   1HD   ARG 104          2HD       ARG 104  17.574  -8.016   9.264
  734   2HD   ARG 104          1HD       ARG 104  17.810  -7.873   7.524
  735    HE   ARG 104           HE       ARG 104  18.526  -5.549   9.120
  736   1HH1  ARG 104          1HH1      ARG 104  19.605  -8.440   7.467
  737   2HH1  ARG 104          2HH1      ARG 104  21.270  -7.964   7.444
  738   1HH2  ARG 104          1HH2      ARG 104  20.712  -4.918   9.102
  739   2HH2  ARG 104          2HH2      ARG 104  21.905  -5.952   8.369
  740    H    ALA 105           H        ALA 105  15.758  -3.109   5.443
  741    HA   ALA 105           HA       ALA 105  16.431  -4.118   2.816
  742   1HB   ALA 105          1HB       ALA 105  14.771  -2.531   2.040
  743   2HB   ALA 105          2HB       ALA 105  14.674  -1.827   3.655
  744   3HB   ALA 105          3HB       ALA 105  14.155  -3.492   3.385
  745    H    GLY 106           H        GLY 106  17.456  -1.505   4.854
  746   1HA   GLY 106          2HA       GLY 106  19.590  -0.449   4.236
  747   2HA   GLY 106          1HA       GLY 106  18.986  -0.378   2.587
  748    H    ALA 107           H        ALA 107  17.833   0.606   5.798
  749    HA   ALA 107           HA       ALA 107  16.316   2.787   4.961
  750   1HB   ALA 107          1HB       ALA 107  17.608   2.327   7.646
  751   2HB   ALA 107          2HB       ALA 107  16.039   1.699   7.140
  752   3HB   ALA 107          3HB       ALA 107  16.282   3.439   7.305
  753    H    ARG 108           H        ARG 108  16.722   5.024   5.121
  754    HA   ARG 108           HA       ARG 108  19.379   6.005   5.420
  755   1HB   ARG 108          2HB       ARG 108  19.143   6.802   2.834
  756   2HB   ARG 108          1HB       ARG 108  20.069   5.399   3.347
  757   1HG   ARG 108          2HG       ARG 108  18.788   4.069   2.139
  758   2HG   ARG 108          1HG       ARG 108  17.350   4.604   3.008
  759   1HD   ARG 108          2HD       ARG 108  18.551   5.685   0.463
  760   2HD   ARG 108          1HD       ARG 108  16.913   5.091   0.741
  761    HE   ARG 108           HE       ARG 108  17.223   7.282   2.397
  762   1HH1  ARG 108          1HH1      ARG 108  17.340   6.674  -1.066
  763   2HH1  ARG 108          2HH1      ARG 108  16.826   8.276  -1.486
  764   1HH2  ARG 108          1HH2      ARG 108  16.551   9.376   1.833
  765   2HH2  ARG 108          2HH2      ARG 108  16.383   9.821   0.159
  Start of MODEL   26
    1   1H    ASN   1          1HT       ASN   1  -7.687  49.482  -2.141
    2   2H    ASN   1          2HT       ASN   1  -9.245  49.445  -1.469
    3   3H    ASN   1          3HT       ASN   1  -8.205  48.119  -1.278
    4    HA   ASN   1           HA       ASN   1  -7.716  50.825  -0.180
    5   1HB   ASN   1          2HB       ASN   1  -8.754  48.287   1.097
    6   2HB   ASN   1          1HB       ASN   1  -8.080  49.618   2.034
    7   1HD2  ASN   1          1HD2      ASN   1 -10.081  49.914   3.083
    8   2HD2  ASN   1          2HD2      ASN   1 -11.415  50.677   2.268
    9    H    VAL   2           H        VAL   2  -5.637  51.155  -0.073
   10    HA   VAL   2           HA       VAL   2  -3.433  50.722  -0.522
   11    HB   VAL   2           HB       VAL   2  -3.657  51.061   1.876
   12   1HG1  VAL   2          1HG1      VAL   2  -3.536  49.190   3.456
   13   2HG1  VAL   2          2HG1      VAL   2  -3.723  48.062   2.111
   14   3HG1  VAL   2          3HG1      VAL   2  -5.025  49.182   2.511
   15   1HG2  VAL   2          1HG2      VAL   2  -1.442  50.856   0.949
   16   2HG2  VAL   2          2HG2      VAL   2  -1.504  49.101   1.108
   17   3HG2  VAL   2          3HG2      VAL   2  -1.483  50.112   2.551
   18    H    VAL   3           H        VAL   3  -4.363  49.223  -2.289
   19    HA   VAL   3           HA       VAL   3  -4.216  46.463  -2.005
   20    HB   VAL   3           HB       VAL   3  -5.527  47.409  -3.766
   21   1HG1  VAL   3          1HG1      VAL   3  -2.963  48.432  -4.975
   22   2HG1  VAL   3          2HG1      VAL   3  -4.216  49.414  -4.217
   23   3HG1  VAL   3          3HG1      VAL   3  -4.567  48.535  -5.706
   24   1HG2  VAL   3          1HG2      VAL   3  -4.753  46.077  -5.687
   25   2HG2  VAL   3          2HG2      VAL   3  -4.662  45.181  -4.171
   26   3HG2  VAL   3          3HG2      VAL   3  -3.198  45.855  -4.886
   27    H    VAL   4           H        VAL   4  -2.338  45.682  -1.181
   28    HA   VAL   4           HA       VAL   4   0.013  45.927  -2.918
   29    HB   VAL   4           HB       VAL   4   0.315  46.771  -0.658
   30   1HG1  VAL   4          1HG1      VAL   4  -0.244  43.962   0.228
   31   2HG1  VAL   4          2HG1      VAL   4  -1.222  45.389   0.570
   32   3HG1  VAL   4          3HG1      VAL   4   0.393  45.237   1.264
   33   1HG2  VAL   4          1HG2      VAL   4   2.259  45.945  -1.810
   34   2HG2  VAL   4          2HG2      VAL   4   1.915  44.305  -1.262
   35   3HG2  VAL   4          3HG2      VAL   4   2.381  45.546  -0.098
   36    H    THR   5           H        THR   5   1.144  44.108  -3.412
   37    HA   THR   5           HA       THR   5  -0.120  41.532  -2.783
   38    HB   THR   5           HB       THR   5   0.635  40.833  -5.161
   39    HG1  THR   5           1HG      THR   5   1.047  42.397  -6.564
   40   1HG2  THR   5          1HG2      THR   5  -1.520  41.559  -6.102
   41   2HG2  THR   5          2HG2      THR   5  -1.728  42.664  -4.743
   42   3HG2  THR   5          3HG2      THR   5  -1.691  40.923  -4.466
   43    HA   PRO   6           HA       PRO   6   3.924  40.830  -1.050
   44   1HB   PRO   6          2HB       PRO   6   2.843  38.068  -1.410
   45   2HB   PRO   6          1HB       PRO   6   3.733  38.764  -0.046
   46   1HG   PRO   6          2HG       PRO   6   1.122  38.545   0.126
   47   2HG   PRO   6          1HG       PRO   6   1.915  40.048   0.639
   48   1HD   PRO   6          2HD       PRO   6   0.382  39.491  -1.869
   49   2HD   PRO   6          1HD       PRO   6   0.419  40.960  -0.876
   50    H    ALA   7           H        ALA   7   5.392  41.203  -2.380
   51    HA   ALA   7           HA       ALA   7   5.896  39.401  -4.645
   52   1HB   ALA   7          1HB       ALA   7   6.782  42.268  -4.328
   53   2HB   ALA   7          2HB       ALA   7   5.427  41.718  -5.314
   54   3HB   ALA   7          3HB       ALA   7   7.073  41.239  -5.731
   55    H    HIS   8           H        HIS   8   8.283  39.479  -5.306
   56    HA   HIS   8           HA       HIS   8  10.378  38.735  -4.862
   57   1HB   HIS   8          2HB       HIS   8  10.452  40.827  -3.457
   58   2HB   HIS   8          1HB       HIS   8   9.993  39.829  -2.085
   59    HD1  HIS   8           1HD      HIS   8  11.912  38.954  -0.750
   60    HD2  HIS   8           2HD      HIS   8  13.007  39.864  -4.656
   61    HE1  HIS   8           1HE      HIS   8  14.408  38.580  -0.894
   62    H    GLU   9           H        GLU   9   7.641  37.626  -3.682
   63    HA   GLU   9           HA       GLU   9   8.166  35.771  -1.705
   64   1HB   GLU   9          2HB       GLU   9   6.279  34.482  -2.548
   65   2HB   GLU   9          1HB       GLU   9   5.913  36.201  -2.594
   66   1HG   GLU   9          2HG       GLU   9   6.312  36.255  -4.979
   67   2HG   GLU   9          1HG       GLU   9   6.812  34.564  -4.955
   68    H    ALA  10           H        ALA  10   9.111  33.815  -1.575
   69    HA   ALA  10           HA       ALA  10  10.396  32.805  -4.021
   70   1HB   ALA  10          1HB       ALA  10  12.037  33.881  -2.547
   71   2HB   ALA  10          2HB       ALA  10  12.329  32.148  -2.686
   72   3HB   ALA  10          3HB       ALA  10  11.561  32.797  -1.237
   73    H    VAL  11           H        VAL  11   8.250  31.735  -3.914
   74    HA   VAL  11           HA       VAL  11   8.012  29.472  -2.183
   75    HB   VAL  11           HB       VAL  11   6.510  30.104  -4.697
   76   1HG1  VAL  11          1HG1      VAL  11   5.854  28.161  -2.494
   77   2HG1  VAL  11          2HG1      VAL  11   6.387  27.737  -4.122
   78   3HG1  VAL  11          3HG1      VAL  11   4.830  28.530  -3.879
   79   1HG2  VAL  11          1HG2      VAL  11   5.766  30.617  -1.827
   80   2HG2  VAL  11          2HG2      VAL  11   4.736  30.915  -3.229
   81   3HG2  VAL  11          3HG2      VAL  11   6.223  31.838  -3.012
   82    H    VAL  12           H        VAL  12   8.922  30.116  -5.491
   83    HA   VAL  12           HA       VAL  12   9.633  28.789  -7.170
   84    HB   VAL  12           HB       VAL  12  11.583  29.754  -6.311
   85   1HG1  VAL  12          1HG1      VAL  12  11.848  27.439  -4.405
   86   2HG1  VAL  12          2HG1      VAL  12  11.393  29.088  -3.975
   87   3HG1  VAL  12          3HG1      VAL  12  13.007  28.756  -4.608
   88   1HG2  VAL  12          1HG2      VAL  12  11.873  28.143  -8.097
   89   2HG2  VAL  12          2HG2      VAL  12  12.081  26.848  -6.917
   90   3HG2  VAL  12          3HG2      VAL  12  13.279  28.140  -7.033
   91    H    ARG  13           H        ARG  13   8.060  27.296  -7.289
   92    HA   ARG  13           HA       ARG  13   8.625  24.684  -6.140
   93   1HB   ARG  13          2HB       ARG  13   6.311  24.088  -6.650
   94   2HB   ARG  13          1HB       ARG  13   6.385  25.519  -5.636
   95   1HG   ARG  13          2HG       ARG  13   5.861  26.941  -7.466
   96   2HG   ARG  13          1HG       ARG  13   6.033  25.611  -8.611
   97   1HD   ARG  13          2HD       ARG  13   3.688  26.046  -8.228
   98   2HD   ARG  13          1HD       ARG  13   4.116  24.482  -7.538
   99    HE   ARG  13           HE       ARG  13   3.801  26.939  -5.922
  100   1HH1  ARG  13          1HH1      ARG  13   3.358  23.498  -6.424
  101   2HH1  ARG  13          2HH1      ARG  13   2.531  23.252  -4.916
  102   1HH2  ARG  13          1HH2      ARG  13   2.712  26.623  -3.914
  103   2HH2  ARG  13          2HH2      ARG  13   2.190  25.019  -3.475
  104    H    VAL  14           H        VAL  14   9.680  23.424  -7.388
  105    HA   VAL  14           HA       VAL  14   9.397  23.599 -10.286
  106    HB   VAL  14           HB       VAL  14  11.641  22.189  -8.903
  107   1HG1  VAL  14          1HG1      VAL  14  11.458  23.547 -11.588
  108   2HG1  VAL  14          2HG1      VAL  14  11.388  21.810 -11.291
  109   3HG1  VAL  14          3HG1      VAL  14  12.871  22.701 -10.954
  110   1HG2  VAL  14          1HG2      VAL  14  11.584  25.131  -9.552
  111   2HG2  VAL  14          2HG2      VAL  14  13.000  24.226  -9.015
  112   3HG2  VAL  14          3HG2      VAL  14  11.616  24.418  -7.939
  113    H    GLY  15           H        GLY  15   9.583  21.587 -11.406
  114   1HA   GLY  15          2HA       GLY  15   9.627  19.093 -10.947
  115   2HA   GLY  15          1HA       GLY  15   8.187  19.436  -9.996
  116    H    THR  16           H        THR  16   9.571  19.829 -13.208
  117    HA   THR  16           HA       THR  16   6.992  20.070 -14.448
  118    HB   THR  16           HB       THR  16   9.733  19.788 -15.680
  119    HG1  THR  16           1HG      THR  16   8.732  21.767 -14.243
  120   1HG2  THR  16          1HG2      THR  16   7.149  20.834 -16.822
  121   2HG2  THR  16          2HG2      THR  16   7.907  19.295 -17.221
  122   3HG2  THR  16          3HG2      THR  16   8.709  20.808 -17.646
  123    H    LYS  17           H        LYS  17   9.226  17.658 -13.689
  124    HA   LYS  17           HA       LYS  17   8.742  15.623 -15.488
  125   1HB   LYS  17          2HB       LYS  17   9.250  15.317 -12.525
  126   2HB   LYS  17          1HB       LYS  17   9.507  14.088 -13.752
  127   1HG   LYS  17          2HG       LYS  17  11.037  16.641 -13.353
  128   2HG   LYS  17          1HG       LYS  17  11.620  14.983 -13.192
  129   1HD   LYS  17          2HD       LYS  17  10.924  14.775 -15.685
  130   2HD   LYS  17          1HD       LYS  17  10.978  16.542 -15.660
  131   1HE   LYS  17          2HE       LYS  17  13.102  15.691 -16.411
  132   2HE   LYS  17          1HE       LYS  17  13.300  16.408 -14.812
  133   1HZ   LYS  17          1HZ       LYS  17  12.968  13.504 -15.345
  134   2HZ   LYS  17          2HZ       LYS  17  13.254  14.211 -13.834
  135   3HZ   LYS  17          3HZ       LYS  17  14.451  14.267 -15.037
  136    HA   PRO  18           HA       PRO  18   4.460  14.790 -14.324
  137   1HB   PRO  18          2HB       PRO  18   4.284  13.353 -16.814
  138   2HB   PRO  18          1HB       PRO  18   3.520  14.881 -16.367
  139   1HG   PRO  18          2HG       PRO  18   5.478  14.671 -18.246
  140   2HG   PRO  18          1HG       PRO  18   5.185  16.129 -17.283
  141   1HD   PRO  18          2HD       PRO  18   7.241  13.982 -16.885
  142   2HD   PRO  18          1HD       PRO  18   7.427  15.750 -16.756
  143    H    GLY  19           H        GLY  19   3.260  12.928 -14.068
  144   1HA   GLY  19          2HA       GLY  19   4.832  10.449 -13.889
  145   2HA   GLY  19          1HA       GLY  19   3.718  10.945 -12.622
  146    H    THR  20           H        THR  20   3.213  11.308 -16.013
  147    HA   THR  20           HA       THR  20   0.664  10.149 -16.098
  148    HB   THR  20           HB       THR  20   2.564  10.305 -18.442
  149    HG1  THR  20           1HG      THR  20   1.732  12.482 -18.668
  150   1HG2  THR  20          1HG2      THR  20   0.517  10.755 -19.698
  151   2HG2  THR  20          2HG2      THR  20  -0.425  10.629 -18.213
  152   3HG2  THR  20          3HG2      THR  20   0.416   9.214 -18.847
  153    H    GLU  21           H        GLU  21   3.857   8.837 -16.786
  154    HA   GLU  21           HA       GLU  21   2.781   6.147 -16.666
  155   1HB   GLU  21          2HB       GLU  21   4.698   7.165 -18.770
  156   2HB   GLU  21          1HB       GLU  21   4.275   5.474 -18.529
  157   1HG   GLU  21          2HG       GLU  21   2.018   5.865 -19.171
  158   2HG   GLU  21          1HG       GLU  21   2.261   7.610 -19.174
  159    H    VAL  22           H        VAL  22   3.662   5.433 -14.900
  160    HA   VAL  22           HA       VAL  22   5.913   6.712 -13.726
  161    HB   VAL  22           HB       VAL  22   4.114   5.988 -12.334
  162   1HG1  VAL  22          1HG1      VAL  22   3.543   3.639 -12.000
  163   2HG1  VAL  22          2HG1      VAL  22   4.706   3.186 -13.245
  164   3HG1  VAL  22          3HG1      VAL  22   3.293   4.152 -13.672
  165   1HG2  VAL  22          1HG2      VAL  22   6.315   5.973 -11.309
  166   2HG2  VAL  22          2HG2      VAL  22   6.554   4.299 -11.813
  167   3HG2  VAL  22          3HG2      VAL  22   5.307   4.693 -10.631
  168    HA   PRO  23           HA       PRO  23   9.044   3.992 -15.443
  169   1HB   PRO  23          2HB       PRO  23  10.793   5.740 -13.856
  170   2HB   PRO  23          1HB       PRO  23  10.829   5.388 -15.587
  171   1HG   PRO  23          2HG       PRO  23  10.022   7.763 -14.636
  172   2HG   PRO  23          1HG       PRO  23   9.305   7.038 -16.087
  173   1HD   PRO  23          2HD       PRO  23   8.252   7.142 -13.299
  174   2HD   PRO  23          1HD       PRO  23   7.399   7.348 -14.837
  175    HA   PRO  24           HA       PRO  24   9.774   1.333 -11.903
  176   1HB   PRO  24          2HB       PRO  24  12.377   0.590 -12.591
  177   2HB   PRO  24          1HB       PRO  24  10.899  -0.243 -13.088
  178   1HG   PRO  24          2HG       PRO  24  12.522   1.788 -14.563
  179   2HG   PRO  24          1HG       PRO  24  11.708   0.335 -15.179
  180   1HD   PRO  24          2HD       PRO  24  10.626   2.728 -15.566
  181   2HD   PRO  24          1HD       PRO  24   9.608   1.346 -15.114
  182    H    VAL  25           H        VAL  25  10.707   1.571  -9.962
  183    HA   VAL  25           HA       VAL  25  12.327   3.991  -9.618
  184    HB   VAL  25           HB       VAL  25  10.621   2.678  -7.505
  185   1HG1  VAL  25          1HG1      VAL  25  10.754   4.929  -6.468
  186   2HG1  VAL  25          2HG1      VAL  25  11.889   5.402  -7.734
  187   3HG1  VAL  25          3HG1      VAL  25  12.310   4.119  -6.605
  188   1HG2  VAL  25          1HG2      VAL  25   9.882   4.939  -9.363
  189   2HG2  VAL  25          2HG2      VAL  25   8.931   4.389  -7.984
  190   3HG2  VAL  25          3HG2      VAL  25   9.186   3.317  -9.359
  191    H    ILE  26           H        ILE  26  14.196   3.945  -8.575
  192    HA   ILE  26           HA       ILE  26  15.547   1.442  -8.407
  193    HB   ILE  26           HB       ILE  26  16.529   4.185  -7.612
  194   1HG1  ILE  26          2HG1      ILE  26  15.775   4.180  -9.931
  195   2HG1  ILE  26          1HG1      ILE  26  17.531   4.261  -9.867
  196   1HG2  ILE  26          1HG2      ILE  26  17.925   2.409  -6.715
  197   2HG2  ILE  26          2HG2      ILE  26  18.765   3.273  -8.001
  198   3HG2  ILE  26          3HG2      ILE  26  18.061   1.688  -8.319
  199   1HD1  ILE  26          1HD1      ILE  26  16.807   2.772 -11.627
  200   2HD1  ILE  26          2HD1      ILE  26  15.884   1.813 -10.470
  201   3HD1  ILE  26          3HD1      ILE  26  17.645   1.865 -10.372
  202    H    ASP  27           H        ASP  27  13.930   3.414  -6.121
  203    HA   ASP  27           HA       ASP  27  15.373   2.460  -3.838
  204   1HB   ASP  27          2HB       ASP  27  12.817   4.056  -3.996
  205   2HB   ASP  27          1HB       ASP  27  13.717   3.717  -2.525
  206    H    GLY  28           H        GLY  28  13.189   1.263  -5.848
  207   1HA   GLY  28          2HA       GLY  28  11.316  -0.009  -4.150
  208   2HA   GLY  28          1HA       GLY  28  11.665  -0.451  -5.820
  209    H    SER  29           H        SER  29  14.575  -0.424  -4.548
  210    HA   SER  29           HA       SER  29  14.692  -3.275  -4.151
  211   1HB   SER  29          2HB       SER  29  16.838  -1.248  -3.558
  212   2HB   SER  29          1HB       SER  29  17.049  -2.971  -3.869
  213    HG   SER  29           HG       SER  29  16.467  -2.646  -5.999
  214    H    ILE  30           H        ILE  30  15.018  -0.428  -2.168
  215    HA   ILE  30           HA       ILE  30  15.391  -1.798   0.315
  216    HB   ILE  30           HB       ILE  30  14.166   0.870   0.560
  217   1HG1  ILE  30          2HG1      ILE  30  16.674   0.514  -1.107
  218   2HG1  ILE  30          1HG1      ILE  30  15.210   1.400  -1.530
  219   1HG2  ILE  30          1HG2      ILE  30  16.800  -0.275   1.460
  220   2HG2  ILE  30          2HG2      ILE  30  15.297  -0.228   2.384
  221   3HG2  ILE  30          3HG2      ILE  30  16.122   1.273   1.963
  222   1HD1  ILE  30          1HD1      ILE  30  15.712   3.078   0.124
  223   2HD1  ILE  30          2HD1      ILE  30  17.072   2.875  -0.977
  224   3HD1  ILE  30          3HD1      ILE  30  17.136   2.177   0.644
  225    H    TRP  31           H        TRP  31  12.752  -0.557  -1.547
  226    HA   TRP  31           HA       TRP  31  10.770  -0.870   0.464
  227   1HB   TRP  31          2HB       TRP  31  10.654  -0.397  -2.512
  228   2HB   TRP  31          1HB       TRP  31   9.205  -0.566  -1.529
  229    HD1  TRP  31           HD       TRP  31  11.173   2.091  -2.915
  230    HE1  TRP  31           1HE      TRP  31  10.950   4.274  -1.551
  231    HE3  TRP  31           3HE      TRP  31   9.199   0.172   1.334
  232    HZ2  TRP  31           2HZ      TRP  31  10.068   5.053   0.996
  233    HZ3  TRP  31           3HZ      TRP  31   8.701   1.678   3.209
  234    HH2  TRP  31           HH       TRP  31   9.131   4.072   3.041
  235    H    ASP  32           H        ASP  32  12.045  -2.851  -2.136
  236    HA   ASP  32           HA       ASP  32  10.041  -4.884  -1.829
  237   1HB   ASP  32          2HB       ASP  32  11.124  -4.572  -3.982
  238   2HB   ASP  32          1HB       ASP  32  12.699  -4.928  -3.264
  239    H    ALA  33           H        ALA  33  13.239  -4.223  -0.503
  240    HA   ALA  33           HA       ALA  33  13.579  -6.760   0.685
  241   1HB   ALA  33          1HB       ALA  33  14.695  -4.088   1.528
  242   2HB   ALA  33          2HB       ALA  33  15.446  -5.221   0.404
  243   3HB   ALA  33          3HB       ALA  33  15.248  -5.661   2.099
  244    H    ILE  34           H        ILE  34  11.997  -3.768   1.667
  245    HA   ILE  34           HA       ILE  34  11.248  -4.613   4.278
  246    HB   ILE  34           HB       ILE  34   9.963  -2.641   2.400
  247   1HG1  ILE  34          2HG1      ILE  34  11.778  -2.280   4.799
  248   2HG1  ILE  34          1HG1      ILE  34  12.216  -2.020   3.114
  249   1HG2  ILE  34          1HG2      ILE  34   8.741  -1.783   4.357
  250   2HG2  ILE  34          2HG2      ILE  34   9.387  -3.107   5.327
  251   3HG2  ILE  34          3HG2      ILE  34   8.299  -3.448   3.982
  252   1HD1  ILE  34          1HD1      ILE  34  11.831   0.079   4.266
  253   2HD1  ILE  34          2HD1      ILE  34  10.195  -0.435   4.682
  254   3HD1  ILE  34          3HD1      ILE  34  10.635  -0.169   2.995
  255    H    ALA  35           H        ALA  35   9.524  -4.637   1.173
  256    HA   ALA  35           HA       ALA  35   7.167  -5.865   2.040
  257   1HB   ALA  35          1HB       ALA  35   8.511  -6.056  -0.651
  258   2HB   ALA  35          2HB       ALA  35   7.397  -4.789  -0.137
  259   3HB   ALA  35          3HB       ALA  35   6.826  -6.450  -0.308
  260    H    GLY  36           H        GLY  36  10.204  -7.211   0.891
  261   1HA   GLY  36          2HA       GLY  36   9.340  -9.943   0.983
  262   2HA   GLY  36          1HA       GLY  36  11.002  -9.381   0.859
  263    H    CYS  37           H        CYS  37  10.339  -7.693   3.321
  264    HA   CYS  37           HA       CYS  37  11.332  -9.631   5.206
  265   1HB   CYS  37          2HB       CYS  37  12.469  -7.583   5.319
  266   2HB   CYS  37          1HB       CYS  37  10.981  -6.652   5.218
  267    H    GLU  38           H        GLU  38   8.609  -7.295   5.246
  268    HA   GLU  38           HA       GLU  38   7.642  -8.675   7.623
  269   1HB   GLU  38          2HB       GLU  38   7.801  -6.079   7.287
  270   2HB   GLU  38          1HB       GLU  38   6.263  -6.288   6.458
  271   1HG   GLU  38          2HG       GLU  38   5.308  -7.318   8.436
  272   2HG   GLU  38          1HG       GLU  38   6.848  -7.174   9.273
  273    H    ALA  39           H        ALA  39   6.789  -8.110   4.283
  274    HA   ALA  39           HA       ALA  39   4.217  -9.386   4.640
  275   1HB   ALA  39          1HB       ALA  39   3.795  -8.838   2.308
  276   2HB   ALA  39          2HB       ALA  39   5.449  -8.245   2.152
  277   3HB   ALA  39          3HB       ALA  39   4.313  -7.421   3.219
  278    H    GLY  40           H        GLY  40   7.353 -10.281   3.940
  279   1HA   GLY  40          2HA       GLY  40   8.192 -12.426   3.593
  280   2HA   GLY  40          1HA       GLY  40   6.546 -12.995   3.315
  281    H    GLY  41           H        GLY  41   7.067 -10.214   1.684
  282   1HA   GLY  41          2HA       GLY  41   7.601  -9.693  -0.482
  283   2HA   GLY  41          1HA       GLY  41   8.090 -11.365  -0.767
  284    H    ASN  42           H        ASN  42   5.160  -9.509   0.050
  285    HA   ASN  42           HA       ASN  42   3.734 -10.878  -2.090
  286   1HB   ASN  42          2HB       ASN  42   3.518 -12.074   0.261
  287   2HB   ASN  42          1HB       ASN  42   2.403 -10.754   0.595
  288   1HD2  ASN  42          1HD2      ASN  42   1.850 -10.902  -2.486
  289   2HD2  ASN  42          2HD2      ASN  42   0.659 -12.157  -2.579
  290    H    TRP  43           H        TRP  43   3.404  -9.010  -3.165
  291    HA   TRP  43           HA       TRP  43   2.771  -6.557  -1.794
  292   1HB   TRP  43          2HB       TRP  43   2.921  -7.231  -4.731
  293   2HB   TRP  43          1HB       TRP  43   2.694  -5.608  -4.084
  294    HD1  TRP  43           HD       TRP  43   5.282  -8.479  -3.804
  295    HE1  TRP  43           1HE      TRP  43   7.634  -7.416  -3.584
  296    HE3  TRP  43           3HE      TRP  43   3.934  -3.567  -3.711
  297    HZ2  TRP  43           2HZ      TRP  43   8.748  -4.805  -3.394
  298    HZ3  TRP  43           3HZ      TRP  43   5.661  -1.843  -3.506
  299    HH2  TRP  43           HH       TRP  43   8.031  -2.451  -3.357
  300    H    ALA  44           H        ALA  44   1.030  -9.153  -2.977
  301    HA   ALA  44           HA       ALA  44  -1.436  -7.562  -3.202
  302   1HB   ALA  44          1HB       ALA  44  -0.894 -10.366  -4.160
  303   2HB   ALA  44          2HB       ALA  44  -0.898  -8.914  -5.160
  304   3HB   ALA  44          3HB       ALA  44  -2.390  -9.461  -4.395
  305    H    ILE  45           H        ILE  45   0.048  -8.787  -0.762
  306    HA   ILE  45           HA       ILE  45  -1.789 -10.690   0.288
  307    HB   ILE  45           HB       ILE  45   0.749 -10.492   0.767
  308   1HG1  ILE  45          2HG1      ILE  45  -1.198 -10.898   3.033
  309   2HG1  ILE  45          1HG1      ILE  45  -0.785 -12.093   1.812
  310   1HG2  ILE  45          1HG2      ILE  45  -0.303  -8.551   2.823
  311   2HG2  ILE  45          2HG2      ILE  45   0.765  -8.156   1.476
  312   3HG2  ILE  45          3HG2      ILE  45   1.331  -9.214   2.769
  313   1HD1  ILE  45          1HD1      ILE  45   1.528 -12.098   2.602
  314   2HD1  ILE  45          2HD1      ILE  45   0.394 -12.528   3.883
  315   3HD1  ILE  45          3HD1      ILE  45   1.104 -10.914   3.834
  316    H    ASN  46           H        ASN  46  -3.272 -10.365   1.925
  317    HA   ASN  46           HA       ASN  46  -3.602  -7.701   3.044
  318   1HB   ASN  46          2HB       ASN  46  -4.890  -7.854   0.817
  319   2HB   ASN  46          1HB       ASN  46  -5.972  -8.956   1.663
  320   1HD2  ASN  46          1HD2      ASN  46  -6.387  -6.294   0.506
  321   2HD2  ASN  46          2HD2      ASN  46  -7.039  -5.330   1.784
  322    H    THR  47           H        THR  47  -3.082  -8.718   4.952
  323    HA   THR  47           HA       THR  47  -4.374 -11.033   5.924
  324    HB   THR  47           HB       THR  47  -3.402 -10.170   8.166
  325    HG1  THR  47           1HG      THR  47  -1.816  -8.537   7.863
  326   1HG2  THR  47          1HG2      THR  47  -1.145 -10.869   7.511
  327   2HG2  THR  47          2HG2      THR  47  -1.578 -10.699   5.811
  328   3HG2  THR  47          3HG2      THR  47  -2.362 -11.929   6.802
  329    H    GLY  48           H        GLY  48  -5.160  -7.670   5.986
  330   1HA   GLY  48          2HA       GLY  48  -7.388  -6.930   6.390
  331   2HA   GLY  48          1HA       GLY  48  -7.614  -8.306   7.464
  332    H    ASN  49           H        ASN  49  -4.664  -6.582   7.694
  333    HA   ASN  49           HA       ASN  49  -5.304  -5.798  10.396
  334   1HB   ASN  49          2HB       ASN  49  -2.811  -5.447   8.723
  335   2HB   ASN  49          1HB       ASN  49  -2.944  -4.899  10.390
  336   1HD2  ASN  49          1HD2      ASN  49  -1.262  -6.238  11.010
  337   2HD2  ASN  49          2HD2      ASN  49  -1.451  -7.951  11.161
  338    H    GLY  50           H        GLY  50  -5.918  -4.437   7.495
  339   1HA   GLY  50          2HA       GLY  50  -6.958  -2.337   7.173
  340   2HA   GLY  50          1HA       GLY  50  -6.124  -1.739   8.608
  341    H    TYR  51           H        TYR  51  -3.732  -3.249   7.486
  342    HA   TYR  51           HA       TYR  51  -2.818  -1.217   5.604
  343   1HB   TYR  51          2HB       TYR  51  -0.967  -3.307   6.682
  344   2HB   TYR  51          1HB       TYR  51  -0.640  -1.639   6.267
  345    HD1  TYR  51           1HD      TYR  51  -3.192  -0.789   8.049
  346    HD2  TYR  51           2HD      TYR  51   0.391  -2.985   8.707
  347    HE1  TYR  51           1HE      TYR  51  -3.254  -0.180  10.441
  348    HE2  TYR  51           2HE      TYR  51   0.333  -2.392  11.094
  349    HH   TYR  51           HH       TYR  51  -2.362  -1.214  12.611
  350    H    TYR  52           H        TYR  52  -1.907  -1.866   3.634
  351    HA   TYR  52           HA       TYR  52  -3.042  -4.434   2.776
  352   1HB   TYR  52          2HB       TYR  52  -2.715  -1.851   1.251
  353   2HB   TYR  52          1HB       TYR  52  -3.229  -3.366   0.511
  354    HD1  TYR  52           1HD      TYR  52  -5.515  -3.743   0.323
  355    HD2  TYR  52           2HD      TYR  52  -4.118  -1.180   3.412
  356    HE1  TYR  52           1HE      TYR  52  -7.841  -3.292   1.000
  357    HE2  TYR  52           2HE      TYR  52  -6.430  -0.714   4.095
  358    HH   TYR  52           HH       TYR  52  -8.638  -0.833   3.348
  359    H    GLY  53           H        GLY  53  -1.956  -5.281   0.709
  360   1HA   GLY  53          2HA       GLY  53   0.404  -6.331   1.718
  361   2HA   GLY  53          1HA       GLY  53  -0.188  -6.570   0.088
  362    H    GLY  54           H        GLY  54   2.378  -6.666   0.362
  363   1HA   GLY  54          2HA       GLY  54   4.158  -5.807  -0.891
  364   2HA   GLY  54          1HA       GLY  54   3.324  -4.258  -0.971
  365    H    VAL  55           H        VAL  55   4.103  -2.679   0.254
  366    HA   VAL  55           HA       VAL  55   6.082  -3.263   2.284
  367    HB   VAL  55           HB       VAL  55   5.969  -0.698   2.610
  368   1HG1  VAL  55          1HG1      VAL  55   6.891  -1.876  -0.016
  369   2HG1  VAL  55          2HG1      VAL  55   7.798  -1.900   1.496
  370   3HG1  VAL  55          3HG1      VAL  55   7.462  -0.363   0.694
  371   1HG2  VAL  55          1HG2      VAL  55   5.071   0.576   0.788
  372   2HG2  VAL  55          2HG2      VAL  55   3.797  -0.473   1.413
  373   3HG2  VAL  55          3HG2      VAL  55   4.633  -0.892  -0.083
  374    H    GLN  56           H        GLN  56   2.861  -3.195   2.140
  375    HA   GLN  56           HA       GLN  56   1.182  -3.386   3.614
  376   1HB   GLN  56          2HB       GLN  56   2.866  -5.231   4.152
  377   2HB   GLN  56          1HB       GLN  56   3.227  -4.289   5.594
  378   1HG   GLN  56          2HG       GLN  56   0.986  -4.497   6.386
  379   2HG   GLN  56          1HG       GLN  56   0.462  -5.222   4.866
  380   1HE2  GLN  56          1HE2      GLN  56   2.944  -6.820   4.705
  381   2HE2  GLN  56          2HE2      GLN  56   2.721  -8.119   5.830
  382    H    PHE  57           H        PHE  57   1.780  -0.726   3.606
  383    HA   PHE  57           HA       PHE  57   1.480  -0.155   6.465
  384   1HB   PHE  57          2HB       PHE  57   1.857   2.204   5.993
  385   2HB   PHE  57          1HB       PHE  57   3.220   1.205   5.540
  386    HD1  PHE  57           1HD      PHE  57   1.241   3.900   4.608
  387    HD2  PHE  57           2HD      PHE  57   3.209   0.506   2.954
  388    HE1  PHE  57           1HE      PHE  57   1.393   5.050   2.427
  389    HE2  PHE  57           2HE      PHE  57   3.353   1.654   0.781
  390    HZ   PHE  57           HZ       PHE  57   2.469   3.927   0.525
  391    H    ASP  58           H        ASP  58  -0.093   1.538   7.030
  392    HA   ASP  58           HA       ASP  58  -2.578   0.331   6.468
  393   1HB   ASP  58          2HB       ASP  58  -2.471   1.101   8.613
  394   2HB   ASP  58          1HB       ASP  58  -1.599   2.548   8.163
  395    H    GLN  59           H        GLN  59  -4.382   1.051   5.477
  396    HA   GLN  59           HA       GLN  59  -4.085   2.460   3.076
  397   1HB   GLN  59          2HB       GLN  59  -5.708   0.773   3.246
  398   2HB   GLN  59          1HB       GLN  59  -6.416   1.479   4.688
  399   1HG   GLN  59          2HG       GLN  59  -7.828   1.742   2.713
  400   2HG   GLN  59          1HG       GLN  59  -7.336   3.285   3.396
  401   1HE2  GLN  59          1HE2      GLN  59  -5.052   1.459   1.563
  402   2HE2  GLN  59          2HE2      GLN  59  -5.070   2.451   0.148
  403    H    GLY  60           H        GLY  60  -5.117   3.442   6.261
  404   1HA   GLY  60          2HA       GLY  60  -6.170   5.988   5.562
  405   2HA   GLY  60          1HA       GLY  60  -5.519   5.543   7.138
  406    H    THR  61           H        THR  61  -2.954   4.922   6.548
  407    HA   THR  61           HA       THR  61  -1.683   7.429   6.158
  408    HB   THR  61           HB       THR  61  -0.551   4.666   6.225
  409    HG1  THR  61           1HG      THR  61  -1.610   5.175   8.146
  410   1HG2  THR  61          1HG2      THR  61   0.824   7.330   6.589
  411   2HG2  THR  61          2HG2      THR  61   1.036   6.232   5.225
  412   3HG2  THR  61          3HG2      THR  61   1.574   5.753   6.834
  413    H    TRP  62           H        TRP  62  -2.003   4.535   4.169
  414    HA   TRP  62           HA       TRP  62  -0.608   5.265   1.895
  415   1HB   TRP  62          2HB       TRP  62  -1.617   3.079   2.209
  416   2HB   TRP  62          1HB       TRP  62  -3.219   3.801   2.250
  417    HD1  TRP  62           HD       TRP  62  -4.264   4.604  -0.085
  418    HE1  TRP  62           1HE      TRP  62  -3.834   3.808  -2.491
  419    HE3  TRP  62           3HE      TRP  62   0.206   2.241   0.641
  420    HZ2  TRP  62           2HZ      TRP  62  -1.832   2.393  -3.934
  421    HZ3  TRP  62           3HZ      TRP  62   1.313   1.196  -1.289
  422    HH2  TRP  62           HH       TRP  62   0.334   1.265  -3.514
  423    H    GLU  63           H        GLU  63  -3.938   5.938   2.805
  424    HA   GLU  63           HA       GLU  63  -4.613   7.448   0.536
  425   1HB   GLU  63          2HB       GLU  63  -6.357   6.486   1.798
  426   2HB   GLU  63          1HB       GLU  63  -5.776   7.186   3.299
  427   1HG   GLU  63          2HG       GLU  63  -6.387   9.423   2.468
  428   2HG   GLU  63          1HG       GLU  63  -7.031   8.674   1.006
  429    H    ALA  64           H        ALA  64  -3.204   8.254   3.638
  430    HA   ALA  64           HA       ALA  64  -3.569  11.057   3.540
  431   1HB   ALA  64          1HB       ALA  64  -1.856  11.157   5.276
  432   2HB   ALA  64          2HB       ALA  64  -1.434   9.474   4.965
  433   3HB   ALA  64          3HB       ALA  64  -3.025   9.878   5.608
  434    H    ASN  65           H        ASN  65  -0.910   8.967   2.488
  435    HA   ASN  65           HA       ASN  65   0.607  11.169   1.449
  436   1HB   ASN  65          2HB       ASN  65   0.937   8.175   1.194
  437   2HB   ASN  65          1HB       ASN  65   2.072   9.352   0.546
  438   1HD2  ASN  65          1HD2      ASN  65   0.732   7.960   3.451
  439   2HD2  ASN  65          2HD2      ASN  65   1.963   8.536   4.519
  440    H    GLY  66           H        GLY  66  -2.066   9.451   0.368
  441   1HA   GLY  66          2HA       GLY  66  -3.307  10.068  -1.516
  442   2HA   GLY  66          1HA       GLY  66  -1.876  10.843  -2.180
  443    H    GLY  67           H        GLY  67  -2.455   7.506  -1.082
  444   1HA   GLY  67          2HA       GLY  67  -0.965   6.506  -3.331
  445   2HA   GLY  67          1HA       GLY  67  -1.672   5.561  -2.030
  446    H    LEU  68           H        LEU  68  -4.287   7.074  -2.636
  447    HA   LEU  68           HA       LEU  68  -5.433   4.895  -3.903
  448   1HB   LEU  68          2HB       LEU  68  -6.495   7.649  -3.393
  449   2HB   LEU  68          1HB       LEU  68  -7.469   6.385  -4.115
  450    HG   LEU  68           HG       LEU  68  -6.857   5.022  -2.013
  451   1HD1  LEU  68          1HD1      LEU  68  -6.234   7.804  -1.087
  452   2HD1  LEU  68          2HD1      LEU  68  -5.130   6.428  -1.150
  453   3HD1  LEU  68          3HD1      LEU  68  -6.490   6.422  -0.027
  454   1HD2  LEU  68          1HD2      LEU  68  -8.750   5.955  -0.806
  455   2HD2  LEU  68          2HD2      LEU  68  -9.101   5.861  -2.531
  456   3HD2  LEU  68          3HD2      LEU  68  -8.682   7.410  -1.799
  457    H    ARG  69           H        ARG  69  -4.035   7.735  -5.232
  458    HA   ARG  69           HA       ARG  69  -5.390   7.649  -7.729
  459   1HB   ARG  69          2HB       ARG  69  -3.698   9.207  -8.503
  460   2HB   ARG  69          1HB       ARG  69  -4.320   9.687  -6.934
  461   1HG   ARG  69          2HG       ARG  69  -2.330   8.720  -5.873
  462   2HG   ARG  69          1HG       ARG  69  -1.704   8.317  -7.474
  463   1HD   ARG  69          2HD       ARG  69  -1.850  10.715  -8.080
  464   2HD   ARG  69          1HD       ARG  69  -2.347  11.077  -6.432
  465    HE   ARG  69           HE       ARG  69   0.164   9.687  -6.621
  466   1HH1  ARG  69          1HH1      ARG  69  -1.419  12.813  -6.626
  467   2HH1  ARG  69          2HH1      ARG  69   0.019  13.681  -6.164
  468   1HH2  ARG  69          1HH2      ARG  69   2.063  10.836  -6.064
  469   2HH2  ARG  69          2HH2      ARG  69   2.002  12.570  -5.889
  470    H    TYR  70           H        TYR  70  -2.623   6.060  -6.351
  471    HA   TYR  70           HA       TYR  70  -1.751   4.913  -8.872
  472   1HB   TYR  70          2HB       TYR  70  -1.108   4.098  -6.031
  473   2HB   TYR  70          1HB       TYR  70  -0.178   3.702  -7.473
  474    HD1  TYR  70           1HD      TYR  70  -0.753   6.064  -4.836
  475    HD2  TYR  70           2HD      TYR  70   1.076   5.578  -8.645
  476    HE1  TYR  70           1HE      TYR  70   0.604   8.057  -4.430
  477    HE2  TYR  70           2HE      TYR  70   2.452   7.579  -8.243
  478    HH   TYR  70           HH       TYR  70   2.853   8.953  -5.243
  479    H    ALA  71           H        ALA  71  -3.639   4.329  -6.096
  480    HA   ALA  71           HA       ALA  71  -5.529   2.576  -7.030
  481   1HB   ALA  71          1HB       ALA  71  -3.709   0.959  -7.473
  482   2HB   ALA  71          2HB       ALA  71  -4.838   0.369  -6.253
  483   3HB   ALA  71          3HB       ALA  71  -3.270   1.010  -5.764
  484    HA   PRO  72           HA       PRO  72  -6.666   3.819  -2.876
  485   1HB   PRO  72          2HB       PRO  72  -9.051   2.529  -2.767
  486   2HB   PRO  72          1HB       PRO  72  -8.794   4.066  -3.592
  487   1HG   PRO  72          2HG       PRO  72  -8.918   1.303  -4.731
  488   2HG   PRO  72          1HG       PRO  72  -9.619   2.805  -5.364
  489   1HD   PRO  72          2HD       PRO  72  -7.332   1.758  -6.345
  490   2HD   PRO  72          1HD       PRO  72  -7.612   3.510  -6.265
  491    H    ARG  73           H        ARG  73  -5.069   1.343  -3.360
  492    HA   ARG  73           HA       ARG  73  -5.082   0.316  -0.757
  493   1HB   ARG  73          2HB       ARG  73  -5.891  -1.943  -1.096
  494   2HB   ARG  73          1HB       ARG  73  -7.164  -0.824  -1.575
  495   1HG   ARG  73          2HG       ARG  73  -6.300  -1.099  -3.942
  496   2HG   ARG  73          1HG       ARG  73  -5.348  -2.453  -3.325
  497   1HD   ARG  73          2HD       ARG  73  -8.330  -2.257  -2.963
  498   2HD   ARG  73          1HD       ARG  73  -7.586  -3.012  -4.369
  499    HE   ARG  73           HE       ARG  73  -6.424  -4.211  -2.177
  500   1HH1  ARG  73          1HH1      ARG  73  -9.676  -3.795  -3.424
  501   2HH1  ARG  73          2HH1      ARG  73 -10.223  -5.358  -2.886
  502   1HH2  ARG  73          1HH2      ARG  73  -7.110  -6.282  -1.514
  503   2HH2  ARG  73          2HH2      ARG  73  -8.758  -6.772  -1.784
  504    H    ALA  74           H        ALA  74  -3.222  -0.833  -0.407
  505    HA   ALA  74           HA       ALA  74  -1.158  -0.392  -2.275
  506   1HB   ALA  74          1HB       ALA  74  -1.023  -2.148   0.168
  507   2HB   ALA  74          2HB       ALA  74  -0.867  -0.391   0.197
  508   3HB   ALA  74          3HB       ALA  74   0.321  -1.366  -0.667
  509    H    ASP  75           H        ASP  75  -3.244  -3.112  -1.712
  510    HA   ASP  75           HA       ASP  75  -1.383  -4.937  -2.960
  511   1HB   ASP  75          2HB       ASP  75  -3.089  -6.673  -2.542
  512   2HB   ASP  75          1HB       ASP  75  -2.589  -5.833  -1.081
  513    H    LEU  76           H        LEU  76  -3.650  -2.786  -4.033
  514    HA   LEU  76           HA       LEU  76  -4.095  -4.284  -6.514
  515   1HB   LEU  76          2HB       LEU  76  -6.016  -3.085  -5.591
  516   2HB   LEU  76          1HB       LEU  76  -5.112  -1.585  -5.618
  517    HG   LEU  76           HG       LEU  76  -5.018  -1.724  -8.094
  518   1HD1  LEU  76          1HD1      LEU  76  -6.877  -4.062  -7.692
  519   2HD1  LEU  76          2HD1      LEU  76  -5.238  -4.132  -8.338
  520   3HD1  LEU  76          3HD1      LEU  76  -6.506  -3.298  -9.238
  521   1HD2  LEU  76          1HD2      LEU  76  -6.722  -0.389  -6.976
  522   2HD2  LEU  76          2HD2      LEU  76  -7.778  -1.799  -6.881
  523   3HD2  LEU  76          3HD2      LEU  76  -7.361  -1.115  -8.452
  524    H    ALA  77           H        ALA  77  -2.353  -1.637  -5.124
  525    HA   ALA  77           HA       ALA  77  -1.228  -0.679  -7.561
  526   1HB   ALA  77          1HB       ALA  77  -0.400  -0.265  -4.687
  527   2HB   ALA  77          2HB       ALA  77  -1.488   0.771  -5.613
  528   3HB   ALA  77          3HB       ALA  77   0.210   0.640  -6.072
  529    H    THR  78           H        THR  78   0.877  -0.979  -8.260
  530    HA   THR  78           HA       THR  78   1.980  -3.586  -7.581
  531    HB   THR  78           HB       THR  78   3.366  -3.196  -9.620
  532    HG1  THR  78           1HG      THR  78   1.744  -0.848  -9.891
  533   1HG2  THR  78          1HG2      THR  78   1.287  -4.374  -9.855
  534   2HG2  THR  78          2HG2      THR  78   1.408  -3.234 -11.199
  535   3HG2  THR  78          3HG2      THR  78   0.373  -2.865  -9.814
  536    H    ARG  79           H        ARG  79   4.616  -3.382  -8.028
  537    HA   ARG  79           HA       ARG  79   5.652  -2.425  -5.631
  538   1HB   ARG  79          2HB       ARG  79   7.062  -2.864  -8.267
  539   2HB   ARG  79          1HB       ARG  79   7.884  -2.580  -6.739
  540   1HG   ARG  79          2HG       ARG  79   6.835  -4.623  -5.838
  541   2HG   ARG  79          1HG       ARG  79   6.114  -4.915  -7.422
  542   1HD   ARG  79          2HD       ARG  79   8.145  -6.225  -7.128
  543   2HD   ARG  79          1HD       ARG  79   8.332  -5.041  -8.423
  544    HE   ARG  79           HE       ARG  79   9.485  -4.768  -5.714
  545   1HH1  ARG  79          1HH1      ARG  79   9.505  -4.089  -9.141
  546   2HH1  ARG  79          2HH1      ARG  79  11.097  -3.386  -9.137
  547   1HH2  ARG  79          1HH2      ARG  79  11.571  -3.804  -5.677
  548   2HH2  ARG  79          2HH2      ARG  79  12.276  -3.223  -7.157
  549    H    GLU  80           H        GLU  80   5.881  -1.002  -8.858
  550    HA   GLU  80           HA       GLU  80   7.330   1.269  -8.157
  551   1HB   GLU  80          2HB       GLU  80   6.224   2.228 -10.295
  552   2HB   GLU  80          1HB       GLU  80   7.267   0.823 -10.426
  553   1HG   GLU  80          2HG       GLU  80   4.370   0.335 -10.074
  554   2HG   GLU  80          1HG       GLU  80   4.916   0.965 -11.628
  555    H    GLU  81           H        GLU  81   3.837   0.779  -8.241
  556    HA   GLU  81           HA       GLU  81   3.094   3.389  -7.517
  557   1HB   GLU  81          2HB       GLU  81   1.822   0.712  -7.517
  558   2HB   GLU  81          1HB       GLU  81   1.072   1.966  -6.540
  559   1HG   GLU  81          2HG       GLU  81   0.080   2.702  -8.313
  560   2HG   GLU  81          1HG       GLU  81   1.624   3.148  -8.990
  561    H    GLN  82           H        GLN  82   3.511   0.456  -5.523
  562    HA   GLN  82           HA       GLN  82   2.823   1.693  -3.096
  563   1HB   GLN  82          2HB       GLN  82   4.630  -0.676  -3.562
  564   2HB   GLN  82          1HB       GLN  82   4.008  -0.180  -1.994
  565   1HG   GLN  82          2HG       GLN  82   1.694  -0.445  -3.040
  566   2HG   GLN  82          1HG       GLN  82   2.525  -1.331  -4.323
  567   1HE2  GLN  82          1HE2      GLN  82   1.672  -3.322  -3.855
  568   2HE2  GLN  82          2HE2      GLN  82   2.014  -4.182  -2.386
  569    H    ILE  83           H        ILE  83   5.896   1.371  -4.777
  570    HA   ILE  83           HA       ILE  83   7.530   2.531  -2.862
  571    HB   ILE  83           HB       ILE  83   7.668   2.238  -5.819
  572   1HG1  ILE  83          2HG1      ILE  83   9.978   1.376  -5.066
  573   2HG1  ILE  83          1HG1      ILE  83   9.335   1.514  -3.439
  574   1HG2  ILE  83          1HG2      ILE  83   9.501   4.052  -4.258
  575   2HG2  ILE  83          2HG2      ILE  83   8.370   4.546  -5.519
  576   3HG2  ILE  83          3HG2      ILE  83   9.750   3.525  -5.923
  577   1HD1  ILE  83          1HD1      ILE  83   9.202  -0.748  -4.242
  578   2HD1  ILE  83          2HD1      ILE  83   8.228  -0.218  -5.612
  579   3HD1  ILE  83          3HD1      ILE  83   7.595  -0.075  -3.972
  580    H    ALA  84           H        ALA  84   5.465   4.093  -5.360
  581    HA   ALA  84           HA       ALA  84   6.601   6.660  -5.048
  582   1HB   ALA  84          1HB       ALA  84   5.302   5.956  -7.005
  583   2HB   ALA  84          2HB       ALA  84   4.673   7.448  -6.300
  584   3HB   ALA  84          3HB       ALA  84   3.844   5.915  -6.017
  585    H    VAL  85           H        VAL  85   3.760   5.163  -3.574
  586    HA   VAL  85           HA       VAL  85   2.984   7.492  -2.123
  587    HB   VAL  85           HB       VAL  85   1.313   5.907  -2.627
  588   1HG1  VAL  85          1HG1      VAL  85   2.596   3.933  -2.892
  589   2HG1  VAL  85          2HG1      VAL  85   1.279   3.629  -1.759
  590   3HG1  VAL  85          3HG1      VAL  85   2.918   3.867  -1.164
  591   1HG2  VAL  85          1HG2      VAL  85   1.907   5.924   0.311
  592   2HG2  VAL  85          2HG2      VAL  85   0.390   5.347  -0.378
  593   3HG2  VAL  85          3HG2      VAL  85   0.867   7.032  -0.586
  594    H    ALA  86           H        ALA  86   4.721   4.530  -1.267
  595    HA   ALA  86           HA       ALA  86   5.275   5.145   1.405
  596   1HB   ALA  86          1HB       ALA  86   6.933   3.541  -0.538
  597   2HB   ALA  86          2HB       ALA  86   5.613   2.917   0.452
  598   3HB   ALA  86          3HB       ALA  86   7.085   3.516   1.220
  599    H    GLU  87           H        GLU  87   6.586   6.228  -1.591
  600    HA   GLU  87           HA       GLU  87   9.059   7.262  -0.696
  601   1HB   GLU  87          2HB       GLU  87   7.286   7.940  -3.026
  602   2HB   GLU  87          1HB       GLU  87   8.684   8.942  -2.662
  603   1HG   GLU  87          2HG       GLU  87  10.080   6.860  -2.813
  604   2HG   GLU  87          1HG       GLU  87   8.635   6.037  -3.410
  605    H    VAL  88           H        VAL  88   5.833   8.742  -0.937
  606    HA   VAL  88           HA       VAL  88   6.574  11.256   0.092
  607    HB   VAL  88           HB       VAL  88   3.898   9.899   0.551
  608   1HG1  VAL  88          1HG1      VAL  88   4.696  12.811   0.508
  609   2HG1  VAL  88          2HG1      VAL  88   4.312  11.860   1.946
  610   3HG1  VAL  88          3HG1      VAL  88   3.060  12.185   0.740
  611   1HG2  VAL  88          1HG2      VAL  88   3.162  11.056  -1.491
  612   2HG2  VAL  88          2HG2      VAL  88   4.442   9.890  -1.829
  613   3HG2  VAL  88          3HG2      VAL  88   4.811  11.615  -1.767
  614    H    THR  89           H        THR  89   5.495   8.291   1.681
  615    HA   THR  89           HA       THR  89   5.339   9.416   4.275
  616    HB   THR  89           HB       THR  89   5.905   6.519   4.026
  617    HG1  THR  89           1HG      THR  89   3.842   7.857   2.647
  618   1HG2  THR  89          1HG2      THR  89   5.150   7.684   6.092
  619   2HG2  THR  89          2HG2      THR  89   4.099   6.358   5.592
  620   3HG2  THR  89          3HG2      THR  89   3.625   8.027   5.284
  621    H    ARG  90           H        ARG  90   7.838   7.511   2.635
  622    HA   ARG  90           HA       ARG  90   9.537   7.234   4.859
  623   1HB   ARG  90          2HB       ARG  90  11.176   6.413   3.383
  624   2HB   ARG  90          1HB       ARG  90   9.648   5.945   2.656
  625   1HG   ARG  90          2HG       ARG  90   9.820   7.552   0.971
  626   2HG   ARG  90          1HG       ARG  90  11.062   8.454   1.836
  627   1HD   ARG  90          2HD       ARG  90  12.582   6.506   1.544
  628   2HD   ARG  90          1HD       ARG  90  11.347   5.759   0.530
  629    HE   ARG  90           HE       ARG  90  11.794   8.286  -0.514
  630   1HH1  ARG  90          1HH1      ARG  90  13.673   5.372   0.010
  631   2HH1  ARG  90          2HH1      ARG  90  14.707   5.642  -1.363
  632   1HH2  ARG  90          1HH2      ARG  90  13.161   8.652  -2.292
  633   2HH2  ARG  90          2HH2      ARG  90  14.421   7.510  -2.657
  634    H    LEU  91           H        LEU  91   9.100   9.821   2.567
  635    HA   LEU  91           HA       LEU  91  11.703  10.953   3.036
  636   1HB   LEU  91          2HB       LEU  91  11.065  12.785   1.604
  637   2HB   LEU  91          1HB       LEU  91  10.631  11.261   0.868
  638    HG   LEU  91           HG       LEU  91   8.242  11.758   1.760
  639   1HD1  LEU  91          1HD1      LEU  91   9.419  14.536   1.803
  640   2HD1  LEU  91          2HD1      LEU  91   8.837  13.637   3.206
  641   3HD1  LEU  91          3HD1      LEU  91   7.709  14.129   1.942
  642   1HD2  LEU  91          1HD2      LEU  91   7.736  13.026  -0.255
  643   2HD2  LEU  91          2HD2      LEU  91   8.885  11.733  -0.596
  644   3HD2  LEU  91          3HD2      LEU  91   9.447  13.400  -0.464
  645    H    ARG  92           H        ARG  92   8.654  11.200   4.547
  646    HA   ARG  92           HA       ARG  92   9.167  13.742   5.794
  647   1HB   ARG  92          2HB       ARG  92   7.117  11.762   6.701
  648   2HB   ARG  92          1HB       ARG  92   7.076  13.515   6.823
  649   1HG   ARG  92          2HG       ARG  92   6.454  13.785   4.618
  650   2HG   ARG  92          1HG       ARG  92   7.065  12.193   4.151
  651   1HD   ARG  92          2HD       ARG  92   4.534  12.916   5.551
  652   2HD   ARG  92          1HD       ARG  92   4.798  11.822   4.186
  653    HE   ARG  92           HE       ARG  92   6.111  10.546   6.106
  654   1HH1  ARG  92          1HH1      ARG  92   2.909  11.977   6.071
  655   2HH1  ARG  92          2HH1      ARG  92   2.309  10.991   7.371
  656   1HH2  ARG  92          1HH2      ARG  92   5.289   9.224   7.833
  657   2HH2  ARG  92          2HH2      ARG  92   3.645   9.428   8.357
  658    H    GLN  93           H        GLN  93   9.117  10.342   6.645
  659    HA   GLN  93           HA       GLN  93   9.877  11.054   9.367
  660   1HB   GLN  93          2HB       GLN  93   8.955   8.936  10.035
  661   2HB   GLN  93          1HB       GLN  93   7.805   9.781   8.996
  662   1HG   GLN  93          2HG       GLN  93   8.939   8.397   7.107
  663   2HG   GLN  93          1HG       GLN  93   9.441   7.359   8.442
  664   1HE2  GLN  93          1HE2      GLN  93   7.617   6.808   6.254
  665   2HE2  GLN  93          2HE2      GLN  93   6.126   6.346   7.003
  666    H    GLY  94           H        GLY  94  11.049   9.151   6.645
  667   1HA   GLY  94          2HA       GLY  94  13.351   8.734   6.301
  668   2HA   GLY  94          1HA       GLY  94  13.630   8.980   8.020
  669    H    TRP  95           H        TRP  95  11.238   6.876   6.504
  670    HA   TRP  95           HA       TRP  95  10.917   4.654   6.454
  671   1HB   TRP  95          2HB       TRP  95  13.803   4.317   7.293
  672   2HB   TRP  95          1HB       TRP  95  12.764   3.090   6.569
  673    HD1  TRP  95           HD       TRP  95  14.435   6.432   5.594
  674    HE1  TRP  95           1HE      TRP  95  14.938   6.360   3.083
  675    HE3  TRP  95           3HE      TRP  95  12.218   1.971   4.479
  676    HZ2  TRP  95           2HZ      TRP  95  14.438   4.635   0.905
  677    HZ3  TRP  95           3HZ      TRP  95  12.274   1.184   2.149
  678    HH2  TRP  95           HH       TRP  95  13.363   2.492   0.401
  679    H    GLY  96           H        GLY  96  11.192   6.483   8.954
  680   1HA   GLY  96          2HA       GLY  96  11.688   4.924  11.205
  681   2HA   GLY  96          1HA       GLY  96  10.669   6.351  11.175
  682    H    ALA  97           H        ALA  97   8.609   5.404   9.479
  683    HA   ALA  97           HA       ALA  97   7.074   3.920  11.358
  684   1HB   ALA  97          1HB       ALA  97   6.024   5.537   9.846
  685   2HB   ALA  97          2HB       ALA  97   5.297   3.937   9.697
  686   3HB   ALA  97          3HB       ALA  97   6.428   4.509   8.473
  687    H    TRP  98           H        TRP  98   9.216   3.033   8.855
  688    HA   TRP  98           HA       TRP  98   8.149   0.315   8.728
  689   1HB   TRP  98          2HB       TRP  98  10.283   1.774   7.166
  690   2HB   TRP  98          1HB       TRP  98  10.018   0.037   7.020
  691    HD1  TRP  98           HD       TRP  98   7.680  -0.764   5.955
  692    HE1  TRP  98           1HE      TRP  98   6.071   0.408   4.321
  693    HE3  TRP  98           3HE      TRP  98   9.339   4.069   6.486
  694    HZ2  TRP  98           2HZ      TRP  98   5.588   3.035   3.359
  695    HZ3  TRP  98           3HZ      TRP  98   8.259   5.830   5.173
  696    HH2  TRP  98           HH       TRP  98   6.418   5.326   3.651
  697    HA   PRO  99           HA       PRO  99  10.765  -0.329  12.257
  698   1HB   PRO  99          2HB       PRO  99   9.694  -3.089  11.911
  699   2HB   PRO  99          1HB       PRO  99   9.684  -2.049  13.342
  700   1HG   PRO  99          2HG       PRO  99   7.459  -2.395  11.989
  701   2HG   PRO  99          1HG       PRO  99   7.911  -0.762  12.528
  702   1HD   PRO  99          2HD       PRO  99   8.271  -2.003   9.810
  703   2HD   PRO  99          1HD       PRO  99   7.573  -0.421  10.233
  704    H    VAL 100           H        VAL 100  11.340  -3.423  12.238
  705    HA   VAL 100           HA       VAL 100  14.064  -3.219  11.765
  706    HB   VAL 100           HB       VAL 100  12.478  -5.781  11.561
  707   1HG1  VAL 100          1HG1      VAL 100  14.501  -6.811  12.463
  708   2HG1  VAL 100          2HG1      VAL 100  15.295  -5.236  12.486
  709   3HG1  VAL 100          3HG1      VAL 100  14.831  -5.966  10.949
  710   1HG2  VAL 100          1HG2      VAL 100  11.768  -4.605  13.560
  711   2HG2  VAL 100          2HG2      VAL 100  13.447  -4.354  14.037
  712   3HG2  VAL 100          3HG2      VAL 100  12.777  -5.986  13.997
  713    H    CYS 101           H        CYS 101  11.482  -3.834   9.540
  714    HA   CYS 101           HA       CYS 101  12.955  -5.137   7.520
  715   1HB   CYS 101          2HB       CYS 101  10.425  -3.495   7.342
  716   2HB   CYS 101          1HB       CYS 101  11.080  -4.467   6.023
  717    H    ALA 102           H        ALA 102  12.468  -1.715   8.255
  718    HA   ALA 102           HA       ALA 102  13.623  -0.770   5.820
  719   1HB   ALA 102          1HB       ALA 102  13.391   0.642   8.477
  720   2HB   ALA 102          2HB       ALA 102  12.176   0.651   7.201
  721   3HB   ALA 102          3HB       ALA 102  13.750   1.396   6.923
  722    H    ALA 103           H        ALA 103  14.859  -1.437   9.060
  723    HA   ALA 103           HA       ALA 103  17.505  -0.596   8.615
  724   1HB   ALA 103          1HB       ALA 103  18.085  -1.912  10.565
  725   2HB   ALA 103          2HB       ALA 103  16.554  -2.783  10.466
  726   3HB   ALA 103          3HB       ALA 103  16.570  -1.060  10.851
  727    H    ARG 104           H        ARG 104  15.862  -3.649   8.085
  728    HA   ARG 104           HA       ARG 104  18.165  -5.084   7.246
  729   1HB   ARG 104          2HB       ARG 104  15.209  -5.584   6.895
  730   2HB   ARG 104          1HB       ARG 104  16.438  -6.705   6.327
  731   1HG   ARG 104          2HG       ARG 104  16.152  -5.847   9.195
  732   2HG   ARG 104          1HG       ARG 104  15.390  -7.280   8.516
  733   1HD   ARG 104          2HD       ARG 104  17.369  -8.017   9.578
  734   2HD   ARG 104          1HD       ARG 104  17.689  -8.054   7.847
  735    HE   ARG 104           HE       ARG 104  19.232  -6.350   8.098
  736   1HH1  ARG 104          1HH1      ARG 104  17.586  -6.995  11.131
  737   2HH1  ARG 104          2HH1      ARG 104  18.646  -5.967  12.058
  738   1HH2  ARG 104          1HH2      ARG 104  20.610  -4.982   9.339
  739   2HH2  ARG 104          2HH2      ARG 104  20.342  -4.838  11.053
  740    H    ALA 105           H        ALA 105  15.843  -3.053   5.636
  741    HA   ALA 105           HA       ALA 105  16.538  -3.919   2.974
  742   1HB   ALA 105          1HB       ALA 105  15.032  -2.155   2.265
  743   2HB   ALA 105          2HB       ALA 105  14.949  -1.547   3.918
  744   3HB   ALA 105          3HB       ALA 105  14.302  -3.141   3.534
  745    H    GLY 106           H        GLY 106  17.670  -1.528   5.213
  746   1HA   GLY 106          2HA       GLY 106  19.727  -0.354   4.937
  747   2HA   GLY 106          1HA       GLY 106  19.547  -0.510   3.194
  748    H    ALA 107           H        ALA 107  17.674   0.854   5.883
  749    HA   ALA 107           HA       ALA 107  16.267   2.765   4.452
  750   1HB   ALA 107          1HB       ALA 107  17.092   2.878   7.345
  751   2HB   ALA 107          2HB       ALA 107  15.685   2.025   6.711
  752   3HB   ALA 107          3HB       ALA 107  15.776   3.783   6.597
  753    H    ARG 108           H        ARG 108  16.469   4.992   4.198
  754    HA   ARG 108           HA       ARG 108  18.729   6.479   4.941
  755   1HB   ARG 108          2HB       ARG 108  19.523   6.724   2.434
  756   2HB   ARG 108          1HB       ARG 108  20.164   5.458   3.467
  757   1HG   ARG 108          2HG       ARG 108  19.709   4.377   1.460
  758   2HG   ARG 108          1HG       ARG 108  18.332   3.965   2.489
  759   1HD   ARG 108          2HD       ARG 108  17.467   4.510   0.351
  760   2HD   ARG 108          1HD       ARG 108  17.098   5.867   1.410
  761    HE   ARG 108           HE       ARG 108  19.407   5.935  -0.421
  762   1HH1  ARG 108          1HH1      ARG 108  16.537   7.394   0.939
  763   2HH1  ARG 108          2HH1      ARG 108  16.574   8.776  -0.125
  764   1HH2  ARG 108          1HH2      ARG 108  19.499   7.763  -1.791
  765   2HH2  ARG 108          2HH2      ARG 108  18.278   8.995  -1.657
  Start of MODEL   27
    1   1H    ASN   1          1HT       ASN   1  10.876  57.696  -7.571
    2   2H    ASN   1          2HT       ASN   1   9.338  56.991  -7.611
    3   3H    ASN   1          3HT       ASN   1  10.522  56.509  -8.730
    4    HA   ASN   1           HA       ASN   1  10.537  56.057  -5.806
    5   1HB   ASN   1          2HB       ASN   1  10.519  54.115  -8.132
    6   2HB   ASN   1          1HB       ASN   1  10.532  53.682  -6.427
    7   1HD2  ASN   1          1HD2      ASN   1   8.641  54.883  -9.070
    8   2HD2  ASN   1          2HD2      ASN   1   7.101  54.734  -8.292
    9    H    VAL   2           H        VAL   2  12.458  55.751  -4.888
   10    HA   VAL   2           HA       VAL   2  14.837  56.245  -6.417
   11    HB   VAL   2           HB       VAL   2  14.520  57.074  -4.089
   12   1HG1  VAL   2          1HG1      VAL   2  13.425  55.132  -3.130
   13   2HG1  VAL   2          2HG1      VAL   2  14.862  55.561  -2.206
   14   3HG1  VAL   2          3HG1      VAL   2  14.904  54.189  -3.313
   15   1HG2  VAL   2          1HG2      VAL   2  16.756  56.938  -5.062
   16   2HG2  VAL   2          2HG2      VAL   2  16.927  55.292  -4.454
   17   3HG2  VAL   2          3HG2      VAL   2  16.796  56.641  -3.324
   18    H    VAL   3           H        VAL   3  13.067  53.484  -5.504
   19    HA   VAL   3           HA       VAL   3  15.124  51.568  -5.567
   20    HB   VAL   3           HB       VAL   3  12.171  51.210  -6.087
   21   1HG1  VAL   3          1HG1      VAL   3  14.287  49.161  -5.427
   22   2HG1  VAL   3          2HG1      VAL   3  13.468  49.345  -6.977
   23   3HG1  VAL   3          3HG1      VAL   3  12.555  48.849  -5.553
   24   1HG2  VAL   3          1HG2      VAL   3  12.085  50.462  -3.752
   25   2HG2  VAL   3          2HG2      VAL   3  12.626  52.135  -3.885
   26   3HG2  VAL   3          3HG2      VAL   3  13.794  50.852  -3.572
   27    H    VAL   4           H        VAL   4  16.274  50.936  -7.265
   28    HA   VAL   4           HA       VAL   4  15.309  51.494  -9.960
   29    HB   VAL   4           HB       VAL   4  17.928  50.210  -9.205
   30   1HG1  VAL   4          1HG1      VAL   4  17.084  51.745 -11.656
   31   2HG1  VAL   4          2HG1      VAL   4  17.290  49.999 -11.547
   32   3HG1  VAL   4          3HG1      VAL   4  18.685  51.063 -11.364
   33   1HG2  VAL   4          1HG2      VAL   4  17.348  53.152  -9.536
   34   2HG2  VAL   4          2HG2      VAL   4  18.948  52.436  -9.322
   35   3HG2  VAL   4          3HG2      VAL   4  17.755  52.338  -8.025
   36    H    THR   5           H        THR   5  15.043  49.908 -11.515
   37    HA   THR   5           HA       THR   5  14.444  47.254 -10.433
   38    HB   THR   5           HB       THR   5  13.156  47.030 -12.651
   39    HG1  THR   5           1HG      THR   5  13.892  48.795 -13.795
   40   1HG2  THR   5          1HG2      THR   5  12.259  49.030 -10.573
   41   2HG2  THR   5          2HG2      THR   5  12.055  47.281 -10.491
   42   3HG2  THR   5          3HG2      THR   5  11.205  48.210 -11.725
   43    HA   PRO   6           HA       PRO   6  17.753  45.886 -13.171
   44   1HB   PRO   6          2HB       PRO   6  18.737  44.059 -11.417
   45   2HB   PRO   6          1HB       PRO   6  19.145  45.775 -11.347
   46   1HG   PRO   6          2HG       PRO   6  17.581  44.208  -9.482
   47   2HG   PRO   6          1HG       PRO   6  18.135  45.881  -9.330
   48   1HD   PRO   6          2HD       PRO   6  15.521  44.844 -10.199
   49   2HD   PRO   6          1HD       PRO   6  15.944  46.459  -9.588
   50    H    ALA   7           H        ALA   7  18.232  43.834 -14.089
   51    HA   ALA   7           HA       ALA   7  15.925  42.090 -14.360
   52   1HB   ALA   7          1HB       ALA   7  17.223  42.726 -16.336
   53   2HB   ALA   7          2HB       ALA   7  17.222  40.980 -16.092
   54   3HB   ALA   7          3HB       ALA   7  18.638  41.931 -15.652
   55    H    HIS   8           H        HIS   8  16.750  42.066 -11.886
   56    HA   HIS   8           HA       HIS   8  18.421  39.834 -11.242
   57   1HB   HIS   8          2HB       HIS   8  17.900  41.922  -9.815
   58   2HB   HIS   8          1HB       HIS   8  16.372  41.133  -9.450
   59    HD1  HIS   8           1HD      HIS   8  19.972  41.136  -8.541
   60    HD2  HIS   8           2HD      HIS   8  16.602  38.793  -7.852
   61    HE1  HIS   8           1HE      HIS   8  20.540  39.620  -6.594
   62    H    GLU   9           H        GLU   9  15.466  40.136 -12.616
   63    HA   GLU   9           HA       GLU   9  13.749  38.399 -11.301
   64   1HB   GLU   9          2HB       GLU   9  12.597  38.116 -13.432
   65   2HB   GLU   9          1HB       GLU   9  13.066  39.795 -13.210
   66   1HG   GLU   9          2HG       GLU   9  14.942  39.495 -14.709
   67   2HG   GLU   9          1HG       GLU   9  14.551  37.785 -14.878
   68    H    ALA  10           H        ALA  10  13.563  36.282 -11.088
   69    HA   ALA  10           HA       ALA  10  14.995  34.443 -12.816
   70   1HB   ALA  10          1HB       ALA  10  16.650  34.938 -11.089
   71   2HB   ALA  10          2HB       ALA  10  16.075  33.277 -10.943
   72   3HB   ALA  10          3HB       ALA  10  15.483  34.518  -9.837
   73    H    VAL  11           H        VAL  11  12.748  34.175 -13.326
   74    HA   VAL  11           HA       VAL  11  10.889  33.220 -11.413
   75    HB   VAL  11           HB       VAL  11  10.760  33.069 -14.400
   76   1HG1  VAL  11          1HG1      VAL  11   9.224  31.509 -13.337
   77   2HG1  VAL  11          2HG1      VAL  11   8.339  32.840 -14.085
   78   3HG1  VAL  11          3HG1      VAL  11   8.580  32.813 -12.339
   79   1HG2  VAL  11          1HG2      VAL  11   9.394  35.087 -14.265
   80   2HG2  VAL  11          2HG2      VAL  11  11.004  35.363 -13.600
   81   3HG2  VAL  11          3HG2      VAL  11   9.632  35.131 -12.517
   82    H    VAL  12           H        VAL  12  12.716  31.689 -14.020
   83    HA   VAL  12           HA       VAL  12  12.752  29.550 -14.743
   84    HB   VAL  12           HB       VAL  12  14.751  29.790 -13.551
   85   1HG1  VAL  12          1HG1      VAL  12  13.321  28.945 -11.044
   86   2HG1  VAL  12          2HG1      VAL  12  13.877  30.576 -11.421
   87   3HG1  VAL  12          3HG1      VAL  12  15.048  29.274 -11.196
   88   1HG2  VAL  12          1HG2      VAL  12  14.334  27.567 -14.385
   89   2HG2  VAL  12          2HG2      VAL  12  13.493  27.136 -12.898
   90   3HG2  VAL  12          3HG2      VAL  12  15.226  27.467 -12.867
   91    H    ARG  13           H        ARG  13  10.679  29.038 -15.012
   92    HA   ARG  13           HA       ARG  13   9.130  27.871 -12.907
   93   1HB   ARG  13          2HB       ARG  13   7.332  27.711 -14.533
   94   2HB   ARG  13          1HB       ARG  13   8.035  29.322 -14.559
   95   1HG   ARG  13          2HG       ARG  13   9.152  28.898 -16.600
   96   2HG   ARG  13          1HG       ARG  13   8.807  27.170 -16.506
   97   1HD   ARG  13          2HD       ARG  13   7.060  27.608 -17.818
   98   2HD   ARG  13          1HD       ARG  13   6.311  28.292 -16.378
   99    HE   ARG  13           HE       ARG  13   7.437  30.461 -17.219
  100   1HH1  ARG  13          1HH1      ARG  13   6.143  27.901 -19.226
  101   2HH1  ARG  13          2HH1      ARG  13   5.731  28.955 -20.547
  102   1HH2  ARG  13          1HH2      ARG  13   6.870  31.876 -18.951
  103   2HH2  ARG  13          2HH2      ARG  13   6.132  31.221 -20.382
  104    H    VAL  14           H        VAL  14   9.326  25.908 -12.364
  105    HA   VAL  14           HA       VAL  14  10.093  23.857 -14.293
  106    HB   VAL  14           HB       VAL  14  10.013  23.457 -11.323
  107   1HG1  VAL  14          1HG1      VAL  14  10.236  21.445 -12.611
  108   2HG1  VAL  14          2HG1      VAL  14  11.774  21.786 -11.816
  109   3HG1  VAL  14          3HG1      VAL  14  11.573  22.135 -13.533
  110   1HG2  VAL  14          1HG2      VAL  14  12.341  24.567 -12.880
  111   2HG2  VAL  14          2HG2      VAL  14  12.404  24.022 -11.208
  112   3HG2  VAL  14          3HG2      VAL  14  11.410  25.409 -11.643
  113    H    GLY  15           H        GLY  15   9.042  21.791 -13.951
  114   1HA   GLY  15          2HA       GLY  15   7.050  20.825 -12.684
  115   2HA   GLY  15          1HA       GLY  15   6.179  22.134 -13.474
  116    H    THR  16           H        THR  16   8.258  19.385 -14.097
  117    HA   THR  16           HA       THR  16   7.006  19.065 -16.708
  118    HB   THR  16           HB       THR  16   9.769  18.259 -15.811
  119    HG1  THR  16           1HG      THR  16   9.127  20.169 -17.813
  120   1HG2  THR  16          1HG2      THR  16   8.860  16.719 -17.467
  121   2HG2  THR  16          2HG2      THR  16  10.169  17.689 -18.144
  122   3HG2  THR  16          3HG2      THR  16   8.493  18.074 -18.532
  123    H    LYS  17           H        LYS  17   7.757  17.605 -13.720
  124    HA   LYS  17           HA       LYS  17   7.649  14.884 -14.429
  125   1HB   LYS  17          2HB       LYS  17   6.929  15.967 -11.715
  126   2HB   LYS  17          1HB       LYS  17   7.651  14.414 -12.106
  127   1HG   LYS  17          2HG       LYS  17   8.973  17.110 -12.311
  128   2HG   LYS  17          1HG       LYS  17   9.286  15.864 -11.099
  129   1HD   LYS  17          2HD       LYS  17  10.122  14.374 -12.834
  130   2HD   LYS  17          1HD       LYS  17   9.755  15.590 -14.065
  131   1HE   LYS  17          2HE       LYS  17  12.150  15.523 -13.396
  132   2HE   LYS  17          1HE       LYS  17  11.384  17.091 -13.163
  133   1HZ   LYS  17          1HZ       LYS  17  12.817  16.358 -11.291
  134   2HZ   LYS  17          2HZ       LYS  17  11.730  15.089 -11.000
  135   3HZ   LYS  17          3HZ       LYS  17  11.221  16.699 -10.838
  136    HA   PRO  18           HA       PRO  18   3.153  14.784 -14.742
  137   1HB   PRO  18          2HB       PRO  18   3.350  12.589 -16.488
  138   2HB   PRO  18          1HB       PRO  18   3.127  14.281 -16.936
  139   1HG   PRO  18          2HG       PRO  18   5.375  12.722 -17.483
  140   2HG   PRO  18          1HG       PRO  18   5.275  14.484 -17.581
  141   1HD   PRO  18          2HD       PRO  18   6.386  12.773 -15.405
  142   2HD   PRO  18          1HD       PRO  18   6.939  14.362 -15.989
  143    H    GLY  19           H        GLY  19   1.609  12.990 -14.583
  144   1HA   GLY  19          2HA       GLY  19   2.640  10.831 -12.873
  145   2HA   GLY  19          1HA       GLY  19   1.109  11.625 -12.549
  146    H    THR  20           H        THR  20   1.977  11.141 -15.734
  147    HA   THR  20           HA       THR  20  -0.183   9.394 -16.334
  148    HB   THR  20           HB       THR  20   2.213   9.989 -18.079
  149    HG1  THR  20           1HG      THR  20  -0.104  11.524 -17.475
  150   1HG2  THR  20          1HG2      THR  20   0.733   8.217 -18.897
  151   2HG2  THR  20          2HG2      THR  20   0.624   9.654 -19.912
  152   3HG2  THR  20          3HG2      THR  20  -0.650   9.299 -18.748
  153    H    GLU  21           H        GLU  21   3.274   9.034 -15.920
  154    HA   GLU  21           HA       GLU  21   2.961   6.172 -15.584
  155   1HB   GLU  21          2HB       GLU  21   5.058   5.784 -16.733
  156   2HB   GLU  21          1HB       GLU  21   3.983   6.672 -17.803
  157   1HG   GLU  21          2HG       GLU  21   5.161   8.679 -17.509
  158   2HG   GLU  21          1HG       GLU  21   6.044   8.047 -16.122
  159    H    VAL  22           H        VAL  22   4.530   5.309 -14.175
  160    HA   VAL  22           HA       VAL  22   5.733   7.305 -12.384
  161    HB   VAL  22           HB       VAL  22   5.104   4.397 -11.818
  162   1HG1  VAL  22          1HG1      VAL  22   6.151   6.565 -10.003
  163   2HG1  VAL  22          2HG1      VAL  22   7.044   5.152 -10.566
  164   3HG1  VAL  22          3HG1      VAL  22   5.660   4.951  -9.493
  165   1HG2  VAL  22          1HG2      VAL  22   3.084   5.759 -11.993
  166   2HG2  VAL  22          2HG2      VAL  22   3.751   6.907 -10.830
  167   3HG2  VAL  22          3HG2      VAL  22   3.371   5.261 -10.326
  168    HA   PRO  23           HA       PRO  23   9.575   6.003 -14.407
  169   1HB   PRO  23          2HB       PRO  23  10.556   7.862 -12.304
  170   2HB   PRO  23          1HB       PRO  23  10.945   7.808 -14.026
  171   1HG   PRO  23          2HG       PRO  23   9.324   9.679 -13.032
  172   2HG   PRO  23          1HG       PRO  23   9.040   8.966 -14.631
  173   1HD   PRO  23          2HD       PRO  23   7.637   8.487 -12.056
  174   2HD   PRO  23          1HD       PRO  23   6.996   8.488 -13.709
  175    HA   PRO  24           HA       PRO  24  10.281   2.742 -11.505
  176   1HB   PRO  24          2HB       PRO  24  12.841   2.128 -12.441
  177   2HB   PRO  24          1HB       PRO  24  11.328   1.450 -13.049
  178   1HG   PRO  24          2HG       PRO  24  12.937   3.739 -14.103
  179   2HG   PRO  24          1HG       PRO  24  12.085   2.458 -14.992
  180   1HD   PRO  24          2HD       PRO  24  11.011   4.870 -14.821
  181   2HD   PRO  24          1HD       PRO  24   9.996   3.427 -14.611
  182    H    VAL  25           H        VAL  25  11.226   2.535  -9.614
  183    HA   VAL  25           HA       VAL  25  13.062   4.692  -8.806
  184    HB   VAL  25           HB       VAL  25  11.029   3.268  -7.079
  185   1HG1  VAL  25          1HG1      VAL  25  12.704   4.027  -5.644
  186   2HG1  VAL  25          2HG1      VAL  25  11.491   5.305  -5.599
  187   3HG1  VAL  25          3HG1      VAL  25  12.952   5.508  -6.564
  188   1HG2  VAL  25          1HG2      VAL  25   9.936   4.645  -8.773
  189   2HG2  VAL  25          2HG2      VAL  25  10.912   6.030  -8.282
  190   3HG2  VAL  25          3HG2      VAL  25   9.738   5.335  -7.164
  191    H    ILE  26           H        ILE  26  14.966   4.151  -8.066
  192    HA   ILE  26           HA       ILE  26  15.869   1.466  -8.069
  193    HB   ILE  26           HB       ILE  26  17.252   3.890  -6.907
  194   1HG1  ILE  26          2HG1      ILE  26  16.631   4.282  -9.242
  195   2HG1  ILE  26          1HG1      ILE  26  18.372   4.072  -9.093
  196   1HG2  ILE  26          1HG2      ILE  26  18.240   1.764  -6.211
  197   2HG2  ILE  26          2HG2      ILE  26  19.313   2.649  -7.295
  198   3HG2  ILE  26          3HG2      ILE  26  18.385   1.277  -7.900
  199   1HD1  ILE  26          1HD1      ILE  26  16.422   1.982 -10.034
  200   2HD1  ILE  26          2HD1      ILE  26  18.170   1.783  -9.900
  201   3HD1  ILE  26          3HD1      ILE  26  17.499   2.933 -11.055
  202    H    ASP  27           H        ASP  27  14.468   3.476  -5.703
  203    HA   ASP  27           HA       ASP  27  15.511   2.119  -3.416
  204   1HB   ASP  27          2HB       ASP  27  13.222   4.062  -3.650
  205   2HB   ASP  27          1HB       ASP  27  13.938   3.507  -2.144
  206    H    GLY  28           H        GLY  28  13.413   1.355  -5.719
  207   1HA   GLY  28          2HA       GLY  28  11.315   0.138  -4.227
  208   2HA   GLY  28          1HA       GLY  28  11.730  -0.219  -5.901
  209    H    SER  29           H        SER  29  14.561  -0.505  -4.572
  210    HA   SER  29           HA       SER  29  14.440  -3.371  -4.337
  211   1HB   SER  29          2HB       SER  29  16.729  -1.520  -3.703
  212   2HB   SER  29          1HB       SER  29  16.829  -3.253  -4.005
  213    HG   SER  29           HG       SER  29  17.227  -1.532  -5.789
  214    H    ILE  30           H        ILE  30  15.137  -0.705  -2.166
  215    HA   ILE  30           HA       ILE  30  15.249  -2.282   0.174
  216    HB   ILE  30           HB       ILE  30  15.114  -0.079   1.344
  217   1HG1  ILE  30          2HG1      ILE  30  14.916   0.955  -1.472
  218   2HG1  ILE  30          1HG1      ILE  30  13.866   1.308  -0.106
  219   1HG2  ILE  30          1HG2      ILE  30  17.258  -1.050   0.790
  220   2HG2  ILE  30          2HG2      ILE  30  17.332   0.696   0.558
  221   3HG2  ILE  30          3HG2      ILE  30  17.177  -0.372  -0.836
  222   1HD1  ILE  30          1HD1      ILE  30  16.724   2.202  -0.418
  223   2HD1  ILE  30          2HD1      ILE  30  15.687   2.542   0.966
  224   3HD1  ILE  30          3HD1      ILE  30  15.285   3.203  -0.621
  225    H    TRP  31           H        TRP  31  12.806  -0.492  -1.534
  226    HA   TRP  31           HA       TRP  31  10.746  -0.676   0.377
  227   1HB   TRP  31          2HB       TRP  31  10.728  -0.256  -2.621
  228   2HB   TRP  31          1HB       TRP  31   9.234  -0.468  -1.724
  229    HD1  TRP  31           HD       TRP  31  11.004   2.287  -3.090
  230    HE1  TRP  31           1HE      TRP  31  10.636   4.466  -1.730
  231    HE3  TRP  31           3HE      TRP  31   9.276   0.241   1.216
  232    HZ2  TRP  31           2HZ      TRP  31   9.778   5.171   0.866
  233    HZ3  TRP  31           3HZ      TRP  31   8.710   1.706   3.105
  234    HH2  TRP  31           HH       TRP  31   8.957   4.121   2.926
  235    H    ASP  32           H        ASP  32  11.929  -2.815  -2.138
  236    HA   ASP  32           HA       ASP  32   9.806  -4.709  -1.809
  237   1HB   ASP  32          2HB       ASP  32  10.971  -4.457  -3.952
  238   2HB   ASP  32          1HB       ASP  32  12.473  -5.001  -3.194
  239    H    ALA  33           H        ALA  33  13.065  -4.280  -0.495
  240    HA   ALA  33           HA       ALA  33  13.189  -6.849   0.670
  241   1HB   ALA  33          1HB       ALA  33  14.599  -4.325   1.518
  242   2HB   ALA  33          2HB       ALA  33  15.182  -5.473   0.313
  243   3HB   ALA  33          3HB       ALA  33  15.024  -5.968   1.999
  244    H    ILE  34           H        ILE  34  11.907  -3.727   1.703
  245    HA   ILE  34           HA       ILE  34  11.099  -4.576   4.302
  246    HB   ILE  34           HB       ILE  34   9.869  -2.497   2.495
  247   1HG1  ILE  34          2HG1      ILE  34  11.830  -2.216   4.788
  248   2HG1  ILE  34          1HG1      ILE  34  12.229  -2.056   3.081
  249   1HG2  ILE  34          1HG2      ILE  34   8.289  -3.228   4.202
  250   2HG2  ILE  34          2HG2      ILE  34   8.848  -1.590   4.539
  251   3HG2  ILE  34          3HG2      ILE  34   9.495  -2.949   5.458
  252   1HD1  ILE  34          1HD1      ILE  34  10.382  -0.274   4.644
  253   2HD1  ILE  34          2HD1      ILE  34  10.757  -0.112   2.929
  254   3HD1  ILE  34          3HD1      ILE  34  12.024   0.111   4.134
  255    H    ALA  35           H        ALA  35   9.508  -4.548   1.141
  256    HA   ALA  35           HA       ALA  35   7.050  -5.645   1.850
  257   1HB   ALA  35          1HB       ALA  35   8.587  -6.115  -0.702
  258   2HB   ALA  35          2HB       ALA  35   7.570  -4.714  -0.367
  259   3HB   ALA  35          3HB       ALA  35   6.850  -6.320  -0.471
  260    H    GLY  36           H        GLY  36  10.150  -7.120   1.273
  261   1HA   GLY  36          2HA       GLY  36   9.170  -9.833   1.382
  262   2HA   GLY  36          1HA       GLY  36  10.854  -9.327   1.366
  263    H    CYS  37           H        CYS  37   9.600  -7.515   3.698
  264    HA   CYS  37           HA       CYS  37  10.394  -9.412   5.780
  265   1HB   CYS  37          2HB       CYS  37  11.718  -7.373   5.676
  266   2HB   CYS  37          1HB       CYS  37  10.261  -6.392   5.784
  267    H    GLU  38           H        GLU  38   7.965  -6.872   5.168
  268    HA   GLU  38           HA       GLU  38   6.464  -7.725   7.500
  269   1HB   GLU  38          2HB       GLU  38   6.223  -5.416   5.593
  270   2HB   GLU  38          1HB       GLU  38   4.918  -5.812   6.703
  271   1HG   GLU  38          2HG       GLU  38   7.745  -5.171   7.509
  272   2HG   GLU  38          1HG       GLU  38   6.391  -4.042   7.546
  273    H    ALA  39           H        ALA  39   6.320  -7.887   4.025
  274    HA   ALA  39           HA       ALA  39   3.680  -9.102   4.206
  275   1HB   ALA  39          1HB       ALA  39   3.824  -7.267   2.637
  276   2HB   ALA  39          2HB       ALA  39   3.511  -8.782   1.788
  277   3HB   ALA  39          3HB       ALA  39   5.132  -8.086   1.783
  278    H    GLY  40           H        GLY  40   6.895  -9.927   3.980
  279   1HA   GLY  40          2HA       GLY  40   7.880 -12.018   3.818
  280   2HA   GLY  40          1HA       GLY  40   6.281 -12.705   3.530
  281    H    GLY  41           H        GLY  41   7.021 -10.015   1.698
  282   1HA   GLY  41          2HA       GLY  41   7.642  -9.681  -0.456
  283   2HA   GLY  41          1HA       GLY  41   8.158 -11.365  -0.569
  284    H    ASN  42           H        ASN  42   5.177  -9.469  -0.159
  285    HA   ASN  42           HA       ASN  42   3.945 -10.789  -2.405
  286   1HB   ASN  42          2HB       ASN  42   3.644 -12.222  -0.199
  287   2HB   ASN  42          1HB       ASN  42   2.424 -11.003   0.165
  288   1HD2  ASN  42          1HD2      ASN  42   0.526 -10.956  -1.034
  289   2HD2  ASN  42          2HD2      ASN  42   0.074 -12.223  -2.114
  290    H    TRP  43           H        TRP  43   3.551  -8.847  -3.330
  291    HA   TRP  43           HA       TRP  43   2.749  -6.555  -1.815
  292   1HB   TRP  43          2HB       TRP  43   2.787  -7.006  -4.799
  293   2HB   TRP  43          1HB       TRP  43   2.578  -5.448  -4.003
  294    HD1  TRP  43           HD       TRP  43   5.217  -8.290  -4.033
  295    HE1  TRP  43           1HE      TRP  43   7.562  -7.203  -3.948
  296    HE3  TRP  43           3HE      TRP  43   3.832  -3.382  -3.710
  297    HZ2  TRP  43           2HZ      TRP  43   8.661  -4.617  -3.748
  298    HZ3  TRP  43           3HZ      TRP  43   5.582  -1.661  -3.599
  299    HH2  TRP  43           HH       TRP  43   7.957  -2.292  -3.642
  300    H    ALA  44           H        ALA  44   1.115  -9.188  -3.002
  301    HA   ALA  44           HA       ALA  44  -1.430  -7.722  -3.212
  302   1HB   ALA  44          1HB       ALA  44  -0.772 -10.520  -4.122
  303   2HB   ALA  44          2HB       ALA  44  -0.824  -9.087  -5.150
  304   3HB   ALA  44          3HB       ALA  44  -2.298  -9.674  -4.378
  305    H    ILE  45           H        ILE  45   0.109  -8.802  -0.738
  306    HA   ILE  45           HA       ILE  45  -1.642 -10.797   0.310
  307    HB   ILE  45           HB       ILE  45   0.899 -10.432   0.805
  308   1HG1  ILE  45          2HG1      ILE  45  -1.056 -11.056   3.023
  309   2HG1  ILE  45          1HG1      ILE  45  -0.534 -12.176   1.771
  310   1HG2  ILE  45          1HG2      ILE  45   0.751  -8.136   1.585
  311   2HG2  ILE  45          2HG2      ILE  45   1.337  -9.189   2.872
  312   3HG2  ILE  45          3HG2      ILE  45  -0.336  -8.628   2.884
  313   1HD1  ILE  45          1HD1      ILE  45   1.750 -12.056   2.606
  314   2HD1  ILE  45          2HD1      ILE  45   0.632 -12.571   3.869
  315   3HD1  ILE  45          3HD1      ILE  45   1.237 -10.916   3.848
  316    H    ASN  46           H        ASN  46  -3.181 -10.538   1.882
  317    HA   ASN  46           HA       ASN  46  -3.655  -7.888   2.988
  318   1HB   ASN  46          2HB       ASN  46  -4.941  -8.134   0.767
  319   2HB   ASN  46          1HB       ASN  46  -5.945  -9.298   1.628
  320   1HD2  ASN  46          1HD2      ASN  46  -5.084  -5.980   1.245
  321   2HD2  ASN  46          2HD2      ASN  46  -6.313  -5.319   2.270
  322    H    THR  47           H        THR  47  -3.189  -8.766   4.974
  323    HA   THR  47           HA       THR  47  -4.380 -11.195   5.887
  324    HB   THR  47           HB       THR  47  -3.371 -10.422   8.116
  325    HG1  THR  47           1HG      THR  47  -1.776  -8.711   7.787
  326   1HG2  THR  47          1HG2      THR  47  -2.249 -12.036   6.681
  327   2HG2  THR  47          2HG2      THR  47  -1.070 -10.911   7.355
  328   3HG2  THR  47          3HG2      THR  47  -1.603 -10.734   5.684
  329    H    GLY  48           H        GLY  48  -5.386  -7.945   5.796
  330   1HA   GLY  48          2HA       GLY  48  -7.563  -7.223   6.369
  331   2HA   GLY  48          1HA       GLY  48  -7.683  -8.571   7.498
  332    H    ASN  49           H        ASN  49  -4.809  -6.706   7.410
  333    HA   ASN  49           HA       ASN  49  -5.177  -6.007  10.188
  334   1HB   ASN  49          2HB       ASN  49  -3.042  -6.914   8.925
  335   2HB   ASN  49          1HB       ASN  49  -2.778  -5.207   8.589
  336   1HD2  ASN  49          1HD2      ASN  49  -1.149  -6.980  10.132
  337   2HD2  ASN  49          2HD2      ASN  49  -1.084  -6.342  11.742
  338    H    GLY  50           H        GLY  50  -5.758  -4.536   7.221
  339   1HA   GLY  50          2HA       GLY  50  -6.662  -2.369   6.936
  340   2HA   GLY  50          1HA       GLY  50  -5.909  -1.883   8.455
  341    H    TYR  51           H        TYR  51  -3.582  -3.553   7.217
  342    HA   TYR  51           HA       TYR  51  -2.451  -1.386   5.595
  343   1HB   TYR  51          2HB       TYR  51  -0.774  -3.537   6.886
  344   2HB   TYR  51          1HB       TYR  51  -0.269  -1.990   6.259
  345    HD1  TYR  51           1HD      TYR  51   0.865  -2.660   8.672
  346    HD2  TYR  51           2HD      TYR  51  -3.024  -1.053   8.044
  347    HE1  TYR  51           1HE      TYR  51   0.892  -1.750  10.952
  348    HE2  TYR  51           2HE      TYR  51  -3.008  -0.133  10.342
  349    HH   TYR  51           HH       TYR  51  -1.849  -0.615  12.529
  350    H    TYR  52           H        TYR  52  -1.335  -2.098   3.690
  351    HA   TYR  52           HA       TYR  52  -2.636  -4.569   2.790
  352   1HB   TYR  52          2HB       TYR  52  -2.075  -2.094   1.168
  353   2HB   TYR  52          1HB       TYR  52  -2.972  -3.523   0.639
  354    HD1  TYR  52           1HD      TYR  52  -4.906  -4.215   2.332
  355    HD2  TYR  52           2HD      TYR  52  -3.314  -0.303   1.917
  356    HE1  TYR  52           1HE      TYR  52  -6.963  -3.295   3.303
  357    HE2  TYR  52           2HE      TYR  52  -5.366   0.640   2.906
  358    HH   TYR  52           HH       TYR  52  -7.780  -0.060   3.131
  359    H    GLY  53           H        GLY  53  -1.720  -5.418   0.713
  360   1HA   GLY  53          2HA       GLY  53   0.643  -6.654   1.403
  361   2HA   GLY  53          1HA       GLY  53  -0.066  -6.676  -0.201
  362    H    GLY  54           H        GLY  54   2.666  -6.757   0.369
  363   1HA   GLY  54          2HA       GLY  54   4.417  -5.822  -0.907
  364   2HA   GLY  54          1HA       GLY  54   3.507  -4.320  -1.007
  365    H    VAL  55           H        VAL  55   4.031  -2.707   0.340
  366    HA   VAL  55           HA       VAL  55   6.258  -3.186   2.142
  367    HB   VAL  55           HB       VAL  55   4.944  -0.515   1.704
  368   1HG1  VAL  55          1HG1      VAL  55   7.110   0.357   2.216
  369   2HG1  VAL  55          2HG1      VAL  55   7.819  -1.258   2.191
  370   3HG1  VAL  55          3HG1      VAL  55   6.681  -0.816   3.461
  371   1HG2  VAL  55          1HG2      VAL  55   5.350  -1.470  -0.513
  372   2HG2  VAL  55          2HG2      VAL  55   7.023  -1.807  -0.065
  373   3HG2  VAL  55          3HG2      VAL  55   6.462  -0.140  -0.181
  374    H    GLN  56           H        GLN  56   3.001  -3.341   2.343
  375    HA   GLN  56           HA       GLN  56   1.581  -3.782   4.023
  376   1HB   GLN  56          2HB       GLN  56   3.481  -5.341   4.538
  377   2HB   GLN  56          1HB       GLN  56   4.050  -4.162   5.709
  378   1HG   GLN  56          2HG       GLN  56   2.814  -5.910   6.809
  379   2HG   GLN  56          1HG       GLN  56   1.955  -4.379   6.945
  380   1HE2  GLN  56          1HE2      GLN  56   1.990  -6.256   4.011
  381   2HE2  GLN  56          2HE2      GLN  56   0.334  -6.741   4.068
  382    H    PHE  57           H        PHE  57   1.737  -1.107   3.680
  383    HA   PHE  57           HA       PHE  57   1.607  -0.213   6.465
  384   1HB   PHE  57          2HB       PHE  57   2.034   2.083   5.729
  385   2HB   PHE  57          1HB       PHE  57   3.357   0.987   5.393
  386    HD1  PHE  57           1HD      PHE  57   3.360   0.003   2.917
  387    HD2  PHE  57           2HD      PHE  57   1.392   3.576   4.141
  388    HE1  PHE  57           1HE      PHE  57   3.469   0.847   0.613
  389    HE2  PHE  57           2HE      PHE  57   1.489   4.422   1.835
  390    HZ   PHE  57           HZ       PHE  57   2.538   3.064   0.065
  391    H    ASP  58           H        ASP  58   0.077   1.724   6.724
  392    HA   ASP  58           HA       ASP  58  -2.376   0.301   6.383
  393   1HB   ASP  58          2HB       ASP  58  -3.306   1.968   7.922
  394   2HB   ASP  58          1HB       ASP  58  -1.822   1.248   8.536
  395    H    GLN  59           H        GLN  59  -4.376   1.247   5.885
  396    HA   GLN  59           HA       GLN  59  -4.577   2.352   3.363
  397   1HB   GLN  59          2HB       GLN  59  -6.312   1.059   4.495
  398   2HB   GLN  59          1HB       GLN  59  -6.521   2.345   5.674
  399   1HG   GLN  59          2HG       GLN  59  -8.276   2.669   4.222
  400   2HG   GLN  59          1HG       GLN  59  -7.073   3.827   3.665
  401   1HE2  GLN  59          1HE2      GLN  59  -5.893   3.338   1.752
  402   2HE2  GLN  59          2HE2      GLN  59  -6.529   2.234   0.565
  403    H    GLY  60           H        GLY  60  -4.593   3.871   6.517
  404   1HA   GLY  60          2HA       GLY  60  -5.573   6.402   5.691
  405   2HA   GLY  60          1HA       GLY  60  -4.743   6.065   7.202
  406    H    THR  61           H        THR  61  -2.292   5.319   6.491
  407    HA   THR  61           HA       THR  61  -0.930   7.647   5.750
  408    HB   THR  61           HB       THR  61  -0.058   4.789   5.689
  409    HG1  THR  61           1HG      THR  61  -0.189   5.059   7.776
  410   1HG2  THR  61          1HG2      THR  61   1.419   6.165   4.314
  411   2HG2  THR  61          2HG2      THR  61   2.235   5.626   5.782
  412   3HG2  THR  61          3HG2      THR  61   1.632   7.280   5.664
  413    H    TRP  62           H        TRP  62  -1.754   4.764   3.906
  414    HA   TRP  62           HA       TRP  62  -0.582   5.403   1.466
  415   1HB   TRP  62          2HB       TRP  62  -1.556   3.221   2.014
  416   2HB   TRP  62          1HB       TRP  62  -3.153   3.952   2.099
  417    HD1  TRP  62           HD       TRP  62  -4.379   4.499  -0.162
  418    HE1  TRP  62           1HE      TRP  62  -4.005   3.688  -2.571
  419    HE3  TRP  62           3HE      TRP  62   0.295   2.562   0.375
  420    HZ2  TRP  62           2HZ      TRP  62  -1.967   2.371  -4.073
  421    HZ3  TRP  62           3HZ      TRP  62   1.406   1.548  -1.563
  422    HH2  TRP  62           HH       TRP  62   0.310   1.451  -3.743
  423    H    GLU  63           H        GLU  63  -3.795   6.107   2.738
  424    HA   GLU  63           HA       GLU  63  -4.752   7.432   0.435
  425   1HB   GLU  63          2HB       GLU  63  -6.246   6.449   2.067
  426   2HB   GLU  63          1HB       GLU  63  -5.647   7.520   3.322
  427   1HG   GLU  63          2HG       GLU  63  -6.538   9.442   2.015
  428   2HG   GLU  63          1HG       GLU  63  -7.257   8.281   0.900
  429    H    ALA  64           H        ALA  64  -3.065   8.469   3.323
  430    HA   ALA  64           HA       ALA  64  -3.597  11.246   3.094
  431   1HB   ALA  64          1HB       ALA  64  -1.815  11.540   4.726
  432   2HB   ALA  64          2HB       ALA  64  -1.292   9.873   4.474
  433   3HB   ALA  64          3HB       ALA  64  -2.872  10.206   5.186
  434    H    ASN  65           H        ASN  65  -0.868   9.235   2.029
  435    HA   ASN  65           HA       ASN  65   0.452  11.430   0.752
  436   1HB   ASN  65          2HB       ASN  65   0.882   8.468   0.308
  437   2HB   ASN  65          1HB       ASN  65   2.007   9.769  -0.076
  438   1HD2  ASN  65          1HD2      ASN  65   1.413  11.226   2.410
  439   2HD2  ASN  65          2HD2      ASN  65   2.192  10.332   3.675
  440    H    GLY  66           H        GLY  66  -2.239   9.569   0.008
  441   1HA   GLY  66          2HA       GLY  66  -3.712  10.078  -1.740
  442   2HA   GLY  66          1HA       GLY  66  -2.397  10.877  -2.590
  443    H    GLY  67           H        GLY  67  -2.761   7.572  -1.309
  444   1HA   GLY  67          2HA       GLY  67  -1.348   6.570  -3.606
  445   2HA   GLY  67          1HA       GLY  67  -1.918   5.636  -2.231
  446    H    LEU  68           H        LEU  68  -4.643   6.995  -2.774
  447    HA   LEU  68           HA       LEU  68  -5.748   4.736  -3.916
  448   1HB   LEU  68          2HB       LEU  68  -6.885   7.458  -3.433
  449   2HB   LEU  68          1HB       LEU  68  -7.848   6.142  -4.074
  450    HG   LEU  68           HG       LEU  68  -7.076   4.861  -1.966
  451   1HD1  LEU  68          1HD1      LEU  68  -6.679   6.323  -0.033
  452   2HD1  LEU  68          2HD1      LEU  68  -6.547   7.695  -1.131
  453   3HD1  LEU  68          3HD1      LEU  68  -5.380   6.378  -1.222
  454   1HD2  LEU  68          1HD2      LEU  68  -8.948   5.808  -0.676
  455   2HD2  LEU  68          2HD2      LEU  68  -9.370   5.521  -2.365
  456   3HD2  LEU  68          3HD2      LEU  68  -9.021   7.158  -1.810
  457    H    ARG  69           H        ARG  69  -4.575   7.622  -5.397
  458    HA   ARG  69           HA       ARG  69  -5.892   7.313  -7.886
  459   1HB   ARG  69          2HB       ARG  69  -4.326   8.918  -8.748
  460   2HB   ARG  69          1HB       ARG  69  -4.818   9.426  -7.139
  461   1HG   ARG  69          2HG       ARG  69  -2.753   9.243  -6.312
  462   2HG   ARG  69          1HG       ARG  69  -2.426   7.748  -7.199
  463   1HD   ARG  69          2HD       ARG  69  -2.343  10.557  -8.308
  464   2HD   ARG  69          1HD       ARG  69  -0.953   9.527  -7.967
  465    HE   ARG  69           HE       ARG  69  -2.862   8.387  -9.812
  466   1HH1  ARG  69          1HH1      ARG  69   0.010  10.380  -9.509
  467   2HH1  ARG  69          2HH1      ARG  69   0.520  10.080 -11.141
  468   1HH2  ARG  69          1HH2      ARG  69  -2.199   8.018 -11.949
  469   2HH2  ARG  69          2HH2      ARG  69  -0.733   8.751 -12.540
  470    H    TYR  70           H        TYR  70  -3.035   5.963  -6.425
  471    HA   TYR  70           HA       TYR  70  -2.017   4.766  -8.851
  472   1HB   TYR  70          2HB       TYR  70  -1.441   4.189  -5.929
  473   2HB   TYR  70          1HB       TYR  70  -0.470   3.644  -7.287
  474    HD1  TYR  70           1HD      TYR  70   1.138   5.120  -8.324
  475    HD2  TYR  70           2HD      TYR  70  -1.438   6.525  -5.250
  476    HE1  TYR  70           1HE      TYR  70   2.534   7.133  -8.083
  477    HE2  TYR  70           2HE      TYR  70  -0.061   8.540  -5.009
  478    HH   TYR  70           HH       TYR  70   2.231   9.278  -5.458
  479    H    ALA  71           H        ALA  71  -3.982   4.134  -6.142
  480    HA   ALA  71           HA       ALA  71  -5.741   2.283  -6.991
  481   1HB   ALA  71          1HB       ALA  71  -3.936   0.707  -7.511
  482   2HB   ALA  71          2HB       ALA  71  -4.904   0.111  -6.161
  483   3HB   ALA  71          3HB       ALA  71  -3.329   0.844  -5.861
  484    HA   PRO  72           HA       PRO  72  -6.896   3.753  -2.978
  485   1HB   PRO  72          2HB       PRO  72  -8.897   1.659  -2.950
  486   2HB   PRO  72          1HB       PRO  72  -9.085   3.403  -2.907
  487   1HG   PRO  72          2HG       PRO  72  -9.651   1.832  -5.083
  488   2HG   PRO  72          1HG       PRO  72  -9.284   3.564  -5.153
  489   1HD   PRO  72          2HD       PRO  72  -7.659   1.271  -5.978
  490   2HD   PRO  72          1HD       PRO  72  -7.527   2.982  -6.431
  491    H    ARG  73           H        ARG  73  -5.560   0.766  -3.576
  492    HA   ARG  73           HA       ARG  73  -4.933   0.441  -0.765
  493   1HB   ARG  73          2HB       ARG  73  -5.639  -1.876  -0.637
  494   2HB   ARG  73          1HB       ARG  73  -7.020  -0.877  -1.078
  495   1HG   ARG  73          2HG       ARG  73  -6.459  -1.472  -3.482
  496   2HG   ARG  73          1HG       ARG  73  -5.412  -2.716  -2.798
  497   1HD   ARG  73          2HD       ARG  73  -8.381  -2.434  -2.323
  498   2HD   ARG  73          1HD       ARG  73  -7.613  -3.603  -3.395
  499    HE   ARG  73           HE       ARG  73  -6.428  -4.258  -1.146
  500   1HH1  ARG  73          1HH1      ARG  73  -9.780  -3.438  -1.723
  501   2HH1  ARG  73          2HH1      ARG  73 -10.387  -4.426  -0.424
  502   1HH2  ARG  73          1HH2      ARG  73  -7.214  -5.568   0.559
  503   2HH2  ARG  73          2HH2      ARG  73  -8.919  -5.618   0.902
  504    H    ALA  74           H        ALA  74  -2.995  -0.541  -0.464
  505    HA   ALA  74           HA       ALA  74  -1.115  -0.416  -2.524
  506   1HB   ALA  74          1HB       ALA  74  -0.717  -0.137  -0.051
  507   2HB   ALA  74          2HB       ALA  74   0.490  -1.069  -0.936
  508   3HB   ALA  74          3HB       ALA  74  -0.711  -1.899   0.051
  509    H    ASP  75           H        ASP  75  -3.134  -3.064  -1.546
  510    HA   ASP  75           HA       ASP  75  -1.386  -5.004  -2.809
  511   1HB   ASP  75          2HB       ASP  75  -2.991  -6.701  -2.127
  512   2HB   ASP  75          1HB       ASP  75  -2.564  -5.676  -0.771
  513    H    LEU  76           H        LEU  76  -3.402  -2.777  -3.924
  514    HA   LEU  76           HA       LEU  76  -4.266  -4.415  -6.206
  515   1HB   LEU  76          2HB       LEU  76  -6.012  -3.075  -5.061
  516   2HB   LEU  76          1HB       LEU  76  -5.096  -1.620  -5.410
  517    HG   LEU  76           HG       LEU  76  -5.400  -2.041  -7.836
  518   1HD1  LEU  76          1HD1      LEU  76  -5.685  -4.456  -7.752
  519   2HD1  LEU  76          2HD1      LEU  76  -7.052  -3.687  -8.557
  520   3HD1  LEU  76          3HD1      LEU  76  -7.214  -4.256  -6.896
  521   1HD2  LEU  76          1HD2      LEU  76  -6.895  -0.544  -6.609
  522   2HD2  LEU  76          2HD2      LEU  76  -7.950  -1.904  -6.231
  523   3HD2  LEU  76          3HD2      LEU  76  -7.747  -1.384  -7.905
  524    H    ALA  77           H        ALA  77  -2.461  -1.604  -5.191
  525    HA   ALA  77           HA       ALA  77  -1.452  -0.965  -7.796
  526   1HB   ALA  77          1HB       ALA  77  -0.519  -0.090  -5.061
  527   2HB   ALA  77          2HB       ALA  77  -1.725   0.741  -6.043
  528   3HB   ALA  77          3HB       ALA  77  -0.055   0.635  -6.600
  529    H    THR  78           H        THR  78   0.834  -1.087  -8.315
  530    HA   THR  78           HA       THR  78   1.991  -3.568  -7.279
  531    HB   THR  78           HB       THR  78   3.240  -3.744  -9.306
  532    HG1  THR  78           1HG      THR  78   2.442  -1.040  -9.694
  533   1HG2  THR  78          1HG2      THR  78   0.430  -2.802  -9.875
  534   2HG2  THR  78          2HG2      THR  78   0.931  -4.451  -9.489
  535   3HG2  THR  78          3HG2      THR  78   1.438  -3.708 -11.009
  536    H    ARG  79           H        ARG  79   4.588  -3.290  -7.861
  537    HA   ARG  79           HA       ARG  79   5.713  -2.008  -5.727
  538   1HB   ARG  79          2HB       ARG  79   6.937  -2.542  -8.434
  539   2HB   ARG  79          1HB       ARG  79   7.854  -2.043  -7.015
  540   1HG   ARG  79          2HG       ARG  79   6.888  -4.067  -5.855
  541   2HG   ARG  79          1HG       ARG  79   6.342  -4.588  -7.451
  542   1HD   ARG  79          2HD       ARG  79   8.485  -4.907  -8.224
  543   2HD   ARG  79          1HD       ARG  79   9.187  -3.804  -7.042
  544    HE   ARG  79           HE       ARG  79   8.907  -5.503  -5.371
  545   1HH1  ARG  79          1HH1      ARG  79   8.355  -6.548  -8.679
  546   2HH1  ARG  79          2HH1      ARG  79   8.736  -8.214  -8.349
  547   1HH2  ARG  79          1HH2      ARG  79   9.436  -7.696  -4.956
  548   2HH2  ARG  79          2HH2      ARG  79   9.343  -8.865  -6.246
  549    H    GLU  80           H        GLU  80   5.475  -0.715  -9.024
  550    HA   GLU  80           HA       GLU  80   6.889   1.629  -8.527
  551   1HB   GLU  80          2HB       GLU  80   5.986   2.495 -10.594
  552   2HB   GLU  80          1HB       GLU  80   6.396   0.797 -10.776
  553   1HG   GLU  80          2HG       GLU  80   4.016   0.228 -10.483
  554   2HG   GLU  80          1HG       GLU  80   3.643   1.950 -10.425
  555    H    GLU  81           H        GLU  81   3.307   1.190  -8.408
  556    HA   GLU  81           HA       GLU  81   2.757   3.825  -7.585
  557   1HB   GLU  81          2HB       GLU  81   1.274   1.262  -7.047
  558   2HB   GLU  81          1HB       GLU  81   0.640   2.863  -6.724
  559   1HG   GLU  81          2HG       GLU  81  -0.340   2.319  -8.704
  560   2HG   GLU  81          1HG       GLU  81   1.034   3.275  -9.236
  561    H    GLN  82           H        GLN  82   3.171   0.833  -5.733
  562    HA   GLN  82           HA       GLN  82   2.526   1.988  -3.252
  563   1HB   GLN  82          2HB       GLN  82   2.266  -0.357  -3.556
  564   2HB   GLN  82          1HB       GLN  82   3.953  -0.554  -4.005
  565   1HG   GLN  82          2HG       GLN  82   4.679  -0.474  -1.866
  566   2HG   GLN  82          1HG       GLN  82   3.359   0.566  -1.339
  567   1HE2  GLN  82          1HE2      GLN  82   2.743  -2.315  -3.203
  568   2HE2  GLN  82          2HE2      GLN  82   2.023  -3.216  -1.900
  569    H    ILE  83           H        ILE  83   5.568   1.536  -4.935
  570    HA   ILE  83           HA       ILE  83   7.310   2.339  -2.883
  571    HB   ILE  83           HB       ILE  83   7.477   2.380  -5.881
  572   1HG1  ILE  83          2HG1      ILE  83   9.521   1.166  -4.076
  573   2HG1  ILE  83          1HG1      ILE  83   7.960   0.363  -4.206
  574   1HG2  ILE  83          1HG2      ILE  83   9.770   3.241  -5.745
  575   2HG2  ILE  83          2HG2      ILE  83   9.540   3.548  -4.024
  576   3HG2  ILE  83          3HG2      ILE  83   8.578   4.425  -5.213
  577   1HD1  ILE  83          1HD1      ILE  83   9.825   1.011  -6.481
  578   2HD1  ILE  83          2HD1      ILE  83   8.262   0.207  -6.627
  579   3HD1  ILE  83          3HD1      ILE  83   9.578  -0.577  -5.752
  580    H    ALA  84           H        ALA  84   5.538   4.164  -5.359
  581    HA   ALA  84           HA       ALA  84   6.677   6.676  -4.828
  582   1HB   ALA  84          1HB       ALA  84   4.780   7.587  -6.065
  583   2HB   ALA  84          2HB       ALA  84   3.951   6.034  -5.946
  584   3HB   ALA  84          3HB       ALA  84   5.445   6.168  -6.873
  585    H    VAL  85           H        VAL  85   3.664   5.206  -3.651
  586    HA   VAL  85           HA       VAL  85   2.850   7.370  -2.041
  587    HB   VAL  85           HB       VAL  85   2.261   4.442  -1.656
  588   1HG1  VAL  85          1HG1      VAL  85   0.207   5.232  -0.570
  589   2HG1  VAL  85          2HG1      VAL  85   0.737   6.899  -0.789
  590   3HG1  VAL  85          3HG1      VAL  85   1.644   5.818   0.269
  591   1HG2  VAL  85          1HG2      VAL  85   0.833   6.511  -3.313
  592   2HG2  VAL  85          2HG2      VAL  85   0.248   4.878  -3.002
  593   3HG2  VAL  85          3HG2      VAL  85   1.736   5.123  -3.918
  594    H    ALA  86           H        ALA  86   4.525   4.329  -1.122
  595    HA   ALA  86           HA       ALA  86   4.798   4.943   1.599
  596   1HB   ALA  86          1HB       ALA  86   6.522   3.152  -0.116
  597   2HB   ALA  86          2HB       ALA  86   5.032   2.676   0.701
  598   3HB   ALA  86          3HB       ALA  86   6.447   3.143   1.646
  599    H    GLU  87           H        GLU  87   6.656   5.761  -1.218
  600    HA   GLU  87           HA       GLU  87   8.942   6.580   0.283
  601   1HB   GLU  87          2HB       GLU  87  10.030   6.938  -1.658
  602   2HB   GLU  87          1HB       GLU  87   8.770   5.867  -2.235
  603   1HG   GLU  87          2HG       GLU  87   8.617   7.376  -3.829
  604   2HG   GLU  87          1HG       GLU  87   7.587   8.221  -2.672
  605    H    VAL  88           H        VAL  88   6.016   8.218  -0.726
  606    HA   VAL  88           HA       VAL  88   6.805  10.826   0.010
  607    HB   VAL  88           HB       VAL  88   4.074   9.538   0.404
  608   1HG1  VAL  88          1HG1      VAL  88   4.865  12.454   0.438
  609   2HG1  VAL  88          2HG1      VAL  88   4.462  11.486   1.861
  610   3HG1  VAL  88          3HG1      VAL  88   3.234  11.806   0.628
  611   1HG2  VAL  88          1HG2      VAL  88   3.465  10.749  -1.647
  612   2HG2  VAL  88          2HG2      VAL  88   4.762   9.593  -1.945
  613   3HG2  VAL  88          3HG2      VAL  88   5.127  11.311  -1.809
  614    H    THR  89           H        THR  89   5.553   8.091   1.848
  615    HA   THR  89           HA       THR  89   5.495   9.403   4.345
  616    HB   THR  89           HB       THR  89   6.018   6.525   4.444
  617    HG1  THR  89           1HG      THR  89   3.713   7.483   3.034
  618   1HG2  THR  89          1HG2      THR  89   3.671   8.216   5.271
  619   2HG2  THR  89          2HG2      THR  89   5.103   7.921   6.254
  620   3HG2  THR  89          3HG2      THR  89   4.039   6.580   5.822
  621    H    ARG  90           H        ARG  90   7.925   7.391   2.742
  622    HA   ARG  90           HA       ARG  90   9.660   7.086   4.919
  623   1HB   ARG  90          2HB       ARG  90  11.275   6.296   3.396
  624   2HB   ARG  90          1HB       ARG  90   9.737   5.874   2.659
  625   1HG   ARG  90          2HG       ARG  90   9.880   7.681   1.122
  626   2HG   ARG  90          1HG       ARG  90  11.280   8.347   1.951
  627   1HD   ARG  90          2HD       ARG  90  12.610   6.430   1.308
  628   2HD   ARG  90          1HD       ARG  90  11.203   5.694   0.540
  629    HE   ARG  90           HE       ARG  90  11.336   8.001  -0.791
  630   1HH1  ARG  90          1HH1      ARG  90  13.870   5.749   0.080
  631   2HH1  ARG  90          2HH1      ARG  90  14.828   6.068  -1.334
  632   1HH2  ARG  90          1HH2      ARG  90  12.599   8.461  -2.621
  633   2HH2  ARG  90          2HH2      ARG  90  14.126   7.658  -2.851
  634    H    LEU  91           H        LEU  91   9.237   9.713   2.669
  635    HA   LEU  91           HA       LEU  91  11.842  10.819   3.166
  636   1HB   LEU  91          2HB       LEU  91  11.177  12.687   1.753
  637   2HB   LEU  91          1HB       LEU  91  10.862  11.148   0.987
  638    HG   LEU  91           HG       LEU  91   8.417  11.517   1.833
  639   1HD1  LEU  91          1HD1      LEU  91   8.848  13.450   3.233
  640   2HD1  LEU  91          2HD1      LEU  91   7.787  13.893   1.894
  641   3HD1  LEU  91          3HD1      LEU  91   9.494  14.335   1.851
  642   1HD2  LEU  91          1HD2      LEU  91   9.569  13.168  -0.410
  643   2HD2  LEU  91          2HD2      LEU  91   7.889  12.663  -0.233
  644   3HD2  LEU  91          3HD2      LEU  91   9.148  11.458  -0.508
  645    H    ARG  92           H        ARG  92   8.765  11.105   4.630
  646    HA   ARG  92           HA       ARG  92   9.268  13.658   5.859
  647   1HB   ARG  92          2HB       ARG  92   7.180  11.730   6.776
  648   2HB   ARG  92          1HB       ARG  92   7.142  13.485   6.797
  649   1HG   ARG  92          2HG       ARG  92   6.574  13.632   4.566
  650   2HG   ARG  92          1HG       ARG  92   7.194  12.017   4.204
  651   1HD   ARG  92          2HD       ARG  92   4.622  12.817   5.480
  652   2HD   ARG  92          1HD       ARG  92   4.932  11.626   4.209
  653    HE   ARG  92           HE       ARG  92   6.173  10.473   6.213
  654   1HH1  ARG  92          1HH1      ARG  92   3.018  12.009   6.144
  655   2HH1  ARG  92          2HH1      ARG  92   2.411  11.116   7.510
  656   1HH2  ARG  92          1HH2      ARG  92   5.336   9.269   8.016
  657   2HH2  ARG  92          2HH2      ARG  92   3.710   9.550   8.541
  658    H    GLN  93           H        GLN  93   9.218  10.267   6.749
  659    HA   GLN  93           HA       GLN  93   9.953  11.026   9.467
  660   1HB   GLN  93          2HB       GLN  93   9.034   8.914  10.169
  661   2HB   GLN  93          1HB       GLN  93   7.887   9.734   9.110
  662   1HG   GLN  93          2HG       GLN  93   9.137   8.290   7.275
  663   2HG   GLN  93          1HG       GLN  93   9.430   7.251   8.670
  664   1HE2  GLN  93          1HE2      GLN  93   7.804   6.765   6.327
  665   2HE2  GLN  93          2HE2      GLN  93   6.208   6.449   6.921
  666    H    GLY  94           H        GLY  94  11.126   9.096   6.770
  667   1HA   GLY  94          2HA       GLY  94  13.406   8.636   6.404
  668   2HA   GLY  94          1HA       GLY  94  13.726   9.002   8.095
  669    H    TRP  95           H        TRP  95  11.383   6.772   6.680
  670    HA   TRP  95           HA       TRP  95  11.099   4.539   6.792
  671   1HB   TRP  95          2HB       TRP  95  14.000   4.295   7.596
  672   2HB   TRP  95          1HB       TRP  95  12.993   3.060   6.835
  673    HD1  TRP  95           HD       TRP  95  14.826   6.318   6.028
  674    HE1  TRP  95           1HE      TRP  95  15.199   6.441   3.493
  675    HE3  TRP  95           3HE      TRP  95  12.105   2.235   4.658
  676    HZ2  TRP  95           2HZ      TRP  95  14.396   4.990   1.199
  677    HZ3  TRP  95           3HZ      TRP  95  11.943   1.673   2.272
  678    HH2  TRP  95           HH       TRP  95  13.066   3.021   0.581
  679    H    GLY  96           H        GLY  96  11.315   6.473   9.198
  680   1HA   GLY  96          2HA       GLY  96  11.741   4.915  11.497
  681   2HA   GLY  96          1HA       GLY  96  10.784   6.386  11.428
  682    H    ALA  97           H        ALA  97   8.884   5.273   9.471
  683    HA   ALA  97           HA       ALA  97   7.134   3.958  11.328
  684   1HB   ALA  97          1HB       ALA  97   5.517   3.933   9.501
  685   2HB   ALA  97          2HB       ALA  97   6.773   4.454   8.375
  686   3HB   ALA  97          3HB       ALA  97   6.252   5.526   9.674
  687    H    TRP  98           H        TRP  98   9.402   2.998   8.968
  688    HA   TRP  98           HA       TRP  98   8.363   0.268   8.918
  689   1HB   TRP  98          2HB       TRP  98  10.416   1.697   7.226
  690   2HB   TRP  98          1HB       TRP  98  10.116  -0.037   7.123
  691    HD1  TRP  98           HD       TRP  98   7.703  -0.809   6.202
  692    HE1  TRP  98           1HE      TRP  98   6.049   0.356   4.608
  693    HE3  TRP  98           3HE      TRP  98   9.503   3.986   6.528
  694    HZ2  TRP  98           2HZ      TRP  98   5.573   2.980   3.607
  695    HZ3  TRP  98           3HZ      TRP  98   8.398   5.737   5.233
  696    HH2  TRP  98           HH       TRP  98   6.476   5.249   3.811
  697    HA   PRO  99           HA       PRO  99  11.135  -0.275  12.342
  698   1HB   PRO  99          2HB       PRO  99  10.197  -3.078  11.988
  699   2HB   PRO  99          1HB       PRO  99  10.196  -2.068  13.439
  700   1HG   PRO  99          2HG       PRO  99   7.928  -2.498  12.182
  701   2HG   PRO  99          1HG       PRO  99   8.326  -0.857  12.742
  702   1HD   PRO  99          2HD       PRO  99   8.583  -2.010   9.977
  703   2HD   PRO  99          1HD       PRO  99   7.871  -0.458  10.484
  704    H    VAL 100           H        VAL 100  11.979  -3.191  12.477
  705    HA   VAL 100           HA       VAL 100  14.592  -2.926  11.616
  706    HB   VAL 100           HB       VAL 100  14.629  -5.472  11.656
  707   1HG1  VAL 100          1HG1      VAL 100  13.638  -3.975  14.080
  708   2HG1  VAL 100          2HG1      VAL 100  15.314  -4.100  13.548
  709   3HG1  VAL 100          3HG1      VAL 100  14.460  -5.537  14.105
  710   1HG2  VAL 100          1HG2      VAL 100  12.287  -5.872  11.149
  711   2HG2  VAL 100          2HG2      VAL 100  11.808  -5.048  12.633
  712   3HG2  VAL 100          3HG2      VAL 100  12.706  -6.565  12.716
  713    H    CYS 101           H        CYS 101  11.817  -3.911   9.836
  714    HA   CYS 101           HA       CYS 101  12.939  -5.220   7.667
  715   1HB   CYS 101          2HB       CYS 101  10.589  -3.316   7.644
  716   2HB   CYS 101          1HB       CYS 101  10.944  -4.538   6.425
  717    H    ALA 102           H        ALA 102  12.631  -1.737   8.272
  718    HA   ALA 102           HA       ALA 102  13.561  -0.960   5.688
  719   1HB   ALA 102          1HB       ALA 102  13.511   0.627   8.250
  720   2HB   ALA 102          2HB       ALA 102  12.204   0.530   7.070
  721   3HB   ALA 102          3HB       ALA 102  13.739   1.280   6.627
  722    H    ALA 103           H        ALA 103  15.069  -1.288   8.862
  723    HA   ALA 103           HA       ALA 103  17.619  -0.356   8.178
  724   1HB   ALA 103          1HB       ALA 103  16.874  -0.671  10.490
  725   2HB   ALA 103          2HB       ALA 103  18.394  -1.510  10.179
  726   3HB   ALA 103          3HB       ALA 103  16.885  -2.418  10.252
  727    H    ARG 104           H        ARG 104  16.253  -3.610   8.143
  728    HA   ARG 104           HA       ARG 104  18.559  -4.916   7.164
  729   1HB   ARG 104          2HB       ARG 104  15.689  -5.581   7.478
  730   2HB   ARG 104          1HB       ARG 104  16.573  -6.513   6.280
  731   1HG   ARG 104          2HG       ARG 104  16.701  -7.786   8.217
  732   2HG   ARG 104          1HG       ARG 104  18.261  -6.977   8.130
  733   1HD   ARG 104          2HD       ARG 104  16.001  -5.818   9.718
  734   2HD   ARG 104          1HD       ARG 104  17.021  -7.089  10.388
  735    HE   ARG 104           HE       ARG 104  18.533  -4.894   9.336
  736   1HH1  ARG 104          1HH1      ARG 104  16.815  -6.106  12.155
  737   2HH1  ARG 104          2HH1      ARG 104  17.653  -5.054  13.263
  738   1HH2  ARG 104          1HH2      ARG 104  19.622  -3.510  10.820
  739   2HH2  ARG 104          2HH2      ARG 104  19.235  -3.618  12.514
  740    H    ALA 105           H        ALA 105  15.926  -3.208   5.587
  741    HA   ALA 105           HA       ALA 105  16.414  -4.283   2.967
  742   1HB   ALA 105          1HB       ALA 105  14.875  -1.830   3.781
  743   2HB   ALA 105          2HB       ALA 105  14.224  -3.467   3.700
  744   3HB   ALA 105          3HB       ALA 105  14.784  -2.668   2.231
  745    H    GLY 106           H        GLY 106  17.630  -1.578   4.793
  746   1HA   GLY 106          2HA       GLY 106  19.685  -0.504   4.022
  747   2HA   GLY 106          1HA       GLY 106  19.059  -0.639   2.383
  748    H    ALA 107           H        ALA 107  17.972   0.681   5.494
  749    HA   ALA 107           HA       ALA 107  16.376   2.714   4.338
  750   1HB   ALA 107          1HB       ALA 107  16.081   3.509   6.612
  751   2HB   ALA 107          2HB       ALA 107  17.418   2.496   7.161
  752   3HB   ALA 107          3HB       ALA 107  15.934   1.753   6.562
  753    H    ARG 108           H        ARG 108  16.707   4.964   4.347
  754    HA   ARG 108           HA       ARG 108  19.104   6.195   5.085
  755   1HB   ARG 108          2HB       ARG 108  19.810   6.715   2.619
  756   2HB   ARG 108          1HB       ARG 108  20.363   5.253   3.410
  757   1HG   ARG 108          2HG       ARG 108  19.763   4.557   1.278
  758   2HG   ARG 108          1HG       ARG 108  18.391   4.087   2.286
  759   1HD   ARG 108          2HD       ARG 108  17.776   5.110   0.087
  760   2HD   ARG 108          1HD       ARG 108  17.092   5.933   1.487
  761    HE   ARG 108           HE       ARG 108  19.356   7.334   1.023
  762   1HH1  ARG 108          1HH1      ARG 108  16.889   6.262  -1.218
  763   2HH1  ARG 108          2HH1      ARG 108  16.896   7.741  -2.129
  764   1HH2  ARG 108          1HH2      ARG 108  19.369   9.278  -0.170
  765   2HH2  ARG 108          2HH2      ARG 108  18.283   9.472  -1.515
  Start of MODEL   28
    1   1H    ASN   1          1HT       ASN   1  12.638  17.927  35.761
    2   2H    ASN   1          2HT       ASN   1  11.966  19.129  34.769
    3   3H    ASN   1          3HT       ASN   1  13.453  18.424  34.359
    4    HA   ASN   1           HA       ASN   1  10.851  17.018  34.459
    5   1HB   ASN   1          2HB       ASN   1  12.534  18.021  32.159
    6   2HB   ASN   1          1HB       ASN   1  11.293  16.786  31.963
    7   1HD2  ASN   1          1HD2      ASN   1  11.518  19.520  30.879
    8   2HD2  ASN   1          2HD2      ASN   1  10.061  20.328  31.369
    9    H    VAL   2           H        VAL   2  11.172  15.012  35.102
   10    HA   VAL   2           HA       VAL   2  13.742  13.759  34.922
   11    HB   VAL   2           HB       VAL   2  12.280  13.262  36.808
   12   1HG1  VAL   2          1HG1      VAL   2  10.443  11.994  34.784
   13   2HG1  VAL   2          2HG1      VAL   2  10.108  13.421  35.769
   14   3HG1  VAL   2          3HG1      VAL   2  10.290  11.842  36.535
   15   1HG2  VAL   2          1HG2      VAL   2  12.451  10.802  36.774
   16   2HG2  VAL   2          2HG2      VAL   2  13.919  11.601  36.211
   17   3HG2  VAL   2          3HG2      VAL   2  12.811  10.876  35.049
   18    H    VAL   3           H        VAL   3  10.634  13.344  33.258
   19    HA   VAL   3           HA       VAL   3  11.646  11.423  31.459
   20    HB   VAL   3           HB       VAL   3   9.294  11.442  31.994
   21   1HG1  VAL   3          1HG1      VAL   3   8.960  13.801  32.398
   22   2HG1  VAL   3          2HG1      VAL   3   7.790  13.211  31.218
   23   3HG1  VAL   3          3HG1      VAL   3   9.184  14.150  30.683
   24   1HG2  VAL   3          1HG2      VAL   3   9.801  12.149  29.109
   25   2HG2  VAL   3          2HG2      VAL   3   8.342  11.372  29.722
   26   3HG2  VAL   3          3HG2      VAL   3   9.895  10.544  29.834
   27    H    VAL   4           H        VAL   4  13.042  11.843  29.896
   28    HA   VAL   4           HA       VAL   4  13.231  14.567  28.825
   29    HB   VAL   4           HB       VAL   4  15.096  12.278  28.230
   30   1HG1  VAL   4          1HG1      VAL   4  16.702  14.056  27.750
   31   2HG1  VAL   4          2HG1      VAL   4  15.471  15.264  28.121
   32   3HG1  VAL   4          3HG1      VAL   4  15.262  14.186  26.740
   33   1HG2  VAL   4          1HG2      VAL   4  15.002  12.540  30.651
   34   2HG2  VAL   4          2HG2      VAL   4  15.317  14.267  30.485
   35   3HG2  VAL   4          3HG2      VAL   4  16.552  13.096  30.020
   36    H    THR   5           H        THR   5  13.175  14.976  26.621
   37    HA   THR   5           HA       THR   5  11.466  13.224  25.099
   38    HB   THR   5           HB       THR   5  11.942  15.125  23.333
   39    HG1  THR   5           1HG      THR   5  12.238  17.108  24.821
   40   1HG2  THR   5          1HG2      THR   5   9.783  14.716  24.433
   41   2HG2  THR   5          2HG2      THR   5  10.120  16.441  24.299
   42   3HG2  THR   5          3HG2      THR   5  10.333  15.618  25.845
   43    HA   PRO   6           HA       PRO   6  15.112  11.266  23.357
   44   1HB   PRO   6          2HB       PRO   6  13.271   9.456  22.034
   45   2HB   PRO   6          1HB       PRO   6  14.393   9.121  23.352
   46   1HG   PRO   6          2HG       PRO   6  11.705   9.095  23.673
   47   2HG   PRO   6          1HG       PRO   6  12.826   9.549  24.972
   48   1HD   PRO   6          2HD       PRO   6  11.256  11.315  23.129
   49   2HD   PRO   6          1HD       PRO   6  11.476  11.445  24.889
   50    H    ALA   7           H        ALA   7  15.728  10.532  21.223
   51    HA   ALA   7           HA       ALA   7  14.901  12.515  19.239
   52   1HB   ALA   7          1HB       ALA   7  17.282  12.387  19.840
   53   2HB   ALA   7          2HB       ALA   7  16.996  12.059  18.130
   54   3HB   ALA   7          3HB       ALA   7  17.321  10.729  19.242
   55    H    HIS   8           H        HIS   8  13.326  10.202  19.800
   56    HA   HIS   8           HA       HIS   8  13.396   8.563  17.456
   57   1HB   HIS   8          2HB       HIS   8  12.293   7.927  19.647
   58   2HB   HIS   8          1HB       HIS   8  11.035   9.097  19.275
   59    HD1  HIS   8           1HD      HIS   8   9.047   8.126  18.092
   60    HD2  HIS   8           2HD      HIS   8  12.489   5.868  17.534
   61    HE1  HIS   8           1HE      HIS   8   8.350   6.083  16.774
   62    H    GLU   9           H        GLU   9  12.727  11.727  18.078
   63    HA   GLU   9           HA       GLU   9  10.568  12.278  16.320
   64   1HB   GLU   9          2HB       GLU   9  11.326  14.612  16.489
   65   2HB   GLU   9          1HB       GLU   9  11.236  13.845  18.068
   66   1HG   GLU   9          2HG       GLU   9  13.662  13.474  18.004
   67   2HG   GLU   9          1HG       GLU   9  13.733  14.314  16.456
   68    H    ALA  10           H        ALA  10  10.706  13.419  14.321
   69    HA   ALA  10           HA       ALA  10  13.166  13.088  12.804
   70   1HB   ALA  10          1HB       ALA  10  10.548  11.848  11.952
   71   2HB   ALA  10          2HB       ALA  10  12.004  10.979  12.438
   72   3HB   ALA  10          3HB       ALA  10  12.003  11.943  10.961
   73    H    VAL  11           H        VAL  11  13.039  15.365  13.097
   74    HA   VAL  11           HA       VAL  11  11.014  16.940  11.909
   75    HB   VAL  11           HB       VAL  11  13.858  17.680  12.488
   76   1HG1  VAL  11          1HG1      VAL  11  13.081  19.992  12.465
   77   2HG1  VAL  11          2HG1      VAL  11  11.460  19.443  12.042
   78   3HG1  VAL  11          3HG1      VAL  11  12.791  19.211  10.910
   79   1HG2  VAL  11          1HG2      VAL  11  12.960  18.682  14.554
   80   2HG2  VAL  11          2HG2      VAL  11  12.750  16.932  14.500
   81   3HG2  VAL  11          3HG2      VAL  11  11.380  17.995  14.168
   82    H    VAL  12           H        VAL  12  14.383  16.955  10.899
   83    HA   VAL  12           HA       VAL  12  15.254  17.316   8.831
   84    HB   VAL  12           HB       VAL  12  15.816  15.123   9.408
   85   1HG1  VAL  12          1HG1      VAL  12  14.486  13.151   8.834
   86   2HG1  VAL  12          2HG1      VAL  12  13.203  14.204   8.233
   87   3HG1  VAL  12          3HG1      VAL  12  13.632  14.225   9.944
   88   1HG2  VAL  12          1HG2      VAL  12  14.917  15.173   6.541
   89   2HG2  VAL  12          2HG2      VAL  12  16.107  14.063   7.224
   90   3HG2  VAL  12          3HG2      VAL  12  16.440  15.794   7.173
   91    H    ARG  13           H        ARG  13  14.023  18.860   7.932
   92    HA   ARG  13           HA       ARG  13  11.774  18.123   6.295
   93   1HB   ARG  13          2HB       ARG  13  12.947  20.795   6.846
   94   2HB   ARG  13          1HB       ARG  13  11.535  20.516   5.847
   95   1HG   ARG  13          2HG       ARG  13  10.434  19.463   7.801
   96   2HG   ARG  13          1HG       ARG  13  11.817  19.941   8.787
   97   1HD   ARG  13          2HD       ARG  13   9.995  21.798   7.263
   98   2HD   ARG  13          1HD       ARG  13   9.980  21.536   9.006
   99    HE   ARG  13           HE       ARG  13  12.419  22.382   8.802
  100   1HH1  ARG  13          1HH1      ARG  13   9.712  23.470   6.873
  101   2HH1  ARG  13          2HH1      ARG  13  10.331  25.083   6.669
  102   1HH2  ARG  13          1HH2      ARG  13  13.254  24.506   8.535
  103   2HH2  ARG  13          2HH2      ARG  13  12.340  25.674   7.615
  104    H    VAL  14           H        VAL  14  12.347  17.132   4.583
  105    HA   VAL  14           HA       VAL  14  14.000  18.494   2.598
  106    HB   VAL  14           HB       VAL  14  13.971  15.512   2.923
  107   1HG1  VAL  14          1HG1      VAL  14  16.087  15.635   1.632
  108   2HG1  VAL  14          2HG1      VAL  14  15.837  17.372   1.461
  109   3HG1  VAL  14          3HG1      VAL  14  14.687  16.239   0.750
  110   1HG2  VAL  14          1HG2      VAL  14  16.148  15.632   4.037
  111   2HG2  VAL  14          2HG2      VAL  14  14.881  16.408   4.989
  112   3HG2  VAL  14          3HG2      VAL  14  16.024  17.390   4.073
  113    H    GLY  15           H        GLY  15  13.535  17.630   0.438
  114   1HA   GLY  15          2HA       GLY  15  11.857  16.023  -0.649
  115   2HA   GLY  15          1HA       GLY  15  10.682  17.083   0.117
  116    H    THR  16           H        THR  16  13.496  17.140  -1.981
  117    HA   THR  16           HA       THR  16  12.597  19.591  -3.232
  118    HB   THR  16           HB       THR  16  15.144  18.043  -3.692
  119    HG1  THR  16           1HG      THR  16  16.018  19.075  -2.009
  120   1HG2  THR  16          1HG2      THR  16  14.436  20.923  -4.188
  121   2HG2  THR  16          2HG2      THR  16  14.551  19.663  -5.413
  122   3HG2  THR  16          3HG2      THR  16  15.989  20.160  -4.523
  123    H    LYS  17           H        LYS  17  12.857  16.265  -3.753
  124    HA   LYS  17           HA       LYS  17  13.190  15.820  -6.396
  125   1HB   LYS  17          2HB       LYS  17  11.151  14.335  -4.738
  126   2HB   LYS  17          1HB       LYS  17  12.063  13.723  -6.111
  127   1HG   LYS  17          2HG       LYS  17  13.200  14.496  -3.433
  128   2HG   LYS  17          1HG       LYS  17  12.929  12.855  -4.016
  129   1HD   LYS  17          2HD       LYS  17  14.739  14.852  -5.362
  130   2HD   LYS  17          1HD       LYS  17  15.292  13.648  -4.198
  131   1HE   LYS  17          2HE       LYS  17  14.392  11.873  -5.677
  132   2HE   LYS  17          1HE       LYS  17  13.966  13.112  -6.856
  133   1HZ   LYS  17          1HZ       LYS  17  16.262  13.663  -7.130
  134   2HZ   LYS  17          2HZ       LYS  17  16.100  11.986  -7.325
  135   3HZ   LYS  17          3HZ       LYS  17  16.728  12.615  -5.880
  136    HA   PRO  18           HA       PRO  18   9.604  17.814  -8.266
  137   1HB   PRO  18          2HB       PRO  18  10.980  16.988 -10.719
  138   2HB   PRO  18          1HB       PRO  18  10.528  18.609 -10.179
  139   1HG   PRO  18          2HG       PRO  18  13.081  17.832 -10.228
  140   2HG   PRO  18          1HG       PRO  18  12.453  18.882  -8.943
  141   1HD   PRO  18          2HD       PRO  18  12.923  15.914  -8.887
  142   2HD   PRO  18          1HD       PRO  18  13.377  17.136  -7.673
  143    H    GLY  19           H        GLY  19   8.066  17.146  -9.770
  144   1HA   GLY  19          2HA       GLY  19   7.862  14.235 -10.084
  145   2HA   GLY  19          1HA       GLY  19   6.530  15.152  -9.396
  146    H    THR  20           H        THR  20   8.582  16.261 -11.918
  147    HA   THR  20           HA       THR  20   6.468  16.890 -13.693
  148    HB   THR  20           HB       THR  20   9.361  16.466 -14.459
  149    HG1  THR  20           1HG      THR  20   8.304  18.235 -12.687
  150   1HG2  THR  20          1HG2      THR  20   7.211  18.294 -15.530
  151   2HG2  THR  20          2HG2      THR  20   7.831  16.843 -16.317
  152   3HG2  THR  20          3HG2      THR  20   8.882  18.241 -16.091
  153    H    GLU  21           H        GLU  21   8.983  14.386 -13.844
  154    HA   GLU  21           HA       GLU  21   7.052  12.498 -14.871
  155   1HB   GLU  21          2HB       GLU  21   9.655  13.120 -16.269
  156   2HB   GLU  21          1HB       GLU  21   8.749  11.638 -16.534
  157   1HG   GLU  21          2HG       GLU  21   6.802  13.126 -17.180
  158   2HG   GLU  21          1HG       GLU  21   7.968  14.449 -17.221
  159    H    VAL  22           H        VAL  22   7.117  11.037 -13.333
  160    HA   VAL  22           HA       VAL  22   9.581  10.608 -11.870
  161    HB   VAL  22           HB       VAL  22   7.572  11.049 -10.604
  162   1HG1  VAL  22          1HG1      VAL  22   5.715   9.451 -10.508
  163   2HG1  VAL  22          2HG1      VAL  22   6.448   8.550 -11.837
  164   3HG1  VAL  22          3HG1      VAL  22   5.889  10.204 -12.094
  165   1HG2  VAL  22          1HG2      VAL  22   9.252   9.662  -9.558
  166   2HG2  VAL  22          2HG2      VAL  22   8.540   8.215 -10.272
  167   3HG2  VAL  22          3HG2      VAL  22   7.645   9.131  -9.059
  168    HA   PRO  23           HA       PRO  23  10.382   6.950 -14.373
  169   1HB   PRO  23          2HB       PRO  23  12.684   6.828 -12.529
  170   2HB   PRO  23          1HB       PRO  23  12.658   6.841 -14.295
  171   1HG   PRO  23          2HG       PRO  23  13.443   8.975 -12.881
  172   2HG   PRO  23          1HG       PRO  23  12.560   9.137 -14.412
  173   1HD   PRO  23          2HD       PRO  23  11.592   9.437 -11.611
  174   2HD   PRO  23          1HD       PRO  23  11.160  10.358 -13.061
  175    HA   PRO  24           HA       PRO  24   9.036   3.640 -11.652
  176   1HB   PRO  24          2HB       PRO  24  10.885   1.738 -12.592
  177   2HB   PRO  24          1HB       PRO  24   9.240   1.975 -13.191
  178   1HG   PRO  24          2HG       PRO  24  11.820   3.016 -14.265
  179   2HG   PRO  24          1HG       PRO  24  10.374   2.468 -15.138
  180   1HD   PRO  24          2HD       PRO  24  10.882   5.064 -14.903
  181   2HD   PRO  24          1HD       PRO  24   9.226   4.451 -14.716
  182    H    VAL  25           H        VAL  25   9.793   2.753  -9.762
  183    HA   VAL  25           HA       VAL  25  11.805   4.497  -8.719
  184    HB   VAL  25           HB       VAL  25   9.973   2.571  -7.284
  185   1HG1  VAL  25          1HG1      VAL  25  12.002   2.982  -5.983
  186   2HG1  VAL  25          2HG1      VAL  25  10.635   3.834  -5.263
  187   3HG1  VAL  25          3HG1      VAL  25  11.822   4.720  -6.218
  188   1HG2  VAL  25          1HG2      VAL  25   9.880   5.573  -7.620
  189   2HG2  VAL  25          2HG2      VAL  25   8.754   4.598  -6.672
  190   3HG2  VAL  25          3HG2      VAL  25   8.825   4.409  -8.423
  191    H    ILE  26           H        ILE  26  13.754   4.118  -8.281
  192    HA   ILE  26           HA       ILE  26  14.939   1.514  -8.634
  193    HB   ILE  26           HB       ILE  26  16.210   4.140  -7.840
  194   1HG1  ILE  26          2HG1      ILE  26  15.124   4.252 -10.041
  195   2HG1  ILE  26          1HG1      ILE  26  16.878   4.324 -10.191
  196   1HG2  ILE  26          1HG2      ILE  26  17.470   1.593  -8.847
  197   2HG2  ILE  26          2HG2      ILE  26  17.598   2.250  -7.216
  198   3HG2  ILE  26          3HG2      ILE  26  18.315   3.117  -8.574
  199   1HD1  ILE  26          1HD1      ILE  26  16.915   1.969 -10.831
  200   2HD1  ILE  26          2HD1      ILE  26  15.900   2.924 -11.913
  201   3HD1  ILE  26          3HD1      ILE  26  15.158   1.902 -10.679
  202    H    ASP  27           H        ASP  27  13.908   3.474  -5.992
  203    HA   ASP  27           HA       ASP  27  15.582   2.167  -4.045
  204   1HB   ASP  27          2HB       ASP  27  13.323   4.127  -3.594
  205   2HB   ASP  27          1HB       ASP  27  14.498   3.598  -2.396
  206    H    GLY  28           H        GLY  28  13.023   1.371  -5.730
  207   1HA   GLY  28          2HA       GLY  28  11.231   0.245  -3.858
  208   2HA   GLY  28          1HA       GLY  28  11.371  -0.208  -5.554
  209    H    SER  29           H        SER  29  14.381  -0.458  -4.586
  210    HA   SER  29           HA       SER  29  14.280  -3.296  -4.122
  211   1HB   SER  29          2HB       SER  29  16.635  -1.423  -3.934
  212   2HB   SER  29          1HB       SER  29  16.703  -3.182  -4.040
  213    HG   SER  29           HG       SER  29  15.332  -2.651  -6.087
  214    H    ILE  30           H        ILE  30  14.980  -0.433  -2.235
  215    HA   ILE  30           HA       ILE  30  15.472  -1.718   0.259
  216    HB   ILE  30           HB       ILE  30  14.038   0.875   0.449
  217   1HG1  ILE  30          2HG1      ILE  30  15.278   1.247  -1.683
  218   2HG1  ILE  30          1HG1      ILE  30  15.863   2.262  -0.375
  219   1HG2  ILE  30          1HG2      ILE  30  15.896   1.422   1.924
  220   2HG2  ILE  30          2HG2      ILE  30  16.671  -0.104   1.498
  221   3HG2  ILE  30          3HG2      ILE  30  15.122  -0.106   2.341
  222   1HD1  ILE  30          1HD1      ILE  30  17.688   1.400  -1.714
  223   2HD1  ILE  30          2HD1      ILE  30  17.177  -0.253  -1.371
  224   3HD1  ILE  30          3HD1      ILE  30  17.769   0.778  -0.065
  225    H    TRP  31           H        TRP  31  12.736  -0.602  -1.502
  226    HA   TRP  31           HA       TRP  31  10.817  -0.916   0.561
  227   1HB   TRP  31          2HB       TRP  31  10.652  -0.458  -2.410
  228   2HB   TRP  31          1HB       TRP  31   9.222  -0.581  -1.390
  229    HD1  TRP  31           HD       TRP  31  11.108   2.041  -2.889
  230    HE1  TRP  31           1HE      TRP  31  10.984   4.243  -1.517
  231    HE3  TRP  31           3HE      TRP  31   9.480   0.132   1.500
  232    HZ2  TRP  31           2HZ      TRP  31  10.309   5.015   1.082
  233    HZ3  TRP  31           3HZ      TRP  31   9.137   1.640   3.409
  234    HH2  TRP  31           HH       TRP  31   9.547   4.033   3.202
  235    H    ASP  32           H        ASP  32  11.937  -2.895  -2.116
  236    HA   ASP  32           HA       ASP  32   9.959  -4.913  -1.800
  237   1HB   ASP  32          2HB       ASP  32  11.046  -4.666  -3.930
  238   2HB   ASP  32          1HB       ASP  32  12.640  -4.893  -3.199
  239    H    ALA  33           H        ALA  33  13.208  -4.343  -0.517
  240    HA   ALA  33           HA       ALA  33  13.465  -6.875   0.692
  241   1HB   ALA  33          1HB       ALA  33  14.739  -4.258   1.473
  242   2HB   ALA  33          2HB       ALA  33  15.388  -5.419   0.315
  243   3HB   ALA  33          3HB       ALA  33  15.250  -5.855   2.019
  244    H    ILE  34           H        ILE  34  12.101  -3.795   1.739
  245    HA   ILE  34           HA       ILE  34  11.416  -4.623   4.371
  246    HB   ILE  34           HB       ILE  34  10.142  -2.529   2.618
  247   1HG1  ILE  34          2HG1      ILE  34  12.172  -2.308   4.854
  248   2HG1  ILE  34          1HG1      ILE  34  12.518  -2.131   3.138
  249   1HG2  ILE  34          1HG2      ILE  34   9.832  -3.030   5.578
  250   2HG2  ILE  34          2HG2      ILE  34   8.584  -3.221   4.346
  251   3HG2  ILE  34          3HG2      ILE  34   9.215  -1.616   4.722
  252   1HD1  ILE  34          1HD1      ILE  34  12.384   0.015   4.293
  253   2HD1  ILE  34          2HD1      ILE  34  10.716  -0.337   4.743
  254   3HD1  ILE  34          3HD1      ILE  34  11.149  -0.138   3.044
  255    H    ALA  35           H        ALA  35   9.582  -4.551   1.324
  256    HA   ALA  35           HA       ALA  35   7.185  -5.629   2.276
  257   1HB   ALA  35          1HB       ALA  35   6.751  -6.268  -0.046
  258   2HB   ALA  35          2HB       ALA  35   8.443  -5.967  -0.446
  259   3HB   ALA  35          3HB       ALA  35   7.406  -4.635   0.064
  260    H    GLY  36           H        GLY  36  10.188  -7.138   1.322
  261   1HA   GLY  36          2HA       GLY  36   9.152  -9.832   1.471
  262   2HA   GLY  36          1HA       GLY  36  10.840  -9.367   1.298
  263    H    CYS  37           H        CYS  37   9.928  -7.555   3.750
  264    HA   CYS  37           HA       CYS  37  10.926  -9.452   5.722
  265   1HB   CYS  37          2HB       CYS  37  12.059  -7.295   5.556
  266   2HB   CYS  37          1HB       CYS  37  10.539  -6.452   5.827
  267    H    GLU  38           H        GLU  38   8.301  -7.051   5.457
  268    HA   GLU  38           HA       GLU  38   7.068  -8.190   7.827
  269   1HB   GLU  38          2HB       GLU  38   6.335  -5.742   6.216
  270   2HB   GLU  38          1HB       GLU  38   5.548  -6.250   7.707
  271   1HG   GLU  38          2HG       GLU  38   7.765  -6.074   8.839
  272   2HG   GLU  38          1HG       GLU  38   8.396  -5.361   7.357
  273    H    ALA  39           H        ALA  39   6.655  -8.151   4.391
  274    HA   ALA  39           HA       ALA  39   4.030  -9.377   4.738
  275   1HB   ALA  39          1HB       ALA  39   3.557  -8.841   2.423
  276   2HB   ALA  39          2HB       ALA  39   5.185  -8.186   2.241
  277   3HB   ALA  39          3HB       ALA  39   4.035  -7.397   3.320
  278    H    GLY  40           H        GLY  40   7.221 -10.124   4.029
  279   1HA   GLY  40          2HA       GLY  40   8.169 -12.197   3.565
  280   2HA   GLY  40          1HA       GLY  40   6.546 -12.860   3.378
  281    H    GLY  41           H        GLY  41   7.064  -9.980   1.781
  282   1HA   GLY  41          2HA       GLY  41   7.415  -9.390  -0.383
  283   2HA   GLY  41          1HA       GLY  41   8.012 -11.017  -0.720
  284    H    ASN  42           H        ASN  42   4.958  -9.404   0.176
  285    HA   ASN  42           HA       ASN  42   3.630 -10.751  -2.037
  286   1HB   ASN  42          2HB       ASN  42   3.515 -12.117   0.201
  287   2HB   ASN  42          1HB       ASN  42   2.342 -10.891   0.675
  288   1HD2  ASN  42          1HD2      ASN  42   0.341 -10.862  -0.294
  289   2HD2  ASN  42          2HD2      ASN  42  -0.234 -12.134  -1.320
  290    H    TRP  43           H        TRP  43   3.086  -8.907  -3.044
  291    HA   TRP  43           HA       TRP  43   2.462  -6.533  -1.510
  292   1HB   TRP  43          2HB       TRP  43   2.631  -6.986  -4.494
  293   2HB   TRP  43          1HB       TRP  43   2.479  -5.415  -3.709
  294    HD1  TRP  43           HD       TRP  43   4.923  -8.406  -3.241
  295    HE1  TRP  43           1HE      TRP  43   7.322  -7.453  -3.134
  296    HE3  TRP  43           3HE      TRP  43   3.823  -3.467  -3.812
  297    HZ2  TRP  43           2HZ      TRP  43   8.567  -4.898  -3.294
  298    HZ3  TRP  43           3HZ      TRP  43   5.642  -1.829  -3.830
  299    HH2  TRP  43           HH       TRP  43   7.974  -2.541  -3.589
  300    H    ALA  44           H        ALA  44   0.733  -9.069  -2.463
  301    HA   ALA  44           HA       ALA  44  -1.750  -7.531  -2.834
  302   1HB   ALA  44          1HB       ALA  44  -1.173 -10.368  -3.687
  303   2HB   ALA  44          2HB       ALA  44  -1.192  -8.959  -4.746
  304   3HB   ALA  44          3HB       ALA  44  -2.678  -9.488  -3.956
  305    H    ILE  45           H        ILE  45  -0.164  -8.742  -0.380
  306    HA   ILE  45           HA       ILE  45  -1.902 -10.704   0.684
  307    HB   ILE  45           HB       ILE  45   0.606 -10.352   1.180
  308   1HG1  ILE  45          2HG1      ILE  45  -1.300 -10.843   3.461
  309   2HG1  ILE  45          1HG1      ILE  45  -0.851 -12.025   2.237
  310   1HG2  ILE  45          1HG2      ILE  45   1.107  -9.028   3.177
  311   2HG2  ILE  45          2HG2      ILE  45  -0.560  -8.453   3.211
  312   3HG2  ILE  45          3HG2      ILE  45   0.494  -8.016   1.867
  313   1HD1  ILE  45          1HD1      ILE  45   1.487 -11.874   2.987
  314   2HD1  ILE  45          2HD1      ILE  45   0.393 -12.421   4.259
  315   3HD1  ILE  45          3HD1      ILE  45   0.982 -10.758   4.255
  316    H    ASN  46           H        ASN  46  -3.440 -10.502   2.261
  317    HA   ASN  46           HA       ASN  46  -3.930  -7.929   3.489
  318   1HB   ASN  46          2HB       ASN  46  -5.213  -7.938   1.297
  319   2HB   ASN  46          1HB       ASN  46  -6.165  -9.268   1.954
  320   1HD2  ASN  46          1HD2      ASN  46  -5.380  -5.896   2.220
  321   2HD2  ASN  46          2HD2      ASN  46  -6.742  -5.457   3.181
  322    H    THR  47           H        THR  47  -3.617  -8.767   5.468
  323    HA   THR  47           HA       THR  47  -4.629 -11.314   6.249
  324    HB   THR  47           HB       THR  47  -3.902 -10.459   8.567
  325    HG1  THR  47           1HG      THR  47  -2.342  -8.618   8.193
  326   1HG2  THR  47          1HG2      THR  47  -2.515 -11.948   7.204
  327   2HG2  THR  47          2HG2      THR  47  -1.519 -10.748   8.026
  328   3HG2  THR  47          3HG2      THR  47  -1.888 -10.564   6.312
  329    H    GLY  48           H        GLY  48  -5.912  -8.159   6.130
  330   1HA   GLY  48          2HA       GLY  48  -8.262  -7.814   6.333
  331   2HA   GLY  48          1HA       GLY  48  -8.310  -9.100   7.531
  332    H    ASN  49           H        ASN  49  -5.673  -7.001   7.870
  333    HA   ASN  49           HA       ASN  49  -6.831  -5.979  10.328
  334   1HB   ASN  49          2HB       ASN  49  -4.564  -5.361  10.950
  335   2HB   ASN  49          1HB       ASN  49  -4.597  -7.030  10.392
  336   1HD2  ASN  49          1HD2      ASN  49  -2.360  -5.207  10.531
  337   2HD2  ASN  49          2HD2      ASN  49  -1.747  -5.077   8.915
  338    H    GLY  50           H        GLY  50  -6.897  -4.960   7.281
  339   1HA   GLY  50          2HA       GLY  50  -7.761  -2.860   6.631
  340   2HA   GLY  50          1HA       GLY  50  -7.112  -2.163   8.108
  341    H    TYR  51           H        TYR  51  -4.679  -4.004   7.009
  342    HA   TYR  51           HA       TYR  51  -3.551  -1.818   5.410
  343   1HB   TYR  51          2HB       TYR  51  -1.882  -3.990   6.653
  344   2HB   TYR  51          1HB       TYR  51  -1.367  -2.448   6.031
  345    HD1  TYR  51           1HD      TYR  51  -0.188  -3.018   8.414
  346    HD2  TYR  51           2HD      TYR  51  -4.155  -1.565   7.865
  347    HE1  TYR  51           1HE      TYR  51  -0.150  -2.085  10.685
  348    HE2  TYR  51           2HE      TYR  51  -4.125  -0.639  10.146
  349    HH   TYR  51           HH       TYR  51  -1.290  -0.307  11.964
  350    H    TYR  52           H        TYR  52  -1.959  -2.616   3.736
  351    HA   TYR  52           HA       TYR  52  -3.211  -4.915   2.405
  352   1HB   TYR  52          2HB       TYR  52  -2.459  -2.255   1.194
  353   2HB   TYR  52          1HB       TYR  52  -3.088  -3.638   0.295
  354    HD1  TYR  52           1HD      TYR  52  -5.404  -4.105   0.251
  355    HD2  TYR  52           2HD      TYR  52  -3.905  -1.190   2.954
  356    HE1  TYR  52           1HE      TYR  52  -7.707  -3.451   0.812
  357    HE2  TYR  52           2HE      TYR  52  -6.193  -0.502   3.515
  358    HH   TYR  52           HH       TYR  52  -8.514  -0.647   2.331
  359    H    GLY  53           H        GLY  53  -1.879  -5.518   0.382
  360   1HA   GLY  53          2HA       GLY  53   0.394  -6.713   1.510
  361   2HA   GLY  53          1HA       GLY  53  -0.091  -6.812  -0.171
  362    H    GLY  54           H        GLY  54   2.544  -6.721   0.771
  363   1HA   GLY  54          2HA       GLY  54   4.310  -5.738  -0.517
  364   2HA   GLY  54          1HA       GLY  54   3.417  -4.222  -0.511
  365    H    VAL  55           H        VAL  55   4.054  -2.721   0.918
  366    HA   VAL  55           HA       VAL  55   5.854  -3.521   3.090
  367    HB   VAL  55           HB       VAL  55   6.013  -1.019   3.454
  368   1HG1  VAL  55          1HG1      VAL  55   7.805  -2.309   2.451
  369   2HG1  VAL  55          2HG1      VAL  55   7.650  -0.760   1.622
  370   3HG1  VAL  55          3HG1      VAL  55   7.012  -2.226   0.878
  371   1HG2  VAL  55          1HG2      VAL  55   4.793  -0.972   0.707
  372   2HG2  VAL  55          2HG2      VAL  55   5.492   0.406   1.557
  373   3HG2  VAL  55          3HG2      VAL  55   4.039  -0.372   2.183
  374    H    GLN  56           H        GLN  56   2.816  -3.592   2.740
  375    HA   GLN  56           HA       GLN  56   1.044  -3.833   4.102
  376   1HB   GLN  56          2HB       GLN  56   2.951  -4.941   5.448
  377   2HB   GLN  56          1HB       GLN  56   2.850  -3.517   6.473
  378   1HG   GLN  56          2HG       GLN  56   0.704  -4.032   7.197
  379   2HG   GLN  56          1HG       GLN  56   0.409  -5.130   5.847
  380   1HE2  GLN  56          1HE2      GLN  56   3.046  -6.364   6.123
  381   2HE2  GLN  56          2HE2      GLN  56   2.949  -7.405   7.500
  382    H    PHE  57           H        PHE  57   1.344  -1.325   3.134
  383    HA   PHE  57           HA       PHE  57   0.934   0.782   4.926
  384   1HB   PHE  57          2HB       PHE  57  -0.112   0.114   2.214
  385   2HB   PHE  57          1HB       PHE  57  -0.738   1.517   3.067
  386    HD1  PHE  57           1HD      PHE  57   0.875   3.310   3.790
  387    HD2  PHE  57           2HD      PHE  57   1.880   0.238   1.025
  388    HE1  PHE  57           1HE      PHE  57   2.728   4.687   2.934
  389    HE2  PHE  57           2HE      PHE  57   3.729   1.599   0.174
  390    HZ   PHE  57           HZ       PHE  57   4.155   3.831   1.111
  391    H    ASP  58           H        ASP  58  -0.703   1.169   6.375
  392    HA   ASP  58           HA       ASP  58  -3.178  -0.248   6.198
  393   1HB   ASP  58          2HB       ASP  58  -4.039   1.376   7.819
  394   2HB   ASP  58          1HB       ASP  58  -2.513   0.682   8.353
  395    H    GLN  59           H        GLN  59  -5.245   0.751   5.644
  396    HA   GLN  59           HA       GLN  59  -5.283   1.875   3.139
  397   1HB   GLN  59          2HB       GLN  59  -7.155   0.750   4.324
  398   2HB   GLN  59          1HB       GLN  59  -7.344   2.182   5.321
  399   1HG   GLN  59          2HG       GLN  59  -8.979   2.285   3.627
  400   2HG   GLN  59          1HG       GLN  59  -7.752   3.488   3.253
  401   1HE2  GLN  59          1HE2      GLN  59  -6.346   3.120   1.490
  402   2HE2  GLN  59          2HE2      GLN  59  -6.737   1.979   0.236
  403    H    GLY  60           H        GLY  60  -5.187   3.422   6.263
  404   1HA   GLY  60          2HA       GLY  60  -5.982   6.021   5.404
  405   2HA   GLY  60          1HA       GLY  60  -5.282   5.612   6.960
  406    H    THR  61           H        THR  61  -2.825   4.698   6.394
  407    HA   THR  61           HA       THR  61  -1.351   7.032   5.824
  408    HB   THR  61           HB       THR  61  -0.471   4.175   5.923
  409    HG1  THR  61           1HG      THR  61  -0.873   4.459   7.966
  410   1HG2  THR  61          1HG2      THR  61   1.174   6.702   6.077
  411   2HG2  THR  61          2HG2      THR  61   1.199   5.526   4.762
  412   3HG2  THR  61          3HG2      THR  61   1.787   5.074   6.362
  413    H    TRP  62           H        TRP  62  -2.232   4.255   3.881
  414    HA   TRP  62           HA       TRP  62  -0.716   4.823   1.595
  415   1HB   TRP  62          2HB       TRP  62  -1.890   2.710   1.902
  416   2HB   TRP  62          1HB       TRP  62  -3.436   3.556   1.922
  417    HD1  TRP  62           HD       TRP  62  -4.507   4.191  -0.390
  418    HE1  TRP  62           1HE      TRP  62  -3.948   3.578  -2.820
  419    HE3  TRP  62           3HE      TRP  62   0.147   2.251   0.329
  420    HZ2  TRP  62           2HZ      TRP  62  -1.777   2.399  -4.291
  421    HZ3  TRP  62           3HZ      TRP  62   1.401   1.411  -1.606
  422    HH2  TRP  62           HH       TRP  62   0.469   1.478  -3.857
  423    H    GLU  63           H        GLU  63  -3.978   5.722   2.562
  424    HA   GLU  63           HA       GLU  63  -4.570   7.268   0.286
  425   1HB   GLU  63          2HB       GLU  63  -6.318   6.344   1.654
  426   2HB   GLU  63          1HB       GLU  63  -5.735   7.193   3.076
  427   1HG   GLU  63          2HG       GLU  63  -6.345   9.326   2.037
  428   2HG   GLU  63          1HG       GLU  63  -6.944   8.457   0.624
  429    H    ALA  64           H        ALA  64  -3.056   7.957   3.358
  430    HA   ALA  64           HA       ALA  64  -3.379  10.749   3.425
  431   1HB   ALA  64          1HB       ALA  64  -2.758   9.407   5.378
  432   2HB   ALA  64          2HB       ALA  64  -1.639  10.745   5.117
  433   3HB   ALA  64          3HB       ALA  64  -1.174   9.106   4.660
  434    H    ASN  65           H        ASN  65  -0.673   8.776   2.183
  435    HA   ASN  65           HA       ASN  65   0.657  11.128   1.193
  436   1HB   ASN  65          2HB       ASN  65   1.261   8.205   0.690
  437   2HB   ASN  65          1HB       ASN  65   2.304   9.560   0.266
  438   1HD2  ASN  65          1HD2      ASN  65   1.095   7.566   2.832
  439   2HD2  ASN  65          2HD2      ASN  65   2.184   8.141   4.053
  440    H    GLY  66           H        GLY  66  -1.864   9.157   0.138
  441   1HA   GLY  66          2HA       GLY  66  -3.240   9.828  -1.660
  442   2HA   GLY  66          1HA       GLY  66  -1.858  10.624  -2.397
  443    H    GLY  67           H        GLY  67  -2.522   7.290  -1.310
  444   1HA   GLY  67          2HA       GLY  67  -1.022   6.268  -3.541
  445   2HA   GLY  67          1HA       GLY  67  -1.805   5.329  -2.280
  446    H    LEU  68           H        LEU  68  -4.331   6.922  -2.879
  447    HA   LEU  68           HA       LEU  68  -5.546   4.865  -4.250
  448   1HB   LEU  68          2HB       LEU  68  -6.432   7.644  -3.628
  449   2HB   LEU  68          1HB       LEU  68  -7.483   6.506  -4.444
  450    HG   LEU  68           HG       LEU  68  -7.017   4.979  -2.413
  451   1HD1  LEU  68          1HD1      LEU  68  -6.596   6.205  -0.333
  452   2HD1  LEU  68          2HD1      LEU  68  -6.249   7.653  -1.279
  453   3HD1  LEU  68          3HD1      LEU  68  -5.218   6.230  -1.433
  454   1HD2  LEU  68          1HD2      LEU  68  -9.188   5.947  -2.907
  455   2HD2  LEU  68          2HD2      LEU  68  -8.699   7.466  -2.157
  456   3HD2  LEU  68          3HD2      LEU  68  -8.868   6.011  -1.174
  457    H    ARG  69           H        ARG  69  -4.091   7.776  -5.459
  458    HA   ARG  69           HA       ARG  69  -5.304   7.804  -8.007
  459   1HB   ARG  69          2HB       ARG  69  -3.410   9.184  -8.697
  460   2HB   ARG  69          1HB       ARG  69  -4.027   9.712  -7.136
  461   1HG   ARG  69          2HG       ARG  69  -2.223   8.720  -5.983
  462   2HG   ARG  69          1HG       ARG  69  -1.691   7.851  -7.420
  463   1HD   ARG  69          2HD       ARG  69  -1.612  10.835  -6.975
  464   2HD   ARG  69          1HD       ARG  69  -0.239   9.727  -6.997
  465    HE   ARG  69           HE       ARG  69  -1.916  10.100  -9.392
  466   1HH1  ARG  69          1HH1      ARG  69   1.237  10.164  -7.838
  467   2HH1  ARG  69          2HH1      ARG  69   2.084  10.454  -9.325
  468   1HH2  ARG  69          1HH2      ARG  69  -0.794  10.499 -11.317
  469   2HH2  ARG  69          2HH2      ARG  69   0.942  10.672 -11.288
  470    H    TYR  70           H        TYR  70  -2.650   6.055  -6.602
  471    HA   TYR  70           HA       TYR  70  -1.696   4.954  -9.097
  472   1HB   TYR  70          2HB       TYR  70  -1.183   4.191  -6.215
  473   2HB   TYR  70          1HB       TYR  70  -0.206   3.696  -7.600
  474    HD1  TYR  70           1HD      TYR  70  -0.801   6.127  -5.088
  475    HD2  TYR  70           2HD      TYR  70   1.079   5.534  -8.845
  476    HE1  TYR  70           1HE      TYR  70   0.563   8.127  -4.708
  477    HE2  TYR  70           2HE      TYR  70   2.453   7.542  -8.484
  478    HH   TYR  70           HH       TYR  70   2.688   9.093  -5.468
  479    H    ALA  71           H        ALA  71  -3.686   4.252  -6.407
  480    HA   ALA  71           HA       ALA  71  -5.526   2.545  -7.411
  481   1HB   ALA  71          1HB       ALA  71  -3.761   0.921  -7.975
  482   2HB   ALA  71          2HB       ALA  71  -4.811   0.293  -6.704
  483   3HB   ALA  71          3HB       ALA  71  -3.217   0.928  -6.296
  484    HA   PRO  72           HA       PRO  72  -6.730   3.880  -3.365
  485   1HB   PRO  72          2HB       PRO  72  -8.802   1.846  -3.570
  486   2HB   PRO  72          1HB       PRO  72  -8.937   3.581  -3.340
  487   1HG   PRO  72          2HG       PRO  72  -9.519   2.334  -5.681
  488   2HG   PRO  72          1HG       PRO  72  -8.972   4.013  -5.567
  489   1HD   PRO  72          2HD       PRO  72  -7.531   1.622  -6.506
  490   2HD   PRO  72          1HD       PRO  72  -7.258   3.336  -6.878
  491    H    ARG  73           H        ARG  73  -5.607   0.800  -4.105
  492    HA   ARG  73           HA       ARG  73  -5.025   0.377  -1.286
  493   1HB   ARG  73          2HB       ARG  73  -5.751  -1.939  -1.277
  494   2HB   ARG  73          1HB       ARG  73  -7.108  -0.899  -1.695
  495   1HG   ARG  73          2HG       ARG  73  -6.515  -1.393  -4.113
  496   2HG   ARG  73          1HG       ARG  73  -5.499  -2.682  -3.468
  497   1HD   ARG  73          2HD       ARG  73  -8.411  -2.434  -2.758
  498   2HD   ARG  73          1HD       ARG  73  -7.876  -3.285  -4.204
  499    HE   ARG  73           HE       ARG  73  -6.588  -4.758  -2.662
  500   1HH1  ARG  73          1HH1      ARG  73  -9.336  -2.963  -1.433
  501   2HH1  ARG  73          2HH1      ARG  73  -9.774  -4.192  -0.282
  502   1HH2  ARG  73          1HH2      ARG  73  -7.190  -6.375  -1.162
  503   2HH2  ARG  73          2HH2      ARG  73  -8.572  -6.122  -0.138
  504    H    ALA  74           H        ALA  74  -3.115  -0.515  -0.948
  505    HA   ALA  74           HA       ALA  74  -1.113  -0.477  -2.872
  506   1HB   ALA  74          1HB       ALA  74  -1.078  -1.910  -0.223
  507   2HB   ALA  74          2HB       ALA  74  -0.729  -0.199  -0.466
  508   3HB   ALA  74          3HB       ALA  74   0.327  -1.425  -1.169
  509    H    ASP  75           H        ASP  75  -3.323  -2.989  -2.101
  510    HA   ASP  75           HA       ASP  75  -1.655  -5.142  -2.987
  511   1HB   ASP  75          2HB       ASP  75  -3.136  -6.236  -1.731
  512   2HB   ASP  75          1HB       ASP  75  -4.227  -4.859  -1.713
  513    H    LEU  76           H        LEU  76  -3.739  -2.874  -4.449
  514    HA   LEU  76           HA       LEU  76  -3.933  -4.390  -6.931
  515   1HB   LEU  76          2HB       LEU  76  -5.891  -3.144  -6.110
  516   2HB   LEU  76          1HB       LEU  76  -4.971  -1.653  -6.195
  517    HG   LEU  76           HG       LEU  76  -4.773  -1.951  -8.650
  518   1HD1  LEU  76          1HD1      LEU  76  -6.207  -3.586  -9.765
  519   2HD1  LEU  76          2HD1      LEU  76  -6.680  -4.244  -8.199
  520   3HD1  LEU  76          3HD1      LEU  76  -5.006  -4.377  -8.742
  521   1HD2  LEU  76          1HD2      LEU  76  -7.093  -1.369  -9.161
  522   2HD2  LEU  76          2HD2      LEU  76  -6.520  -0.544  -7.712
  523   3HD2  LEU  76          3HD2      LEU  76  -7.584  -1.941  -7.566
  524    H    ALA  77           H        ALA  77  -2.332  -1.619  -5.529
  525    HA   ALA  77           HA       ALA  77  -1.114  -0.725  -7.950
  526   1HB   ALA  77          1HB       ALA  77  -0.464  -0.090  -5.072
  527   2HB   ALA  77          2HB       ALA  77  -1.604   0.790  -6.090
  528   3HB   ALA  77          3HB       ALA  77   0.114   0.791  -6.486
  529    H    THR  78           H        THR  78   1.130  -0.735  -8.358
  530    HA   THR  78           HA       THR  78   2.345  -3.294  -7.644
  531    HB   THR  78           HB       THR  78   3.795  -2.863  -9.599
  532    HG1  THR  78           1HG      THR  78   2.182  -0.506  -9.895
  533   1HG2  THR  78          1HG2      THR  78   1.738  -4.063  -9.952
  534   2HG2  THR  78          2HG2      THR  78   1.974  -2.954 -11.306
  535   3HG2  THR  78          3HG2      THR  78   0.821  -2.557 -10.025
  536    H    ARG  79           H        ARG  79   4.981  -2.933  -7.940
  537    HA   ARG  79           HA       ARG  79   5.908  -1.946  -5.547
  538   1HB   ARG  79          2HB       ARG  79   7.726  -1.626  -7.890
  539   2HB   ARG  79          1HB       ARG  79   8.070  -2.256  -6.292
  540   1HG   ARG  79          2HG       ARG  79   6.552  -3.725  -8.424
  541   2HG   ARG  79          1HG       ARG  79   8.263  -3.921  -8.069
  542   1HD   ARG  79          2HD       ARG  79   6.712  -4.205  -5.683
  543   2HD   ARG  79          1HD       ARG  79   6.123  -5.301  -6.937
  544    HE   ARG  79           HE       ARG  79   8.864  -5.228  -5.849
  545   1HH1  ARG  79          1HH1      ARG  79   6.319  -6.866  -7.628
  546   2HH1  ARG  79          2HH1      ARG  79   7.169  -8.384  -7.683
  547   1HH2  ARG  79          1HH2      ARG  79   9.943  -7.231  -5.857
  548   2HH2  ARG  79          2HH2      ARG  79   9.239  -8.586  -6.691
  549    H    GLU  80           H        GLU  80   6.023  -0.312  -8.699
  550    HA   GLU  80           HA       GLU  80   7.329   1.998  -7.793
  551   1HB   GLU  80          2HB       GLU  80   6.591   2.999  -9.924
  552   2HB   GLU  80          1HB       GLU  80   7.259   1.385 -10.132
  553   1HG   GLU  80          2HG       GLU  80   4.924   0.508 -10.166
  554   2HG   GLU  80          1HG       GLU  80   4.361   2.178 -10.187
  555    H    GLU  81           H        GLU  81   3.938   1.216  -8.041
  556    HA   GLU  81           HA       GLU  81   2.929   3.796  -7.408
  557   1HB   GLU  81          2HB       GLU  81   1.874   1.040  -7.691
  558   2HB   GLU  81          1HB       GLU  81   0.897   2.198  -6.790
  559   1HG   GLU  81          2HG       GLU  81   0.280   3.236  -8.595
  560   2HG   GLU  81          1HG       GLU  81   1.908   3.324  -9.220
  561    H    GLN  82           H        GLN  82   3.175   0.797  -5.559
  562    HA   GLN  82           HA       GLN  82   2.155   1.862  -3.163
  563   1HB   GLN  82          2HB       GLN  82   2.069  -0.472  -3.388
  564   2HB   GLN  82          1HB       GLN  82   3.751  -0.577  -3.881
  565   1HG   GLN  82          2HG       GLN  82   4.535  -0.429  -1.736
  566   2HG   GLN  82          1HG       GLN  82   3.091   0.394  -1.152
  567   1HE2  GLN  82          1HE2      GLN  82   2.839  -2.436  -3.177
  568   2HE2  GLN  82          2HE2      GLN  82   2.275  -3.501  -1.921
  569    H    ILE  83           H        ILE  83   5.316   1.613  -4.545
  570    HA   ILE  83           HA       ILE  83   6.746   2.485  -2.276
  571    HB   ILE  83           HB       ILE  83   7.381   2.201  -5.177
  572   1HG1  ILE  83          2HG1      ILE  83   8.730   0.471  -4.502
  573   2HG1  ILE  83          1HG1      ILE  83   9.092   1.204  -2.950
  574   1HG2  ILE  83          1HG2      ILE  83   9.131   3.574  -3.146
  575   2HG2  ILE  83          2HG2      ILE  83   8.417   4.302  -4.584
  576   3HG2  ILE  83          3HG2      ILE  83   9.649   3.052  -4.750
  577   1HD1  ILE  83          1HD1      ILE  83   7.823  -0.845  -2.701
  578   2HD1  ILE  83          2HD1      ILE  83   6.530  -0.183  -3.703
  579   3HD1  ILE  83          3HD1      ILE  83   6.890   0.542  -2.136
  580    H    ALA  84           H        ALA  84   5.255   4.217  -5.031
  581    HA   ALA  84           HA       ALA  84   6.508   6.692  -4.571
  582   1HB   ALA  84          1HB       ALA  84   3.744   6.189  -5.665
  583   2HB   ALA  84          2HB       ALA  84   5.236   6.186  -6.603
  584   3HB   ALA  84          3HB       ALA  84   4.676   7.675  -5.843
  585    H    VAL  85           H        VAL  85   3.677   5.197  -3.167
  586    HA   VAL  85           HA       VAL  85   2.790   7.391  -1.613
  587    HB   VAL  85           HB       VAL  85   2.516   4.445  -1.061
  588   1HG1  VAL  85          1HG1      VAL  85   1.887   5.784   0.854
  589   2HG1  VAL  85          2HG1      VAL  85   0.440   5.109   0.105
  590   3HG1  VAL  85          3HG1      VAL  85   0.861   6.801  -0.159
  591   1HG2  VAL  85          1HG2      VAL  85   0.381   4.602  -2.270
  592   2HG2  VAL  85          2HG2      VAL  85   1.769   4.945  -3.303
  593   3HG2  VAL  85          3HG2      VAL  85   0.770   6.268  -2.701
  594    H    ALA  86           H        ALA  86   4.809   4.563  -0.877
  595    HA   ALA  86           HA       ALA  86   5.508   5.241   1.739
  596   1HB   ALA  86          1HB       ALA  86   5.867   3.022   0.780
  597   2HB   ALA  86          2HB       ALA  86   7.360   3.678   1.451
  598   3HB   ALA  86          3HB       ALA  86   7.101   3.684  -0.293
  599    H    GLU  87           H        GLU  87   6.717   6.289  -1.337
  600    HA   GLU  87           HA       GLU  87   9.201   7.323  -0.572
  601   1HB   GLU  87          2HB       GLU  87   7.302   8.018  -2.806
  602   2HB   GLU  87          1HB       GLU  87   8.811   8.893  -2.595
  603   1HG   GLU  87          2HG       GLU  87   8.535   5.934  -3.068
  604   2HG   GLU  87          1HG       GLU  87   8.988   7.137  -4.272
  605    H    VAL  88           H        VAL  88   5.988   8.849  -0.683
  606    HA   VAL  88           HA       VAL  88   6.867  11.438   0.007
  607    HB   VAL  88           HB       VAL  88   4.167  10.166   0.606
  608   1HG1  VAL  88          1HG1      VAL  88   3.358  12.433   0.920
  609   2HG1  VAL  88          2HG1      VAL  88   4.964  13.086   0.603
  610   3HG1  VAL  88          3HG1      VAL  88   4.679  12.109   2.049
  611   1HG2  VAL  88          1HG2      VAL  88   4.677  10.236  -1.783
  612   2HG2  VAL  88          2HG2      VAL  88   5.074  11.950  -1.665
  613   3HG2  VAL  88          3HG2      VAL  88   3.421  11.409  -1.379
  614    H    THR  89           H        THR  89   5.578   8.826   2.026
  615    HA   THR  89           HA       THR  89   5.907  10.390   4.378
  616    HB   THR  89           HB       THR  89   4.094   8.744   4.166
  617    HG1  THR  89           1HG      THR  89   4.353   9.100   6.252
  618   1HG2  THR  89          1HG2      THR  89   6.115   6.609   4.678
  619   2HG2  THR  89          2HG2      THR  89   5.562   6.999   3.050
  620   3HG2  THR  89          3HG2      THR  89   4.414   6.424   4.263
  621    H    ARG  90           H        ARG  90   7.872   7.916   2.775
  622    HA   ARG  90           HA       ARG  90   9.584   7.341   4.945
  623   1HB   ARG  90          2HB       ARG  90  11.040   6.263   3.445
  624   2HB   ARG  90          1HB       ARG  90   9.465   6.083   2.689
  625   1HG   ARG  90          2HG       ARG  90  10.009   7.387   0.928
  626   2HG   ARG  90          1HG       ARG  90  11.055   8.441   1.886
  627   1HD   ARG  90          2HD       ARG  90  12.846   6.930   1.801
  628   2HD   ARG  90          1HD       ARG  90  11.809   5.601   1.282
  629    HE   ARG  90           HE       ARG  90  11.547   6.927  -0.848
  630   1HH1  ARG  90          1HH1      ARG  90  14.436   7.176   1.122
  631   2HH1  ARG  90          2HH1      ARG  90  15.478   7.489  -0.230
  632   1HH2  ARG  90          1HH2      ARG  90  12.882   7.405  -2.595
  633   2HH2  ARG  90          2HH2      ARG  90  14.589   7.650  -2.342
  634    H    LEU  91           H        LEU  91   9.597   9.926   2.596
  635    HA   LEU  91           HA       LEU  91  12.310  10.669   3.104
  636   1HB   LEU  91          2HB       LEU  91  11.905  12.600   1.674
  637   2HB   LEU  91          1HB       LEU  91  11.366  11.113   0.932
  638    HG   LEU  91           HG       LEU  91   9.001  11.813   1.753
  639   1HD1  LEU  91          1HD1      LEU  91  10.418  14.480   1.815
  640   2HD1  LEU  91          2HD1      LEU  91   9.718  13.649   3.203
  641   3HD1  LEU  91          3HD1      LEU  91   8.676  14.229   1.906
  642   1HD2  LEU  91          1HD2      LEU  91   8.671  13.123  -0.279
  643   2HD2  LEU  91          2HD2      LEU  91   9.690  11.717  -0.581
  644   3HD2  LEU  91          3HD2      LEU  91  10.415  13.319  -0.444
  645    H    ARG  92           H        ARG  92   9.330  11.399   4.606
  646    HA   ARG  92           HA       ARG  92  10.186  13.872   5.803
  647   1HB   ARG  92          2HB       ARG  92   7.880  12.230   6.754
  648   2HB   ARG  92          1HB       ARG  92   8.069  13.977   6.773
  649   1HG   ARG  92          2HG       ARG  92   7.516  14.195   4.547
  650   2HG   ARG  92          1HG       ARG  92   7.914  12.512   4.179
  651   1HD   ARG  92          2HD       ARG  92   5.487  13.646   5.486
  652   2HD   ARG  92          1HD       ARG  92   5.615  12.453   4.190
  653    HE   ARG  92           HE       ARG  92   6.722  11.136   6.236
  654   1HH1  ARG  92          1HH1      ARG  92   3.696  12.869   5.892
  655   2HH1  ARG  92          2HH1      ARG  92   2.895  12.009   7.181
  656   1HH2  ARG  92          1HH2      ARG  92   5.674  10.008   7.958
  657   2HH2  ARG  92          2HH2      ARG  92   4.034  10.398   8.374
  658    H    GLN  93           H        GLN  93   9.737  10.522   6.681
  659    HA   GLN  93           HA       GLN  93  10.505  11.137   9.419
  660   1HB   GLN  93          2HB       GLN  93   9.502   9.000  10.006
  661   2HB   GLN  93          1HB       GLN  93   8.389   9.988   9.059
  662   1HG   GLN  93          2HG       GLN  93   9.260   8.670   7.041
  663   2HG   GLN  93          1HG       GLN  93   9.883   7.534   8.238
  664   1HE2  GLN  93          1HE2      GLN  93   7.781   7.255   6.202
  665   2HE2  GLN  93          2HE2      GLN  93   6.366   6.760   7.055
  666    H    GLY  94           H        GLY  94  11.619   9.253   6.667
  667   1HA   GLY  94          2HA       GLY  94  13.864   8.691   6.272
  668   2HA   GLY  94          1HA       GLY  94  14.228   9.091   7.949
  669    H    TRP  95           H        TRP  95  11.852   6.900   6.547
  670    HA   TRP  95           HA       TRP  95  11.493   4.698   6.702
  671   1HB   TRP  95          2HB       TRP  95  14.337   4.186   7.515
  672   2HB   TRP  95          1HB       TRP  95  13.271   3.183   6.527
  673    HD1  TRP  95           HD       TRP  95  15.286   6.469   6.242
  674    HE1  TRP  95           1HE      TRP  95  15.945   6.776   3.799
  675    HE3  TRP  95           3HE      TRP  95  12.789   2.495   4.222
  676    HZ2  TRP  95           2HZ      TRP  95  15.536   5.505   1.362
  677    HZ3  TRP  95           3HZ      TRP  95  12.982   2.109   1.799
  678    HH2  TRP  95           HH       TRP  95  14.323   3.591   0.391
  679    H    GLY  96           H        GLY  96  11.634   6.601   9.080
  680   1HA   GLY  96          2HA       GLY  96  12.263   5.101  11.386
  681   2HA   GLY  96          1HA       GLY  96  11.244   6.532  11.336
  682    H    ALA  97           H        ALA  97   9.276   5.498   9.559
  683    HA   ALA  97           HA       ALA  97   7.627   4.079  11.383
  684   1HB   ALA  97          1HB       ALA  97   7.206   4.484   8.425
  685   2HB   ALA  97          2HB       ALA  97   6.719   5.618   9.686
  686   3HB   ALA  97          3HB       ALA  97   5.983   4.018   9.607
  687    H    TRP  98           H        TRP  98   9.886   3.135   8.961
  688    HA   TRP  98           HA       TRP  98   8.880   0.388   8.969
  689   1HB   TRP  98          2HB       TRP  98  10.904   1.825   7.255
  690   2HB   TRP  98          1HB       TRP  98  10.627   0.086   7.167
  691    HD1  TRP  98           HD       TRP  98   8.219  -0.726   6.268
  692    HE1  TRP  98           1HE      TRP  98   6.560   0.402   4.655
  693    HE3  TRP  98           3HE      TRP  98   9.966   4.101   6.539
  694    HZ2  TRP  98           2HZ      TRP  98   6.071   3.015   3.627
  695    HZ3  TRP  98           3HZ      TRP  98   8.863   5.827   5.198
  696    HH2  TRP  98           HH       TRP  98   6.962   5.271   3.770
  697    HA   PRO  99           HA       PRO  99  11.748  -0.089  12.333
  698   1HB   PRO  99          2HB       PRO  99  10.764  -2.890  12.115
  699   2HB   PRO  99          1HB       PRO  99  10.814  -1.820  13.522
  700   1HG   PRO  99          2HG       PRO  99   8.507  -2.278  12.337
  701   2HG   PRO  99          1HG       PRO  99   8.936  -0.622  12.825
  702   1HD   PRO  99          2HD       PRO  99   9.130  -1.881  10.101
  703   2HD   PRO  99          1HD       PRO  99   8.423  -0.312  10.561
  704    H    VAL 100           H        VAL 100  12.501  -3.079  12.440
  705    HA   VAL 100           HA       VAL 100  15.127  -2.836  11.598
  706    HB   VAL 100           HB       VAL 100  13.570  -5.414  11.858
  707   1HG1  VAL 100          1HG1      VAL 100  15.749  -5.706  10.799
  708   2HG1  VAL 100          2HG1      VAL 100  15.721  -6.421  12.412
  709   3HG1  VAL 100          3HG1      VAL 100  16.521  -4.872  12.148
  710   1HG2  VAL 100          1HG2      VAL 100  15.029  -3.821  13.962
  711   2HG2  VAL 100          2HG2      VAL 100  14.354  -5.435  14.191
  712   3HG2  VAL 100          3HG2      VAL 100  13.286  -4.071  13.854
  713    H    CYS 101           H        CYS 101  12.321  -3.673   9.775
  714    HA   CYS 101           HA       CYS 101  13.510  -5.102   7.677
  715   1HB   CYS 101          2HB       CYS 101  11.039  -3.357   7.605
  716   2HB   CYS 101          1HB       CYS 101  11.466  -4.605   6.433
  717    H    ALA 102           H        ALA 102  13.150  -1.624   8.229
  718    HA   ALA 102           HA       ALA 102  14.005  -0.846   5.623
  719   1HB   ALA 102          1HB       ALA 102  14.110   0.730   8.192
  720   2HB   ALA 102          2HB       ALA 102  12.729   0.645   7.099
  721   3HB   ALA 102          3HB       ALA 102  14.239   1.381   6.558
  722    H    ALA 103           H        ALA 103  15.643  -1.316   8.718
  723    HA   ALA 103           HA       ALA 103  18.204  -0.461   7.898
  724   1HB   ALA 103          1HB       ALA 103  17.467  -2.458  10.036
  725   2HB   ALA 103          2HB       ALA 103  17.586  -0.712  10.252
  726   3HB   ALA 103          3HB       ALA 103  19.026  -1.650   9.867
  727    H    ARG 104           H        ARG 104  16.529  -3.526   7.740
  728    HA   ARG 104           HA       ARG 104  18.704  -5.056   6.737
  729   1HB   ARG 104          2HB       ARG 104  15.727  -5.413   6.835
  730   2HB   ARG 104          1HB       ARG 104  16.758  -6.566   6.003
  731   1HG   ARG 104          2HG       ARG 104  17.972  -6.964   8.103
  732   2HG   ARG 104          1HG       ARG 104  16.874  -5.844   8.922
  733   1HD   ARG 104          2HD       ARG 104  16.301  -8.319   9.081
  734   2HD   ARG 104          1HD       ARG 104  15.010  -7.238   8.549
  735    HE   ARG 104           HE       ARG 104  16.467  -8.244   6.333
  736   1HH1  ARG 104          1HH1      ARG 104  14.026  -9.182   8.682
  737   2HH1  ARG 104          2HH1      ARG 104  13.300 -10.353   7.620
  738   1HH2  ARG 104          1HH2      ARG 104  15.492  -9.762   4.954
  739   2HH2  ARG 104          2HH2      ARG 104  14.114 -10.675   5.502
  740    H    ALA 105           H        ALA 105  16.625  -2.762   5.328
  741    HA   ALA 105           HA       ALA 105  16.718  -3.966   2.663
  742   1HB   ALA 105          1HB       ALA 105  14.589  -3.179   3.515
  743   2HB   ALA 105          2HB       ALA 105  15.082  -2.265   2.090
  744   3HB   ALA 105          3HB       ALA 105  15.248  -1.555   3.695
  745    H    GLY 106           H        GLY 106  18.215  -1.448   4.500
  746   1HA   GLY 106          2HA       GLY 106  20.189  -0.332   3.746
  747   2HA   GLY 106          1HA       GLY 106  19.636  -0.544   2.089
  748    H    ALA 107           H        ALA 107  18.738   1.083   5.115
  749    HA   ALA 107           HA       ALA 107  16.821   2.786   3.953
  750   1HB   ALA 107          1HB       ALA 107  18.316   3.126   6.549
  751   2HB   ALA 107          2HB       ALA 107  16.843   2.177   6.341
  752   3HB   ALA 107          3HB       ALA 107  16.811   3.922   6.092
  753    H    ARG 108           H        ARG 108  16.904   5.026   3.628
  754    HA   ARG 108           HA       ARG 108  17.751   7.008   2.955
  755   1HB   ARG 108          2HB       ARG 108  20.393   6.157   4.125
  756   2HB   ARG 108          1HB       ARG 108  19.781   7.795   3.910
  757   1HG   ARG 108          2HG       ARG 108  18.364   5.803   5.634
  758   2HG   ARG 108          1HG       ARG 108  19.709   6.783   6.263
  759   1HD   ARG 108          2HD       ARG 108  18.455   8.819   5.492
  760   2HD   ARG 108          1HD       ARG 108  17.092   7.762   5.117
  761    HE   ARG 108           HE       ARG 108  17.430   7.150   7.657
  762   1HH1  ARG 108          1HH1      ARG 108  17.609  10.306   6.135
  763   2HH1  ARG 108          2HH1      ARG 108  17.075  11.157   7.556
  764   1HH2  ARG 108          1HH2      ARG 108  16.713   8.253   9.511
  765   2HH2  ARG 108          2HH2      ARG 108  16.538   9.988   9.479
  Start of MODEL   29
    1   1H    ASN   1          1HT       ASN   1  54.452  19.053 -30.410
    2   2H    ASN   1          2HT       ASN   1  53.811  18.042 -31.607
    3   3H    ASN   1          3HT       ASN   1  54.812  17.399 -30.395
    4    HA   ASN   1           HA       ASN   1  52.199  18.678 -29.873
    5   1HB   ASN   1          2HB       ASN   1  52.917  15.749 -30.106
    6   2HB   ASN   1          1HB       ASN   1  51.398  16.349 -29.446
    7   1HD2  ASN   1          1HD2      ASN   1  51.832  14.645 -31.736
    8   2HD2  ASN   1          2HD2      ASN   1  51.160  15.467 -33.104
    9    H    VAL   2           H        VAL   2  52.216  19.413 -27.870
   10    HA   VAL   2           HA       VAL   2  54.016  18.205 -25.899
   11    HB   VAL   2           HB       VAL   2  52.420  20.769 -25.707
   12   1HG1  VAL   2          1HG1      VAL   2  54.677  19.748 -23.986
   13   2HG1  VAL   2          2HG1      VAL   2  52.973  19.762 -23.533
   14   3HG1  VAL   2          3HG1      VAL   2  53.829  21.282 -23.795
   15   1HG2  VAL   2          1HG2      VAL   2  55.344  20.368 -26.324
   16   2HG2  VAL   2          2HG2      VAL   2  54.533  21.921 -26.112
   17   3HG2  VAL   2          3HG2      VAL   2  54.109  20.880 -27.473
   18    H    VAL   3           H        VAL   3  50.654  18.853 -26.563
   19    HA   VAL   3           HA       VAL   3  49.746  17.909 -24.029
   20    HB   VAL   3           HB       VAL   3  48.124  18.551 -26.490
   21   1HG1  VAL   3          1HG1      VAL   3  47.321  18.338 -23.591
   22   2HG1  VAL   3          2HG1      VAL   3  46.917  17.191 -24.869
   23   3HG1  VAL   3          3HG1      VAL   3  46.268  18.831 -24.917
   24   1HG2  VAL   3          1HG2      VAL   3  48.881  20.311 -24.164
   25   2HG2  VAL   3          2HG2      VAL   3  47.717  20.730 -25.418
   26   3HG2  VAL   3          3HG2      VAL   3  49.412  20.492 -25.835
   27    H    VAL   4           H        VAL   4  49.044  15.885 -23.546
   28    HA   VAL   4           HA       VAL   4  49.214  13.836 -25.606
   29    HB   VAL   4           HB       VAL   4  48.329  13.404 -22.769
   30   1HG1  VAL   4          1HG1      VAL   4  49.229  11.154 -23.126
   31   2HG1  VAL   4          2HG1      VAL   4  49.650  11.601 -24.781
   32   3HG1  VAL   4          3HG1      VAL   4  47.959  11.560 -24.280
   33   1HG2  VAL   4          1HG2      VAL   4  50.439  14.600 -22.638
   34   2HG2  VAL   4          2HG2      VAL   4  51.170  13.476 -23.783
   35   3HG2  VAL   4          3HG2      VAL   4  50.676  12.911 -22.187
   36    H    THR   5           H        THR   5  47.502  12.693 -26.380
   37    HA   THR   5           HA       THR   5  44.829  13.672 -25.655
   38    HB   THR   5           HB       THR   5  44.268  13.542 -28.128
   39    HG1  THR   5           1HG      THR   5  46.765  12.648 -28.243
   40   1HG2  THR   5          1HG2      THR   5  44.565  15.672 -26.936
   41   2HG2  THR   5          2HG2      THR   5  45.137  15.773 -28.601
   42   3HG2  THR   5          3HG2      THR   5  46.294  15.616 -27.280
   43    HA   PRO   6           HA       PRO   6  44.392   9.166 -25.711
   44   1HB   PRO   6          2HB       PRO   6  42.159   9.487 -23.939
   45   2HB   PRO   6          1HB       PRO   6  43.764   8.858 -23.565
   46   1HG   PRO   6          2HG       PRO   6  42.762  11.220 -22.586
   47   2HG   PRO   6          1HG       PRO   6  44.491  10.858 -22.751
   48   1HD   PRO   6          2HD       PRO   6  42.700  12.436 -24.561
   49   2HD   PRO   6          1HD       PRO   6  44.368  12.784 -24.053
   50    H    ALA   7           H        ALA   7  42.560   7.790 -26.109
   51    HA   ALA   7           HA       ALA   7  40.328   9.031 -27.528
   52   1HB   ALA   7          1HB       ALA   7  42.036   8.650 -29.239
   53   2HB   ALA   7          2HB       ALA   7  40.641   7.599 -29.487
   54   3HB   ALA   7          3HB       ALA   7  42.122   6.950 -28.783
   55    H    HIS   8           H        HIS   8  39.168   6.830 -28.586
   56    HA   HIS   8           HA       HIS   8  37.697   5.185 -28.072
   57   1HB   HIS   8          2HB       HIS   8  39.745   3.997 -27.253
   58   2HB   HIS   8          1HB       HIS   8  39.419   4.657 -25.656
   59    HD1  HIS   8           1HD      HIS   8  38.232   3.041 -24.176
   60    HD2  HIS   8           2HD      HIS   8  37.297   2.462 -28.184
   61    HE1  HIS   8           1HE      HIS   8  36.657   1.065 -24.259
   62    H    GLU   9           H        GLU   9  38.175   7.917 -26.514
   63    HA   GLU   9           HA       GLU   9  36.657   7.974 -24.217
   64   1HB   GLU   9          2HB       GLU   9  36.137  10.306 -24.740
   65   2HB   GLU   9          1HB       GLU   9  37.816   9.946 -25.114
   66   1HG   GLU   9          2HG       GLU   9  37.180   9.682 -27.491
   67   2HG   GLU   9          1HG       GLU   9  35.543  10.181 -27.065
   68    H    ALA  10           H        ALA  10  34.510   7.967 -23.716
   69    HA   ALA  10           HA       ALA  10  32.714   7.238 -25.920
   70   1HB   ALA  10          1HB       ALA  10  33.424   5.214 -24.738
   71   2HB   ALA  10          2HB       ALA  10  31.701   5.518 -24.521
   72   3HB   ALA  10          3HB       ALA  10  32.832   5.893 -23.222
   73    H    VAL  11           H        VAL  11  32.366   9.545 -25.653
   74    HA   VAL  11           HA       VAL  11  30.860  10.596 -23.525
   75    HB   VAL  11           HB       VAL  11  30.873  11.419 -26.407
   76   1HG1  VAL  11          1HG1      VAL  11  30.072  13.596 -25.598
   77   2HG1  VAL  11          2HG1      VAL  11  29.934  12.922 -23.974
   78   3HG1  VAL  11          3HG1      VAL  11  28.921  12.301 -25.278
   79   1HG2  VAL  11          1HG2      VAL  11  32.477  12.455 -24.080
   80   2HG2  VAL  11          2HG2      VAL  11  32.490  13.120 -25.715
   81   3HG2  VAL  11          3HG2      VAL  11  33.092  11.487 -25.421
   82    H    VAL  12           H        VAL  12  29.840   9.406 -26.693
   83    HA   VAL  12           HA       VAL  12  27.363   9.220 -26.832
   84    HB   VAL  12           HB       VAL  12  28.643   8.113 -28.449
   85   1HG1  VAL  12          1HG1      VAL  12  29.365   6.078 -26.344
   86   2HG1  VAL  12          2HG1      VAL  12  30.446   7.260 -27.081
   87   3HG1  VAL  12          3HG1      VAL  12  29.772   5.953 -28.056
   88   1HG2  VAL  12          1HG2      VAL  12  26.364   7.311 -28.279
   89   2HG2  VAL  12          2HG2      VAL  12  26.858   6.092 -27.107
   90   3HG2  VAL  12          3HG2      VAL  12  27.435   5.999 -28.772
   91    H    ARG  13           H        ARG  13  26.186   9.309 -25.107
   92    HA   ARG  13           HA       ARG  13  25.784   6.837 -23.606
   93   1HB   ARG  13          2HB       ARG  13  25.670   9.623 -22.561
   94   2HB   ARG  13          1HB       ARG  13  25.010   8.253 -21.693
   95   1HG   ARG  13          2HG       ARG  13  27.240   7.236 -21.637
   96   2HG   ARG  13          1HG       ARG  13  27.888   8.636 -22.489
   97   1HD   ARG  13          2HD       ARG  13  26.522   8.726 -19.805
   98   2HD   ARG  13          1HD       ARG  13  28.268   8.713 -20.044
   99    HE   ARG  13           HE       ARG  13  26.556  10.873 -21.103
  100   1HH1  ARG  13          1HH1      ARG  13  29.426   9.762 -19.443
  101   2HH1  ARG  13          2HH1      ARG  13  30.002  11.367 -19.079
  102   1HH2  ARG  13          1HH2      ARG  13  27.299  12.982 -20.663
  103   2HH2  ARG  13          2HH2      ARG  13  28.775  13.210 -19.769
  104    H    VAL  14           H        VAL  14  23.951   5.985 -24.176
  105    HA   VAL  14           HA       VAL  14  21.757   7.660 -25.082
  106    HB   VAL  14           HB       VAL  14  21.729   4.673 -25.111
  107   1HG1  VAL  14          1HG1      VAL  14  19.672   5.836 -25.674
  108   2HG1  VAL  14          2HG1      VAL  14  20.312   4.977 -27.075
  109   3HG1  VAL  14          3HG1      VAL  14  20.512   6.724 -26.947
  110   1HG2  VAL  14          1HG2      VAL  14  22.759   4.651 -27.330
  111   2HG2  VAL  14          2HG2      VAL  14  23.871   5.287 -26.118
  112   3HG2  VAL  14          3HG2      VAL  14  23.042   6.388 -27.220
  113    H    GLY  15           H        GLY  15  19.633   7.102 -24.355
  114   1HA   GLY  15          2HA       GLY  15  18.568   5.617 -22.526
  115   2HA   GLY  15          1HA       GLY  15  19.592   6.600 -21.489
  116    H    THR  16           H        THR  16  16.685   6.446 -23.308
  117    HA   THR  16           HA       THR  16  16.150   9.267 -23.185
  118    HB   THR  16           HB       THR  16  14.339   7.022 -24.053
  119    HG1  THR  16           1HG      THR  16  15.133   7.479 -26.149
  120   1HG2  THR  16          1HG2      THR  16  14.336   9.949 -24.756
  121   2HG2  THR  16          2HG2      THR  16  13.245   9.175 -23.607
  122   3HG2  THR  16          3HG2      THR  16  13.187   8.732 -25.313
  123    H    LYS  17           H        LYS  17  15.278   6.387 -21.511
  124    HA   LYS  17           HA       LYS  17  13.714   5.862 -19.922
  125   1HB   LYS  17          2HB       LYS  17  14.969   8.401 -18.951
  126   2HB   LYS  17          1HB       LYS  17  13.847   7.488 -17.954
  127   1HG   LYS  17          2HG       LYS  17  15.835   6.669 -17.196
  128   2HG   LYS  17          1HG       LYS  17  15.518   5.524 -18.499
  129   1HD   LYS  17          2HD       LYS  17  17.839   6.330 -18.527
  130   2HD   LYS  17          1HD       LYS  17  16.965   6.784 -19.991
  131   1HE   LYS  17          2HE       LYS  17  18.312   8.643 -19.184
  132   2HE   LYS  17          1HE       LYS  17  16.595   9.024 -19.077
  133   1HZ   LYS  17          1HZ       LYS  17  18.448   8.329 -16.870
  134   2HZ   LYS  17          2HZ       LYS  17  16.765   8.294 -16.677
  135   3HZ   LYS  17          3HZ       LYS  17  17.543   9.747 -17.073
  136    HA   PRO  18           HA       PRO  18  10.388   8.704 -21.480
  137   1HB   PRO  18          2HB       PRO  18   8.969   6.270 -22.188
  138   2HB   PRO  18          1HB       PRO  18   9.483   7.599 -23.231
  139   1HG   PRO  18          2HG       PRO  18  10.586   5.143 -23.367
  140   2HG   PRO  18          1HG       PRO  18  11.500   6.623 -23.704
  141   1HD   PRO  18          2HD       PRO  18  11.427   4.982 -21.194
  142   2HD   PRO  18          1HD       PRO  18  12.833   5.672 -22.038
  143    H    GLY  19           H        GLY  19   8.163   8.763 -20.904
  144   1HA   GLY  19          2HA       GLY  19   7.838   7.769 -18.169
  145   2HA   GLY  19          1HA       GLY  19   7.007   9.164 -18.835
  146    H    THR  20           H        THR  20   7.283   6.328 -20.640
  147    HA   THR  20           HA       THR  20   4.476   5.890 -20.841
  148    HB   THR  20           HB       THR  20   6.547   3.817 -21.521
  149    HG1  THR  20           1HG      THR  20   5.876   5.878 -23.351
  150   1HG2  THR  20          1HG2      THR  20   5.025   3.349 -23.366
  151   2HG2  THR  20          2HG2      THR  20   3.989   4.685 -22.862
  152   3HG2  THR  20          3HG2      THR  20   4.179   3.275 -21.821
  153    H    GLU  21           H        GLU  21   7.134   4.328 -19.209
  154    HA   GLU  21           HA       GLU  21   5.333   3.037 -17.361
  155   1HB   GLU  21          2HB       GLU  21   6.802   1.081 -17.350
  156   2HB   GLU  21          1HB       GLU  21   6.195   1.375 -18.976
  157   1HG   GLU  21          2HG       GLU  21   8.296   2.376 -19.623
  158   2HG   GLU  21          1HG       GLU  21   8.912   2.195 -17.979
  159    H    VAL  22           H        VAL  22   6.253   2.853 -15.308
  160    HA   VAL  22           HA       VAL  22   7.860   5.104 -14.615
  161    HB   VAL  22           HB       VAL  22   7.007   2.808 -12.846
  162   1HG1  VAL  22          1HG1      VAL  22   8.739   4.182 -11.848
  163   2HG1  VAL  22          2HG1      VAL  22   7.197   4.478 -11.048
  164   3HG1  VAL  22          3HG1      VAL  22   7.821   5.640 -12.215
  165   1HG2  VAL  22          1HG2      VAL  22   5.048   4.122 -12.308
  166   2HG2  VAL  22          2HG2      VAL  22   5.120   3.851 -14.053
  167   3HG2  VAL  22          3HG2      VAL  22   5.589   5.412 -13.383
  168    HA   PRO  23           HA       PRO  23  11.819   3.049 -15.255
  169   1HB   PRO  23          2HB       PRO  23  12.666   5.494 -13.793
  170   2HB   PRO  23          1HB       PRO  23  13.274   4.827 -15.309
  171   1HG   PRO  23          2HG       PRO  23  11.707   6.988 -15.274
  172   2HG   PRO  23          1HG       PRO  23  11.577   5.775 -16.563
  173   1HD   PRO  23          2HD       PRO  23   9.814   6.264 -14.221
  174   2HD   PRO  23          1HD       PRO  23   9.393   5.731 -15.858
  175    HA   PRO  24           HA       PRO  24  12.413   1.037 -11.391
  176   1HB   PRO  24          2HB       PRO  24  15.215   1.055 -11.324
  177   2HB   PRO  24          1HB       PRO  24  14.204  -0.193 -12.059
  178   1HG   PRO  24          2HG       PRO  24  15.563   2.139 -13.333
  179   2HG   PRO  24          1HG       PRO  24  15.338   0.490 -13.950
  180   1HD   PRO  24          2HD       PRO  24  13.820   2.469 -14.857
  181   2HD   PRO  24          1HD       PRO  24  13.110   0.880 -14.507
  182    H    VAL  25           H        VAL  25  12.599   1.606  -9.354
  183    HA   VAL  25           HA       VAL  25  13.375   4.379  -8.806
  184    HB   VAL  25           HB       VAL  25  11.611   2.589  -7.124
  185   1HG1  VAL  25          1HG1      VAL  25  12.090   5.566  -7.130
  186   2HG1  VAL  25          2HG1      VAL  25  12.512   4.416  -5.863
  187   3HG1  VAL  25          3HG1      VAL  25  10.821   4.765  -6.205
  188   1HG2  VAL  25          1HG2      VAL  25   9.695   3.765  -8.104
  189   2HG2  VAL  25          2HG2      VAL  25  10.600   2.870  -9.327
  190   3HG2  VAL  25          3HG2      VAL  25  10.781   4.621  -9.199
  191    H    ILE  26           H        ILE  26  14.926   4.824  -7.382
  192    HA   ILE  26           HA       ILE  26  16.804   2.819  -6.747
  193    HB   ILE  26           HB       ILE  26  16.653   5.633  -5.653
  194   1HG1  ILE  26          2HG1      ILE  26  16.640   5.652  -8.090
  195   2HG1  ILE  26          1HG1      ILE  26  18.195   6.216  -7.488
  196   1HG2  ILE  26          1HG2      ILE  26  18.986   3.734  -5.877
  197   2HG2  ILE  26          2HG2      ILE  26  18.184   4.236  -4.387
  198   3HG2  ILE  26          3HG2      ILE  26  19.078   5.414  -5.347
  199   1HD1  ILE  26          1HD1      ILE  26  19.186   4.053  -7.980
  200   2HD1  ILE  26          2HD1      ILE  26  18.441   4.747  -9.419
  201   3HD1  ILE  26          3HD1      ILE  26  17.626   3.454  -8.542
  202    H    ASP  27           H        ASP  27  14.130   4.150  -5.025
  203    HA   ASP  27           HA       ASP  27  14.993   3.052  -2.497
  204   1HB   ASP  27          2HB       ASP  27  12.446   4.467  -3.240
  205   2HB   ASP  27          1HB       ASP  27  12.862   3.930  -1.623
  206    H    GLY  28           H        GLY  28  13.457   2.135  -5.206
  207   1HA   GLY  28          2HA       GLY  28  11.313   0.558  -4.265
  208   2HA   GLY  28          1HA       GLY  28  12.103   0.384  -5.830
  209    H    SER  29           H        SER  29  14.645   0.189  -4.153
  210    HA   SER  29           HA       SER  29  14.701  -2.698  -4.067
  211   1HB   SER  29          2HB       SER  29  16.783  -0.749  -3.108
  212   2HB   SER  29          1HB       SER  29  17.025  -2.448  -3.508
  213    HG   SER  29           HG       SER  29  17.425  -0.508  -5.121
  214    H    ILE  30           H        ILE  30  14.705  -0.035  -1.879
  215    HA   ILE  30           HA       ILE  30  15.016  -1.504   0.545
  216    HB   ILE  30           HB       ILE  30  13.505   1.034   0.740
  217   1HG1  ILE  30          2HG1      ILE  30  14.911   1.605  -1.211
  218   2HG1  ILE  30          1HG1      ILE  30  15.393   2.505   0.220
  219   1HG2  ILE  30          1HG2      ILE  30  16.026   0.020   2.020
  220   2HG2  ILE  30          2HG2      ILE  30  14.397  -0.011   2.691
  221   3HG2  ILE  30          3HG2      ILE  30  15.214   1.530   2.434
  222   1HD1  ILE  30          1HD1      ILE  30  17.283   1.024   0.550
  223   2HD1  ILE  30          2HD1      ILE  30  17.317   1.737  -1.062
  224   3HD1  ILE  30          3HD1      ILE  30  16.797   0.066  -0.846
  225    H    TRP  31           H        TRP  31  12.428  -0.301  -1.418
  226    HA   TRP  31           HA       TRP  31  10.321  -0.851   0.379
  227   1HB   TRP  31          2HB       TRP  31  10.356  -0.326  -2.599
  228   2HB   TRP  31          1HB       TRP  31   8.880  -0.508  -1.655
  229    HD1  TRP  31           HD       TRP  31  10.630   2.214  -3.059
  230    HE1  TRP  31           1HE      TRP  31  10.400   4.375  -1.663
  231    HE3  TRP  31           3HE      TRP  31   9.161   0.146   1.321
  232    HZ2  TRP  31           2HZ      TRP  31   9.720   5.063   0.981
  233    HZ3  TRP  31           3HZ      TRP  31   8.755   1.602   3.261
  234    HH2  TRP  31           HH       TRP  31   9.037   4.017   3.087
  235    H    ASP  32           H        ASP  32  11.842  -2.652  -2.228
  236    HA   ASP  32           HA       ASP  32   9.927  -4.775  -2.141
  237   1HB   ASP  32          2HB       ASP  32  10.984  -4.468  -4.212
  238   2HB   ASP  32          1HB       ASP  32  12.588  -4.364  -3.476
  239    H    ALA  33           H        ALA  33  13.054  -4.105  -0.631
  240    HA   ALA  33           HA       ALA  33  13.351  -6.707   0.444
  241   1HB   ALA  33          1HB       ALA  33  15.249  -5.203   0.187
  242   2HB   ALA  33          2HB       ALA  33  15.076  -5.734   1.861
  243   3HB   ALA  33          3HB       ALA  33  14.554  -4.116   1.390
  244    H    ILE  34           H        ILE  34  11.867  -3.713   1.612
  245    HA   ILE  34           HA       ILE  34  11.170  -4.690   4.195
  246    HB   ILE  34           HB       ILE  34   9.807  -2.602   2.501
  247   1HG1  ILE  34          2HG1      ILE  34  11.771  -2.307   4.788
  248   2HG1  ILE  34          1HG1      ILE  34  12.159  -2.090   3.085
  249   1HG2  ILE  34          1HG2      ILE  34   9.495  -3.208   5.443
  250   2HG2  ILE  34          2HG2      ILE  34   8.282  -3.457   4.187
  251   3HG2  ILE  34          3HG2      ILE  34   8.791  -1.822   4.607
  252   1HD1  ILE  34          1HD1      ILE  34  11.868   0.042   4.188
  253   2HD1  ILE  34          2HD1      ILE  34  10.241  -0.418   4.689
  254   3HD1  ILE  34          3HD1      ILE  34  10.610  -0.204   2.978
  255    H    ALA  35           H        ALA  35   9.497  -4.630   1.084
  256    HA   ALA  35           HA       ALA  35   7.096  -5.826   1.820
  257   1HB   ALA  35          1HB       ALA  35   6.916  -6.530  -0.518
  258   2HB   ALA  35          2HB       ALA  35   8.619  -6.140  -0.764
  259   3HB   ALA  35          3HB       ALA  35   7.466  -4.860  -0.384
  260    H    GLY  36           H        GLY  36  10.221  -7.197   1.080
  261   1HA   GLY  36          2HA       GLY  36   9.310  -9.938   1.190
  262   2HA   GLY  36          1HA       GLY  36  10.978  -9.393   1.086
  263    H    CYS  37           H        CYS  37   9.763  -7.646   3.502
  264    HA   CYS  37           HA       CYS  37  10.839  -9.469   5.502
  265   1HB   CYS  37          2HB       CYS  37  11.858  -7.271   5.405
  266   2HB   CYS  37          1HB       CYS  37  10.287  -6.500   5.589
  267    H    GLU  38           H        GLU  38   8.088  -7.195   5.209
  268    HA   GLU  38           HA       GLU  38   6.882  -8.481   7.526
  269   1HB   GLU  38          2HB       GLU  38   6.178  -5.970   6.015
  270   2HB   GLU  38          1HB       GLU  38   5.160  -6.636   7.286
  271   1HG   GLU  38          2HG       GLU  38   7.129  -6.500   8.815
  272   2HG   GLU  38          1HG       GLU  38   7.976  -5.625   7.541
  273    H    ALA  39           H        ALA  39   6.377  -8.130   4.087
  274    HA   ALA  39           HA       ALA  39   3.802  -9.438   4.319
  275   1HB   ALA  39          1HB       ALA  39   3.940  -7.463   2.891
  276   2HB   ALA  39          2HB       ALA  39   3.455  -8.898   1.984
  277   3HB   ALA  39          3HB       ALA  39   5.110  -8.299   1.871
  278    H    GLY  40           H        GLY  40   6.999 -10.258   3.771
  279   1HA   GLY  40          2HA       GLY  40   7.940 -12.327   3.300
  280   2HA   GLY  40          1HA       GLY  40   6.314 -12.969   3.062
  281    H    GLY  41           H        GLY  41   7.148 -10.066   1.527
  282   1HA   GLY  41          2HA       GLY  41   7.458  -9.457  -0.621
  283   2HA   GLY  41          1HA       GLY  41   8.074 -11.075  -0.957
  284    H    ASN  42           H        ASN  42   4.959  -9.599  -0.053
  285    HA   ASN  42           HA       ASN  42   3.724 -10.884  -2.357
  286   1HB   ASN  42          2HB       ASN  42   3.531 -12.307  -0.175
  287   2HB   ASN  42          1HB       ASN  42   2.375 -11.075   0.323
  288   1HD2  ASN  42          1HD2      ASN  42   0.411 -10.902  -0.776
  289   2HD2  ASN  42          2HD2      ASN  42  -0.175 -12.153  -1.826
  290    H    TRP  43           H        TRP  43   3.486  -8.865  -3.233
  291    HA   TRP  43           HA       TRP  43   2.634  -6.600  -1.746
  292   1HB   TRP  43          2HB       TRP  43   2.700  -6.991  -4.737
  293   2HB   TRP  43          1HB       TRP  43   2.585  -5.449  -3.896
  294    HD1  TRP  43           HD       TRP  43   5.079  -8.437  -3.935
  295    HE1  TRP  43           1HE      TRP  43   7.477  -7.477  -3.907
  296    HE3  TRP  43           3HE      TRP  43   3.946  -3.468  -3.714
  297    HZ2  TRP  43           2HZ      TRP  43   8.719  -4.929  -3.790
  298    HZ3  TRP  43           3HZ      TRP  43   5.776  -1.834  -3.666
  299    HH2  TRP  43           HH       TRP  43   8.116  -2.569  -3.722
  300    H    ALA  44           H        ALA  44   0.968  -9.188  -3.055
  301    HA   ALA  44           HA       ALA  44  -1.507  -7.651  -3.428
  302   1HB   ALA  44          1HB       ALA  44  -0.814  -9.082  -5.295
  303   2HB   ALA  44          2HB       ALA  44  -2.361  -9.594  -4.622
  304   3HB   ALA  44          3HB       ALA  44  -0.892 -10.490  -4.238
  305    H    ILE  45           H        ILE  45  -0.162  -8.755  -0.849
  306    HA   ILE  45           HA       ILE  45  -2.115 -10.624   0.120
  307    HB   ILE  45           HB       ILE  45   0.484 -10.379   0.687
  308   1HG1  ILE  45          2HG1      ILE  45  -1.596 -11.250   2.694
  309   2HG1  ILE  45          1HG1      ILE  45  -1.036 -12.203   1.324
  310   1HG2  ILE  45          1HG2      ILE  45   0.819  -9.415   2.911
  311   2HG2  ILE  45          2HG2      ILE  45  -0.851  -8.846   2.918
  312   3HG2  ILE  45          3HG2      ILE  45   0.298  -8.195   1.749
  313   1HD1  ILE  45          1HD1      ILE  45   0.050 -12.943   3.342
  314   2HD1  ILE  45          2HD1      ILE  45   0.616 -11.306   3.670
  315   3HD1  ILE  45          3HD1      ILE  45   1.233 -12.186   2.273
  316    H    ASN  46           H        ASN  46  -3.637 -10.223   1.693
  317    HA   ASN  46           HA       ASN  46  -3.854  -7.638   2.944
  318   1HB   ASN  46          2HB       ASN  46  -4.862  -7.231   0.677
  319   2HB   ASN  46          1HB       ASN  46  -6.056  -8.473   1.033
  320   1HD2  ASN  46          1HD2      ASN  46  -6.192  -5.521   0.521
  321   2HD2  ASN  46          2HD2      ASN  46  -7.128  -4.901   1.837
  322    H    THR  47           H        THR  47  -3.765  -8.796   4.823
  323    HA   THR  47           HA       THR  47  -5.549 -10.962   5.370
  324    HB   THR  47           HB       THR  47  -4.666 -10.737   7.715
  325    HG1  THR  47           1HG      THR  47  -3.287  -9.139   8.193
  326   1HG2  THR  47          1HG2      THR  47  -2.607 -10.888   5.508
  327   2HG2  THR  47          2HG2      THR  47  -3.592 -12.227   6.097
  328   3HG2  THR  47          3HG2      THR  47  -2.389 -11.485   7.154
  329    H    GLY  48           H        GLY  48  -5.621  -7.547   5.692
  330   1HA   GLY  48          2HA       GLY  48  -7.653  -6.354   6.000
  331   2HA   GLY  48          1HA       GLY  48  -8.284  -7.729   6.900
  332    H    ASN  49           H        ASN  49  -5.058  -6.670   7.522
  333    HA   ASN  49           HA       ASN  49  -5.836  -5.954  10.216
  334   1HB   ASN  49          2HB       ASN  49  -3.392  -5.735  10.642
  335   2HB   ASN  49          1HB       ASN  49  -3.860  -7.310  10.015
  336   1HD2  ASN  49          1HD2      ASN  49  -1.713  -7.658   9.371
  337   2HD2  ASN  49          2HD2      ASN  49  -1.064  -6.908   7.954
  338    H    GLY  50           H        GLY  50  -5.989  -4.279   7.509
  339   1HA   GLY  50          2HA       GLY  50  -6.585  -1.993   7.453
  340   2HA   GLY  50          1HA       GLY  50  -5.620  -1.737   8.901
  341    H    TYR  51           H        TYR  51  -3.667  -3.609   7.265
  342    HA   TYR  51           HA       TYR  51  -2.467  -1.416   5.720
  343   1HB   TYR  51          2HB       TYR  51  -0.742  -3.634   6.777
  344   2HB   TYR  51          1HB       TYR  51  -0.310  -1.996   6.359
  345    HD1  TYR  51           1HD      TYR  51  -2.832  -1.039   8.221
  346    HD2  TYR  51           2HD      TYR  51   0.716  -3.331   8.733
  347    HE1  TYR  51           1HE      TYR  51  -2.776  -0.427  10.612
  348    HE2  TYR  51           2HE      TYR  51   0.771  -2.740  11.119
  349    HH   TYR  51           HH       TYR  51  -0.062  -1.022  12.611
  350    H    TYR  52           H        TYR  52  -1.203  -2.251   3.855
  351    HA   TYR  52           HA       TYR  52  -2.627  -4.621   2.870
  352   1HB   TYR  52          2HB       TYR  52  -1.980  -2.147   1.275
  353   2HB   TYR  52          1HB       TYR  52  -2.930  -3.538   0.740
  354    HD1  TYR  52           1HD      TYR  52  -3.086  -0.329   2.193
  355    HD2  TYR  52           2HD      TYR  52  -4.983  -4.127   2.257
  356    HE1  TYR  52           1HE      TYR  52  -5.099   0.692   3.162
  357    HE2  TYR  52           2HE      TYR  52  -7.014  -3.113   3.188
  358    HH   TYR  52           HH       TYR  52  -7.566   0.185   3.219
  359    H    GLY  53           H        GLY  53  -1.680  -5.484   0.816
  360   1HA   GLY  53          2HA       GLY  53   0.673  -6.720   1.612
  361   2HA   GLY  53          1HA       GLY  53  -0.039  -6.836   0.015
  362    H    GLY  54           H        GLY  54   2.673  -6.913   0.583
  363   1HA   GLY  54          2HA       GLY  54   4.408  -6.086  -0.801
  364   2HA   GLY  54          1HA       GLY  54   3.547  -4.555  -0.912
  365    H    VAL  55           H        VAL  55   4.140  -2.941   0.394
  366    HA   VAL  55           HA       VAL  55   6.381  -3.424   2.176
  367    HB   VAL  55           HB       VAL  55   5.084  -0.749   1.714
  368   1HG1  VAL  55          1HG1      VAL  55   7.941  -1.546   2.218
  369   2HG1  VAL  55          2HG1      VAL  55   6.815  -1.009   3.461
  370   3HG1  VAL  55          3HG1      VAL  55   7.290   0.093   2.168
  371   1HG2  VAL  55          1HG2      VAL  55   6.604  -0.422  -0.181
  372   2HG2  VAL  55          2HG2      VAL  55   5.462  -1.731  -0.488
  373   3HG2  VAL  55          3HG2      VAL  55   7.129  -2.100  -0.046
  374    H    GLN  56           H        GLN  56   3.099  -3.461   2.395
  375    HA   GLN  56           HA       GLN  56   1.709  -3.930   4.097
  376   1HB   GLN  56          2HB       GLN  56   3.590  -5.525   4.548
  377   2HB   GLN  56          1HB       GLN  56   4.211  -4.370   5.719
  378   1HG   GLN  56          2HG       GLN  56   3.041  -5.938   6.980
  379   2HG   GLN  56          1HG       GLN  56   1.965  -4.552   6.872
  380   1HE2  GLN  56          1HE2      GLN  56   1.191  -5.194   4.096
  381   2HE2  GLN  56          2HE2      GLN  56   0.116  -6.540   4.227
  382    H    PHE  57           H        PHE  57   1.894  -1.252   3.792
  383    HA   PHE  57           HA       PHE  57   1.816  -0.389   6.592
  384   1HB   PHE  57          2HB       PHE  57   2.265   1.916   5.871
  385   2HB   PHE  57          1HB       PHE  57   3.573   0.803   5.527
  386    HD1  PHE  57           1HD      PHE  57   3.627  -0.136   3.063
  387    HD2  PHE  57           2HD      PHE  57   1.594   3.406   4.266
  388    HE1  PHE  57           1HE      PHE  57   3.771   0.723   0.766
  389    HE2  PHE  57           2HE      PHE  57   1.727   4.264   1.968
  390    HZ   PHE  57           HZ       PHE  57   2.824   2.929   0.211
  391    H    ASP  58           H        ASP  58   0.309   1.542   6.919
  392    HA   ASP  58           HA       ASP  58  -2.178   0.193   6.502
  393   1HB   ASP  58          2HB       ASP  58  -3.106   1.710   8.123
  394   2HB   ASP  58          1HB       ASP  58  -1.563   1.094   8.700
  395    H    GLN  59           H        GLN  59  -4.164   1.281   6.131
  396    HA   GLN  59           HA       GLN  59  -4.342   2.422   3.607
  397   1HB   GLN  59          2HB       GLN  59  -6.104   1.129   4.590
  398   2HB   GLN  59          1HB       GLN  59  -6.240   2.248   5.936
  399   1HG   GLN  59          2HG       GLN  59  -8.080   2.659   4.550
  400   2HG   GLN  59          1HG       GLN  59  -6.960   3.987   4.284
  401   1HE2  GLN  59          1HE2      GLN  59  -5.187   2.564   2.521
  402   2HE2  GLN  59          2HE2      GLN  59  -6.034   2.331   1.028
  403    H    GLY  60           H        GLY  60  -4.378   3.887   6.800
  404   1HA   GLY  60          2HA       GLY  60  -5.279   6.450   5.989
  405   2HA   GLY  60          1HA       GLY  60  -4.458   6.081   7.498
  406    H    THR  61           H        THR  61  -2.065   5.157   6.645
  407    HA   THR  61           HA       THR  61  -0.617   7.477   5.941
  408    HB   THR  61           HB       THR  61   0.176   4.595   5.930
  409    HG1  THR  61           1HG      THR  61   0.019   4.870   8.012
  410   1HG2  THR  61          1HG2      THR  61   1.924   7.046   5.969
  411   2HG2  THR  61          2HG2      THR  61   1.736   5.940   4.610
  412   3HG2  THR  61          3HG2      THR  61   2.479   5.379   6.108
  413    H    TRP  62           H        TRP  62  -1.514   4.592   4.102
  414    HA   TRP  62           HA       TRP  62  -0.293   5.212   1.675
  415   1HB   TRP  62          2HB       TRP  62  -1.315   3.046   2.177
  416   2HB   TRP  62          1HB       TRP  62  -2.901   3.808   2.269
  417    HD1  TRP  62           HD       TRP  62  -4.103   4.428  -0.004
  418    HE1  TRP  62           1HE      TRP  62  -3.725   3.666  -2.427
  419    HE3  TRP  62           3HE      TRP  62   0.525   2.348   0.528
  420    HZ2  TRP  62           2HZ      TRP  62  -1.693   2.346  -3.965
  421    HZ3  TRP  62           3HZ      TRP  62   1.622   1.357  -1.429
  422    HH2  TRP  62           HH       TRP  62   0.550   1.347  -3.621
  423    H    GLU  63           H        GLU  63  -3.492   6.004   2.926
  424    HA   GLU  63           HA       GLU  63  -4.414   7.375   0.639
  425   1HB   GLU  63          2HB       GLU  63  -5.912   6.441   2.324
  426   2HB   GLU  63          1HB       GLU  63  -5.275   7.542   3.537
  427   1HG   GLU  63          2HG       GLU  63  -6.106   9.419   2.058
  428   2HG   GLU  63          1HG       GLU  63  -6.974   8.181   1.150
  429    H    ALA  64           H        ALA  64  -2.605   8.317   3.478
  430    HA   ALA  64           HA       ALA  64  -3.046  11.115   3.315
  431   1HB   ALA  64          1HB       ALA  64  -2.262  10.039   5.366
  432   2HB   ALA  64          2HB       ALA  64  -1.166  11.323   4.858
  433   3HB   ALA  64          3HB       ALA  64  -0.739   9.635   4.576
  434    H    ASN  65           H        ASN  65  -0.424   9.020   2.134
  435    HA   ASN  65           HA       ASN  65   0.955  11.161   0.841
  436   1HB   ASN  65          2HB       ASN  65   1.159   8.211   0.227
  437   2HB   ASN  65          1HB       ASN  65   2.376   9.452  -0.062
  438   1HD2  ASN  65          1HD2      ASN  65   2.030  10.789   2.467
  439   2HD2  ASN  65          2HD2      ASN  65   2.688   9.743   3.679
  440    H    GLY  66           H        GLY  66  -1.817   9.355   0.111
  441   1HA   GLY  66          2HA       GLY  66  -3.337   9.976  -1.573
  442   2HA   GLY  66          1HA       GLY  66  -2.017  10.734  -2.459
  443    H    GLY  67           H        GLY  67  -2.509   7.440  -1.172
  444   1HA   GLY  67          2HA       GLY  67  -1.132   6.385  -3.468
  445   2HA   GLY  67          1HA       GLY  67  -1.732   5.476  -2.091
  446    H    LEU  68           H        LEU  68  -4.407   6.906  -2.595
  447    HA   LEU  68           HA       LEU  68  -5.628   4.698  -3.691
  448   1HB   LEU  68          2HB       LEU  68  -6.510   7.488  -3.225
  449   2HB   LEU  68          1HB       LEU  68  -7.614   6.306  -3.897
  450    HG   LEU  68           HG       LEU  68  -7.031   4.906  -1.817
  451   1HD1  LEU  68          1HD1      LEU  68  -6.131   7.615  -0.883
  452   2HD1  LEU  68          2HD1      LEU  68  -5.140   6.165  -1.039
  453   3HD1  LEU  68          3HD1      LEU  68  -6.432   6.224   0.157
  454   1HD2  LEU  68          1HD2      LEU  68  -8.766   6.028  -0.509
  455   2HD2  LEU  68          2HD2      LEU  68  -9.210   5.904  -2.209
  456   3HD2  LEU  68          3HD2      LEU  68  -8.639   7.438  -1.559
  457    H    ARG  69           H        ARG  69  -4.500   7.609  -5.244
  458    HA   ARG  69           HA       ARG  69  -5.802   7.270  -7.723
  459   1HB   ARG  69          2HB       ARG  69  -4.110   8.799  -8.595
  460   2HB   ARG  69          1HB       ARG  69  -4.731   9.366  -7.051
  461   1HG   ARG  69          2HG       ARG  69  -2.729   8.235  -5.995
  462   2HG   ARG  69          1HG       ARG  69  -2.087   8.088  -7.630
  463   1HD   ARG  69          2HD       ARG  69  -2.863  10.667  -6.264
  464   2HD   ARG  69          1HD       ARG  69  -1.218  10.082  -6.500
  465    HE   ARG  69           HE       ARG  69  -1.872  10.201  -8.994
  466   1HH1  ARG  69          1HH1      ARG  69  -2.916  12.401  -6.477
  467   2HH1  ARG  69          2HH1      ARG  69  -3.166  13.735  -7.558
  468   1HH2  ARG  69          1HH2      ARG  69  -2.164  11.982 -10.434
  469   2HH2  ARG  69          2HH2      ARG  69  -2.749  13.500  -9.800
  470    H    TYR  70           H        TYR  70  -2.961   5.887  -6.287
  471    HA   TYR  70           HA       TYR  70  -1.970   4.602  -8.668
  472   1HB   TYR  70          2HB       TYR  70  -1.519   4.163  -5.700
  473   2HB   TYR  70          1HB       TYR  70  -0.545   3.412  -6.977
  474    HD1  TYR  70           1HD      TYR  70  -1.378   6.530  -5.252
  475    HD2  TYR  70           2HD      TYR  70   1.204   4.680  -8.071
  476    HE1  TYR  70           1HE      TYR  70   0.112   8.473  -5.143
  477    HE2  TYR  70           2HE      TYR  70   2.712   6.619  -7.970
  478    HH   TYR  70           HH       TYR  70   2.670   8.955  -7.381
  479    H    ALA  71           H        ALA  71  -3.934   4.066  -5.935
  480    HA   ALA  71           HA       ALA  71  -5.828   2.329  -6.683
  481   1HB   ALA  71          1HB       ALA  71  -5.078   0.086  -5.996
  482   2HB   ALA  71          2HB       ALA  71  -3.443   0.705  -5.757
  483   3HB   ALA  71          3HB       ALA  71  -4.146   0.668  -7.376
  484    HA   PRO  72           HA       PRO  72  -6.614   3.781  -2.613
  485   1HB   PRO  72          2HB       PRO  72  -8.583   1.680  -2.318
  486   2HB   PRO  72          1HB       PRO  72  -8.784   3.424  -2.315
  487   1HG   PRO  72          2HG       PRO  72  -9.552   1.785  -4.360
  488   2HG   PRO  72          1HG       PRO  72  -9.188   3.513  -4.534
  489   1HD   PRO  72          2HD       PRO  72  -7.648   1.174  -5.410
  490   2HD   PRO  72          1HD       PRO  72  -7.574   2.858  -5.962
  491    H    ARG  73           H        ARG  73  -5.375   0.723  -3.226
  492    HA   ARG  73           HA       ARG  73  -4.413   0.583  -0.515
  493   1HB   ARG  73          2HB       ARG  73  -5.188  -1.643  -0.031
  494   2HB   ARG  73          1HB       ARG  73  -6.566  -0.612  -0.379
  495   1HG   ARG  73          2HG       ARG  73  -6.281  -1.578  -2.795
  496   2HG   ARG  73          1HG       ARG  73  -5.443  -2.881  -1.936
  497   1HD   ARG  73          2HD       ARG  73  -7.692  -2.437  -0.407
  498   2HD   ARG  73          1HD       ARG  73  -8.286  -2.217  -2.047
  499    HE   ARG  73           HE       ARG  73  -6.780  -4.582  -1.964
  500   1HH1  ARG  73          1HH1      ARG  73  -9.733  -3.259  -0.614
  501   2HH1  ARG  73          2HH1      ARG  73 -10.550  -4.794  -0.548
  502   1HH2  ARG  73          1HH2      ARG  73  -7.842  -6.604  -1.877
  503   2HH2  ARG  73          2HH2      ARG  73  -9.466  -6.707  -1.259
  504    H    ALA  74           H        ALA  74  -2.592  -0.543  -0.294
  505    HA   ALA  74           HA       ALA  74  -0.815  -0.570  -2.403
  506   1HB   ALA  74          1HB       ALA  74   0.758  -1.526  -0.869
  507   2HB   ALA  74          2HB       ALA  74  -0.544  -2.071   0.186
  508   3HB   ALA  74          3HB       ALA  74  -0.240  -0.346  -0.018
  509    H    ASP  75           H        ASP  75  -2.985  -3.097  -1.437
  510    HA   ASP  75           HA       ASP  75  -1.409  -5.146  -2.747
  511   1HB   ASP  75          2HB       ASP  75  -3.118  -6.713  -2.050
  512   2HB   ASP  75          1HB       ASP  75  -2.627  -5.708  -0.693
  513    H    LEU  76           H        LEU  76  -3.628  -2.848  -3.616
  514    HA   LEU  76           HA       LEU  76  -4.486  -4.327  -5.995
  515   1HB   LEU  76          2HB       LEU  76  -6.225  -3.136  -4.729
  516   2HB   LEU  76          1HB       LEU  76  -5.344  -1.633  -4.927
  517    HG   LEU  76           HG       LEU  76  -5.695  -1.743  -7.356
  518   1HD1  LEU  76          1HD1      LEU  76  -7.258  -3.374  -8.291
  519   2HD1  LEU  76          2HD1      LEU  76  -7.355  -4.180  -6.726
  520   3HD1  LEU  76          3HD1      LEU  76  -5.832  -4.159  -7.614
  521   1HD2  LEU  76          1HD2      LEU  76  -7.262  -0.516  -5.965
  522   2HD2  LEU  76          2HD2      LEU  76  -8.217  -1.979  -5.722
  523   3HD2  LEU  76          3HD2      LEU  76  -8.093  -1.264  -7.330
  524    H    ALA  77           H        ALA  77  -2.593  -1.643  -4.858
  525    HA   ALA  77           HA       ALA  77  -1.732  -0.787  -7.443
  526   1HB   ALA  77          1HB       ALA  77  -1.791   0.768  -5.565
  527   2HB   ALA  77          2HB       ALA  77  -0.149   0.593  -6.179
  528   3HB   ALA  77          3HB       ALA  77  -0.625  -0.224  -4.692
  529    H    THR  78           H        THR  78   0.524  -0.889  -8.065
  530    HA   THR  78           HA       THR  78   1.598  -3.555  -7.512
  531    HB   THR  78           HB       THR  78   2.887  -3.142  -9.633
  532    HG1  THR  78           1HG      THR  78   1.188  -0.825  -9.700
  533   1HG2  THR  78          1HG2      THR  78   0.864  -3.347 -11.082
  534   2HG2  THR  78          2HG2      THR  78  -0.125  -2.941  -9.673
  535   3HG2  THR  78          3HG2      THR  78   0.840  -4.418  -9.679
  536    H    ARG  79           H        ARG  79   4.169  -3.471  -8.001
  537    HA   ARG  79           HA       ARG  79   5.415  -2.468  -5.763
  538   1HB   ARG  79          2HB       ARG  79   6.556  -3.039  -8.495
  539   2HB   ARG  79          1HB       ARG  79   7.544  -2.664  -7.091
  540   1HG   ARG  79          2HG       ARG  79   6.600  -4.624  -5.944
  541   2HG   ARG  79          1HG       ARG  79   5.702  -5.013  -7.413
  542   1HD   ARG  79          2HD       ARG  79   7.485  -5.923  -8.370
  543   2HD   ARG  79          1HD       ARG  79   8.506  -4.553  -7.947
  544    HE   ARG  79           HE       ARG  79   8.798  -5.633  -5.749
  545   1HH1  ARG  79          1HH1      ARG  79   7.653  -7.545  -8.461
  546   2HH1  ARG  79          2HH1      ARG  79   8.360  -9.024  -7.883
  547   1HH2  ARG  79          1HH2      ARG  79   9.764  -7.600  -4.999
  548   2HH2  ARG  79          2HH2      ARG  79   9.562  -9.062  -5.933
  549    H    GLU  80           H        GLU  80   5.449  -1.104  -9.010
  550    HA   GLU  80           HA       GLU  80   6.974   1.158  -8.436
  551   1HB   GLU  80          2HB       GLU  80   5.815   2.086 -10.535
  552   2HB   GLU  80          1HB       GLU  80   6.769   0.620 -10.685
  553   1HG   GLU  80          2HG       GLU  80   3.865   0.329 -10.180
  554   2HG   GLU  80          1HG       GLU  80   4.385   0.859 -11.779
  555    H    GLU  81           H        GLU  81   3.478   0.697  -8.285
  556    HA   GLU  81           HA       GLU  81   2.815   3.379  -7.668
  557   1HB   GLU  81          2HB       GLU  81   1.482   0.740  -7.660
  558   2HB   GLU  81          1HB       GLU  81   0.770   1.981  -6.636
  559   1HG   GLU  81          2HG       GLU  81   0.076   3.199  -8.348
  560   2HG   GLU  81          1HG       GLU  81   1.467   2.831  -9.336
  561    H    GLN  82           H        GLN  82   3.145   0.486  -5.677
  562    HA   GLN  82           HA       GLN  82   2.517   1.759  -3.248
  563   1HB   GLN  82          2HB       GLN  82   2.210  -0.580  -3.419
  564   2HB   GLN  82          1HB       GLN  82   3.866  -0.835  -3.950
  565   1HG   GLN  82          2HG       GLN  82   4.721  -0.614  -1.838
  566   2HG   GLN  82          1HG       GLN  82   3.347   0.332  -1.268
  567   1HE2  GLN  82          1HE2      GLN  82   2.851  -2.555  -3.135
  568   2HE2  GLN  82          2HE2      GLN  82   2.239  -3.517  -1.823
  569    H    ILE  83           H        ILE  83   5.517   1.165  -4.953
  570    HA   ILE  83           HA       ILE  83   7.308   2.043  -2.987
  571    HB   ILE  83           HB       ILE  83   7.399   1.941  -5.984
  572   1HG1  ILE  83          2HG1      ILE  83   9.281   0.704  -3.980
  573   2HG1  ILE  83          1HG1      ILE  83   7.760  -0.064  -4.416
  574   1HG2  ILE  83          1HG2      ILE  83   9.543   3.136  -4.237
  575   2HG2  ILE  83          2HG2      ILE  83   8.583   3.981  -5.448
  576   3HG2  ILE  83          3HG2      ILE  83   9.725   2.731  -5.942
  577   1HD1  ILE  83          1HD1      ILE  83   8.482  -0.170  -6.744
  578   2HD1  ILE  83          2HD1      ILE  83   9.623  -0.985  -5.676
  579   3HD1  ILE  83          3HD1      ILE  83   9.997   0.618  -6.310
  580    H    ALA  84           H        ALA  84   5.488   3.800  -5.485
  581    HA   ALA  84           HA       ALA  84   6.718   6.298  -5.042
  582   1HB   ALA  84          1HB       ALA  84   4.890   7.224  -6.345
  583   2HB   ALA  84          2HB       ALA  84   3.987   5.718  -6.177
  584   3HB   ALA  84          3HB       ALA  84   5.499   5.743  -7.086
  585    H    VAL  85           H        VAL  85   3.780   4.843  -3.701
  586    HA   VAL  85           HA       VAL  85   2.958   7.132  -2.237
  587    HB   VAL  85           HB       VAL  85   2.402   4.230  -1.668
  588   1HG1  VAL  85          1HG1      VAL  85   1.824   5.631   0.211
  589   2HG1  VAL  85          2HG1      VAL  85   0.347   5.100  -0.593
  590   3HG1  VAL  85          3HG1      VAL  85   0.945   6.740  -0.842
  591   1HG2  VAL  85          1HG2      VAL  85   1.806   4.805  -3.955
  592   2HG2  VAL  85          2HG2      VAL  85   0.862   6.180  -3.376
  593   3HG2  VAL  85          3HG2      VAL  85   0.359   4.535  -2.979
  594    H    ALA  86           H        ALA  86   4.699   4.177  -1.288
  595    HA   ALA  86           HA       ALA  86   5.076   4.899   1.406
  596   1HB   ALA  86          1HB       ALA  86   5.245   2.599   0.587
  597   2HB   ALA  86          2HB       ALA  86   6.702   3.090   1.454
  598   3HB   ALA  86          3HB       ALA  86   6.703   3.026  -0.308
  599    H    GLU  87           H        GLU  87   6.809   5.594  -1.525
  600    HA   GLU  87           HA       GLU  87   9.213   6.399  -0.207
  601   1HB   GLU  87          2HB       GLU  87  10.084   7.032  -2.298
  602   2HB   GLU  87          1HB       GLU  87   9.087   5.619  -2.595
  603   1HG   GLU  87          2HG       GLU  87   8.481   6.862  -4.337
  604   2HG   GLU  87          1HG       GLU  87   7.287   7.438  -3.178
  605    H    VAL  88           H        VAL  88   6.269   8.064  -1.129
  606    HA   VAL  88           HA       VAL  88   7.077  10.671  -0.457
  607    HB   VAL  88           HB       VAL  88   4.362   9.393   0.062
  608   1HG1  VAL  88          1HG1      VAL  88   4.733  11.413   1.402
  609   2HG1  VAL  88          2HG1      VAL  88   3.509  11.672   0.155
  610   3HG1  VAL  88          3HG1      VAL  88   5.140  12.311  -0.063
  611   1HG2  VAL  88          1HG2      VAL  88   5.299  11.091  -2.258
  612   2HG2  VAL  88          2HG2      VAL  88   3.676  10.441  -2.027
  613   3HG2  VAL  88          3HG2      VAL  88   5.032   9.348  -2.307
  614    H    THR  89           H        THR  89   5.786   8.034   1.518
  615    HA   THR  89           HA       THR  89   5.700   9.464   3.935
  616    HB   THR  89           HB       THR  89   6.142   6.666   4.379
  617    HG1  THR  89           1HG      THR  89   3.957   7.079   2.643
  618   1HG2  THR  89          1HG2      THR  89   3.650   8.350   4.492
  619   2HG2  THR  89          2HG2      THR  89   4.856   8.228   5.770
  620   3HG2  THR  89          3HG2      THR  89   3.915   6.809   5.307
  621    H    ARG  90           H        ARG  90   8.164   7.334   2.539
  622    HA   ARG  90           HA       ARG  90   9.800   7.169   4.836
  623   1HB   ARG  90          2HB       ARG  90  11.446   6.189   3.455
  624   2HB   ARG  90          1HB       ARG  90   9.909   5.703   2.758
  625   1HG   ARG  90          2HG       ARG  90  10.984   6.277   0.845
  626   2HG   ARG  90          1HG       ARG  90  10.341   7.863   1.269
  627   1HD   ARG  90          2HD       ARG  90  12.414   8.630   2.017
  628   2HD   ARG  90          1HD       ARG  90  13.062   6.997   2.189
  629    HE   ARG  90           HE       ARG  90  13.250   6.878  -0.202
  630   1HH1  ARG  90          1HH1      ARG  90  12.605  10.062   1.083
  631   2HH1  ARG  90          2HH1      ARG  90  13.092  10.879  -0.365
  632   1HH2  ARG  90          1HH2      ARG  90  13.917   7.950  -2.098
  633   2HH2  ARG  90          2HH2      ARG  90  13.842   9.694  -2.165
  634    H    LEU  91           H        LEU  91   9.360   9.471   2.379
  635    HA   LEU  91           HA       LEU  91  11.849  10.839   2.577
  636   1HB   LEU  91          2HB       LEU  91  10.579  10.933   0.559
  637   2HB   LEU  91          1HB       LEU  91   9.162  11.520   1.406
  638    HG   LEU  91           HG       LEU  91  10.371  13.628   1.879
  639   1HD1  LEU  91          1HD1      LEU  91  12.433  12.454   0.010
  640   2HD1  LEU  91          2HD1      LEU  91  12.655  12.790   1.726
  641   3HD1  LEU  91          3HD1      LEU  91  12.406  14.119   0.594
  642   1HD2  LEU  91          1HD2      LEU  91  10.145  14.493  -0.398
  643   2HD2  LEU  91          2HD2      LEU  91   8.814  13.415   0.027
  644   3HD2  LEU  91          3HD2      LEU  91  10.113  12.841  -1.018
  645    H    ARG  92           H        ARG  92   8.865  10.990   4.286
  646    HA   ARG  92           HA       ARG  92   9.363  13.646   5.342
  647   1HB   ARG  92          2HB       ARG  92   7.152  11.850   6.230
  648   2HB   ARG  92          1HB       ARG  92   7.184  13.604   6.146
  649   1HG   ARG  92          2HG       ARG  92   6.790  13.632   3.865
  650   2HG   ARG  92          1HG       ARG  92   7.327  11.961   3.656
  651   1HD   ARG  92          2HD       ARG  92   4.741  13.006   4.713
  652   2HD   ARG  92          1HD       ARG  92   5.042  11.731   3.527
  653    HE   ARG  92           HE       ARG  92   6.107  10.701   5.771
  654   1HH1  ARG  92          1HH1      ARG  92   2.950  12.050   5.013
  655   2HH1  ARG  92          2HH1      ARG  92   2.151  11.213   6.316
  656   1HH2  ARG  92          1HH2      ARG  92   5.018   9.612   7.493
  657   2HH2  ARG  92          2HH2      ARG  92   3.310   9.841   7.706
  658    H    GLN  93           H        GLN  93   9.043  10.327   6.438
  659    HA   GLN  93           HA       GLN  93   9.595  11.178   9.165
  660   1HB   GLN  93          2HB       GLN  93   8.644   9.046   9.829
  661   2HB   GLN  93          1HB       GLN  93   7.569   9.880   8.708
  662   1HG   GLN  93          2HG       GLN  93   8.773   8.471   6.903
  663   2HG   GLN  93          1HG       GLN  93   9.247   7.457   8.265
  664   1HE2  GLN  93          1HE2      GLN  93   7.512   6.936   5.978
  665   2HE2  GLN  93          2HE2      GLN  93   5.999   6.427   6.655
  666    H    GLY  94           H        GLY  94  10.974   9.180   6.624
  667   1HA   GLY  94          2HA       GLY  94  13.265   8.620   6.508
  668   2HA   GLY  94          1HA       GLY  94  13.413   8.988   8.228
  669    H    TRP  95           H        TRP  95  11.016   6.977   6.675
  670    HA   TRP  95           HA       TRP  95  10.557   4.793   6.679
  671   1HB   TRP  95          2HB       TRP  95  13.332   4.177   7.675
  672   2HB   TRP  95          1HB       TRP  95  12.281   3.172   6.677
  673    HD1  TRP  95           HD       TRP  95  14.381   6.394   6.400
  674    HE1  TRP  95           1HE      TRP  95  15.136   6.654   3.978
  675    HE3  TRP  95           3HE      TRP  95  11.861   2.453   4.355
  676    HZ2  TRP  95           2HZ      TRP  95  14.768   5.356   1.545
  677    HZ3  TRP  95           3HZ      TRP  95  12.119   2.035   1.942
  678    HH2  TRP  95           HH       TRP  95  13.542   3.464   0.560
  679    H    GLY  96           H        GLY  96  10.570   6.628   9.068
  680   1HA   GLY  96          2HA       GLY  96  10.900   5.135  11.418
  681   2HA   GLY  96          1HA       GLY  96   9.876   6.552  11.247
  682    H    ALA  97           H        ALA  97   8.196   5.312   9.185
  683    HA   ALA  97           HA       ALA  97   6.383   3.899  10.894
  684   1HB   ALA  97          1HB       ALA  97   5.568   5.364   9.106
  685   2HB   ALA  97          2HB       ALA  97   4.967   3.719   8.915
  686   3HB   ALA  97          3HB       ALA  97   6.289   4.297   7.903
  687    H    TRP  98           H        TRP  98   8.993   3.051   8.865
  688    HA   TRP  98           HA       TRP  98   8.095   0.270   8.696
  689   1HB   TRP  98          2HB       TRP  98  10.127   1.835   7.115
  690   2HB   TRP  98          1HB       TRP  98   9.951   0.082   6.993
  691    HD1  TRP  98           HD       TRP  98   7.600  -0.842   6.038
  692    HE1  TRP  98           1HE      TRP  98   5.899   0.226   4.426
  693    HE3  TRP  98           3HE      TRP  98   9.127   4.042   6.365
  694    HZ2  TRP  98           2HZ      TRP  98   5.297   2.822   3.415
  695    HZ3  TRP  98           3HZ      TRP  98   7.952   5.727   5.056
  696    HH2  TRP  98           HH       TRP  98   6.072   5.136   3.614
  697    HA   PRO  99           HA       PRO  99  10.692  -0.318  12.216
  698   1HB   PRO  99          2HB       PRO  99  10.023  -3.147  11.586
  699   2HB   PRO  99          1HB       PRO  99   9.856  -2.263  13.112
  700   1HG   PRO  99          2HG       PRO  99   7.700  -2.770  11.675
  701   2HG   PRO  99          1HG       PRO  99   7.920  -1.168  12.412
  702   1HD   PRO  99          2HD       PRO  99   8.390  -2.010   9.569
  703   2HD   PRO  99          1HD       PRO  99   7.569  -0.560  10.191
  704    H    VAL 100           H        VAL 100  11.758  -3.124  12.248
  705    HA   VAL 100           HA       VAL 100  14.389  -2.639  11.535
  706    HB   VAL 100           HB       VAL 100  14.649  -5.139  11.582
  707   1HG1  VAL 100          1HG1      VAL 100  14.177  -5.325  13.984
  708   2HG1  VAL 100          2HG1      VAL 100  13.171  -3.877  13.892
  709   3HG1  VAL 100          3HG1      VAL 100  14.906  -3.765  13.592
  710   1HG2  VAL 100          1HG2      VAL 100  12.434  -5.732  10.745
  711   2HG2  VAL 100          2HG2      VAL 100  11.704  -5.075  12.209
  712   3HG2  VAL 100          3HG2      VAL 100  12.753  -6.490  12.305
  713    H    CYS 101           H        CYS 101  11.760  -3.830   9.652
  714    HA   CYS 101           HA       CYS 101  13.058  -5.027   7.521
  715   1HB   CYS 101          2HB       CYS 101  10.513  -3.397   7.407
  716   2HB   CYS 101          1HB       CYS 101  11.027  -4.614   6.238
  717    H    ALA 102           H        ALA 102  12.501  -1.593   8.137
  718    HA   ALA 102           HA       ALA 102  13.318  -0.706   5.554
  719   1HB   ALA 102          1HB       ALA 102  13.472   1.506   6.584
  720   2HB   ALA 102          2HB       ALA 102  13.292   0.775   8.179
  721   3HB   ALA 102          3HB       ALA 102  11.966   0.697   7.018
  722    H    ALA 103           H        ALA 103  14.961  -1.114   8.653
  723    HA   ALA 103           HA       ALA 103  17.461  -0.093   7.819
  724   1HB   ALA 103          1HB       ALA 103  16.873  -2.059  10.031
  725   2HB   ALA 103          2HB       ALA 103  16.823  -0.302  10.181
  726   3HB   ALA 103          3HB       ALA 103  18.353  -1.115   9.843
  727    H    ARG 104           H        ARG 104  16.040  -3.299   7.808
  728    HA   ARG 104           HA       ARG 104  18.377  -4.669   6.919
  729   1HB   ARG 104          2HB       ARG 104  15.494  -5.326   7.253
  730   2HB   ARG 104          1HB       ARG 104  16.434  -6.345   6.177
  731   1HG   ARG 104          2HG       ARG 104  16.373  -7.350   8.337
  732   2HG   ARG 104          1HG       ARG 104  18.009  -6.783   8.025
  733   1HD   ARG 104          2HD       ARG 104  16.008  -5.199   9.626
  734   2HD   ARG 104          1HD       ARG 104  17.086  -6.394  10.352
  735    HE   ARG 104           HE       ARG 104  17.759  -3.751   9.539
  736   1HH1  ARG 104          1HH1      ARG 104  19.042  -6.984   9.896
  737   2HH1  ARG 104          2HH1      ARG 104  20.695  -6.455  10.036
  738   1HH2  ARG 104          1HH2      ARG 104  19.939  -3.040   9.758
  739   2HH2  ARG 104          2HH2      ARG 104  21.201  -4.218   9.930
  740    H    ALA 105           H        ALA 105  16.014  -2.754   5.386
  741    HA   ALA 105           HA       ALA 105  16.394  -3.920   2.743
  742   1HB   ALA 105          1HB       ALA 105  14.705  -1.600   3.647
  743   2HB   ALA 105          2HB       ALA 105  14.166  -3.270   3.488
  744   3HB   ALA 105          3HB       ALA 105  14.667  -2.366   2.061
  745    H    GLY 106           H        GLY 106  17.596  -1.301   4.644
  746   1HA   GLY 106          2HA       GLY 106  19.634  -0.187   3.997
  747   2HA   GLY 106          1HA       GLY 106  19.136  -0.350   2.318
  748    H    ALA 107           H        ALA 107  17.684   0.997   5.282
  749    HA   ALA 107           HA       ALA 107  16.186   2.932   3.887
  750   1HB   ALA 107          1HB       ALA 107  16.889   2.777   6.812
  751   2HB   ALA 107          2HB       ALA 107  15.495   2.021   6.040
  752   3HB   ALA 107          3HB       ALA 107  15.624   3.780   6.101
  753    H    ARG 108           H        ARG 108  16.381   5.150   3.860
  754    HA   ARG 108           HA       ARG 108  17.390   7.160   3.621
  755   1HB   ARG 108          2HB       ARG 108  19.224   6.443   5.876
  756   2HB   ARG 108          1HB       ARG 108  18.428   7.978   5.534
  757   1HG   ARG 108          2HG       ARG 108  16.336   7.165   6.278
  758   2HG   ARG 108          1HG       ARG 108  16.925   5.492   6.329
  759   1HD   ARG 108          2HD       ARG 108  18.574   6.270   8.072
  760   2HD   ARG 108          1HD       ARG 108  17.717   7.808   8.101
  761    HE   ARG 108           HE       ARG 108  16.238   5.336   8.664
  762   1HH1  ARG 108          1HH1      ARG 108  17.484   8.434   9.725
  763   2HH1  ARG 108          2HH1      ARG 108  16.701   8.354  11.276
  764   1HH2  ARG 108          1HH2      ARG 108  15.217   5.234  10.712
  765   2HH2  ARG 108          2HH2      ARG 108  15.411   6.555  11.829
  Start of MODEL   30
    1   1H    ASN   1          1HT       ASN   1  14.583  -9.693 -66.763
    2   2H    ASN   1          2HT       ASN   1  13.460 -10.721 -66.023
    3   3H    ASN   1          3HT       ASN   1  15.100 -10.819 -65.604
    4    HA   ASN   1           HA       ASN   1  13.197  -8.638 -65.014
    5   1HB   ASN   1          2HB       ASN   1  14.913 -10.399 -63.256
    6   2HB   ASN   1          1HB       ASN   1  13.876  -9.095 -62.688
    7   1HD2  ASN   1          1HD2      ASN   1  11.717  -9.431 -62.477
    8   2HD2  ASN   1          2HD2      ASN   1  10.960 -10.965 -62.748
    9    H    VAL   2           H        VAL   2  14.125  -6.845 -65.713
   10    HA   VAL   2           HA       VAL   2  17.000  -6.477 -65.349
   11    HB   VAL   2           HB       VAL   2  15.928  -6.160 -67.604
   12   1HG1  VAL   2          1HG1      VAL   2  14.774  -4.057 -68.057
   13   2HG1  VAL   2          2HG1      VAL   2  14.818  -3.660 -66.339
   14   3HG1  VAL   2          3HG1      VAL   2  13.886  -5.049 -66.899
   15   1HG2  VAL   2          1HG2      VAL   2  18.132  -5.271 -67.131
   16   2HG2  VAL   2          2HG2      VAL   2  17.421  -3.813 -66.438
   17   3HG2  VAL   2          3HG2      VAL   2  17.234  -4.153 -68.159
   18    H    VAL   3           H        VAL   3  14.004  -5.547 -64.058
   19    HA   VAL   3           HA       VAL   3  14.495  -2.983 -63.114
   20    HB   VAL   3           HB       VAL   3  12.821  -5.139 -61.823
   21   1HG1  VAL   3          1HG1      VAL   3  13.267  -3.304 -60.293
   22   2HG1  VAL   3          2HG1      VAL   3  11.581  -3.279 -60.806
   23   3HG1  VAL   3          3HG1      VAL   3  12.733  -2.139 -61.505
   24   1HG2  VAL   3          1HG2      VAL   3  12.040  -3.018 -63.818
   25   2HG2  VAL   3          2HG2      VAL   3  10.941  -4.152 -63.030
   26   3HG2  VAL   3          3HG2      VAL   3  12.177  -4.746 -64.141
   27    H    VAL   4           H        VAL   4  16.106  -2.350 -61.812
   28    HA   VAL   4           HA       VAL   4  17.561  -4.141 -60.141
   29    HB   VAL   4           HB       VAL   4  17.513  -1.149 -59.850
   30   1HG1  VAL   4          1HG1      VAL   4  19.830  -1.442 -59.128
   31   2HG1  VAL   4          2HG1      VAL   4  19.671  -3.184 -59.345
   32   3HG1  VAL   4          3HG1      VAL   4  18.708  -2.358 -58.121
   33   1HG2  VAL   4          1HG2      VAL   4  17.825  -1.638 -62.218
   34   2HG2  VAL   4          2HG2      VAL   4  19.139  -2.748 -61.825
   35   3HG2  VAL   4          3HG2      VAL   4  19.316  -1.022 -61.508
   36    H    THR   5           H        THR   5  17.459  -4.395 -57.949
   37    HA   THR   5           HA       THR   5  14.852  -3.911 -56.802
   38    HB   THR   5           HB       THR   5  15.727  -5.278 -54.888
   39    HG1  THR   5           1HG      THR   5  17.973  -5.679 -56.609
   40   1HG2  THR   5          1HG2      THR   5  16.002  -6.521 -57.628
   41   2HG2  THR   5          2HG2      THR   5  14.492  -6.305 -56.742
   42   3HG2  THR   5          3HG2      THR   5  15.733  -7.391 -56.119
   43    HA   PRO   6           HA       PRO   6  16.131  -0.178 -54.796
   44   1HB   PRO   6          2HB       PRO   6  13.959   0.027 -53.159
   45   2HB   PRO   6          1HB       PRO   6  13.932   0.466 -54.875
   46   1HG   PRO   6          2HG       PRO   6  13.102  -2.095 -53.567
   47   2HG   PRO   6          1HG       PRO   6  12.227  -1.134 -54.779
   48   1HD   PRO   6          2HD       PRO   6  13.616  -3.284 -55.513
   49   2HD   PRO   6          1HD       PRO   6  13.653  -1.813 -56.502
   50    H    ALA   7           H        ALA   7  17.370   0.091 -53.236
   51    HA   ALA   7           HA       ALA   7  17.127  -1.370 -50.722
   52   1HB   ALA   7          1HB       ALA   7  19.685  -1.257 -52.324
   53   2HB   ALA   7          2HB       ALA   7  18.688  -2.691 -52.068
   54   3HB   ALA   7          3HB       ALA   7  19.514  -1.934 -50.706
   55    H    HIS   8           H        HIS   8  19.412  -0.516 -49.503
   56    HA   HIS   8           HA       HIS   8  20.200   1.184 -48.244
   57   1HB   HIS   8          2HB       HIS   8  20.656   2.280 -50.437
   58   2HB   HIS   8          1HB       HIS   8  19.074   3.042 -50.344
   59    HD1  HIS   8           1HD      HIS   8  18.987   5.266 -49.151
   60    HD2  HIS   8           2HD      HIS   8  22.442   3.108 -48.309
   61    HE1  HIS   8           1HE      HIS   8  20.476   6.798 -47.790
   62    H    GLU   9           H        GLU   9  16.996   0.713 -49.048
   63    HA   GLU   9           HA       GLU   9  15.992   2.725 -47.195
   64   1HB   GLU   9          2HB       GLU   9  13.774   2.082 -47.903
   65   2HB   GLU   9          1HB       GLU   9  14.777   2.322 -49.324
   66   1HG   GLU   9          2HG       GLU   9  14.997  -0.034 -49.646
   67   2HG   GLU   9          1HG       GLU   9  14.198  -0.363 -48.109
   68    H    ALA  10           H        ALA  10  15.383   2.318 -45.184
   69    HA   ALA  10           HA       ALA  10  14.668  -0.353 -44.343
   70   1HB   ALA  10          1HB       ALA  10  16.234  -0.359 -42.444
   71   2HB   ALA  10          2HB       ALA  10  16.955   1.134 -43.046
   72   3HB   ALA  10          3HB       ALA  10  17.088  -0.350 -43.987
   73    H    VAL  11           H        VAL  11  12.765   1.043 -44.463
   74    HA   VAL  11           HA       VAL  11  12.362   3.171 -42.665
   75    HB   VAL  11           HB       VAL  11  10.321   1.395 -43.948
   76   1HG1  VAL  11          1HG1      VAL  11   9.371   2.586 -42.072
   77   2HG1  VAL  11          2HG1      VAL  11   8.768   3.267 -43.582
   78   3HG1  VAL  11          3HG1      VAL  11  10.030   4.104 -42.679
   79   1HG2  VAL  11          1HG2      VAL  11  11.470   4.032 -44.835
   80   2HG2  VAL  11          2HG2      VAL  11  10.112   3.209 -45.604
   81   3HG2  VAL  11          3HG2      VAL  11  11.712   2.466 -45.614
   82    H    VAL  12           H        VAL  12  11.078  -0.124 -42.607
   83    HA   VAL  12           HA       VAL  12   9.917  -1.170 -40.948
   84    HB   VAL  12           HB       VAL  12  11.982  -2.270 -41.149
   85   1HG1  VAL  12          1HG1      VAL  12  13.506  -0.407 -40.835
   86   2HG1  VAL  12          2HG1      VAL  12  13.953  -1.756 -39.788
   87   3HG1  VAL  12          3HG1      VAL  12  13.111  -0.357 -39.117
   88   1HG2  VAL  12          1HG2      VAL  12  12.216  -3.278 -38.919
   89   2HG2  VAL  12          2HG2      VAL  12  10.533  -3.087 -39.411
   90   3HG2  VAL  12          3HG2      VAL  12  11.243  -1.965 -38.252
   91    H    ARG  13           H        ARG  13   8.626   0.479 -40.243
   92    HA   ARG  13           HA       ARG  13   9.393   2.017 -37.936
   93   1HB   ARG  13          2HB       ARG  13   7.121   2.044 -39.843
   94   2HB   ARG  13          1HB       ARG  13   6.936   2.775 -38.263
   95   1HG   ARG  13          2HG       ARG  13   8.521   4.419 -38.689
   96   2HG   ARG  13          1HG       ARG  13   9.244   3.502 -40.014
   97   1HD   ARG  13          2HD       ARG  13   7.783   5.523 -40.606
   98   2HD   ARG  13          1HD       ARG  13   7.505   4.018 -41.479
   99    HE   ARG  13           HE       ARG  13   5.821   4.192 -39.193
  100   1HH1  ARG  13          1HH1      ARG  13   6.236   5.514 -42.413
  101   2HH1  ARG  13          2HH1      ARG  13   4.534   5.716 -42.689
  102   1HH2  ARG  13          1HH2      ARG  13   3.592   4.488 -39.527
  103   2HH2  ARG  13          2HH2      ARG  13   3.014   5.123 -41.041
  104    H    VAL  14           H        VAL  14   9.433   0.709 -36.256
  105    HA   VAL  14           HA       VAL  14   6.942  -0.599 -35.485
  106    HB   VAL  14           HB       VAL  14   9.601  -1.323 -34.334
  107   1HG1  VAL  14          1HG1      VAL  14   7.623  -2.073 -33.138
  108   2HG1  VAL  14          2HG1      VAL  14   8.506  -3.443 -33.810
  109   3HG1  VAL  14          3HG1      VAL  14   7.033  -2.873 -34.595
  110   1HG2  VAL  14          1HG2      VAL  14   9.872  -1.651 -36.722
  111   2HG2  VAL  14          2HG2      VAL  14   8.370  -2.574 -36.785
  112   3HG2  VAL  14          3HG2      VAL  14   9.761  -3.209 -35.906
  113    H    GLY  15           H        GLY  15   6.531  -0.530 -33.224
  114   1HA   GLY  15          2HA       GLY  15   7.885   1.030 -31.402
  115   2HA   GLY  15          1HA       GLY  15   6.709   2.053 -32.207
  116    H    THR  16           H        THR  16   7.126  -0.866 -30.319
  117    HA   THR  16           HA       THR  16   4.356  -1.045 -29.642
  118    HB   THR  16           HB       THR  16   6.651  -2.401 -28.244
  119    HG1  THR  16           1HG      THR  16   5.265  -3.319 -30.578
  120   1HG2  THR  16          1HG2      THR  16   4.455  -2.619 -27.208
  121   2HG2  THR  16          2HG2      THR  16   4.990  -4.160 -27.877
  122   3HG2  THR  16          3HG2      THR  16   3.786  -3.196 -28.732
  123    H    LYS  17           H        LYS  17   7.326  -0.042 -28.163
  124    HA   LYS  17           HA       LYS  17   7.832   0.893 -26.116
  125   1HB   LYS  17          2HB       LYS  17   5.929   2.741 -27.510
  126   2HB   LYS  17          1HB       LYS  17   6.677   3.202 -25.988
  127   1HG   LYS  17          2HG       LYS  17   7.996   4.148 -27.701
  128   2HG   LYS  17          1HG       LYS  17   8.903   2.766 -27.087
  129   1HD   LYS  17          2HD       LYS  17   8.085   1.413 -28.964
  130   2HD   LYS  17          1HD       LYS  17   7.224   2.818 -29.589
  131   1HE   LYS  17          2HE       LYS  17  10.205   2.708 -29.158
  132   2HE   LYS  17          1HE       LYS  17   9.416   2.367 -30.697
  133   1HZ   LYS  17          1HZ       LYS  17  10.197   4.635 -30.632
  134   2HZ   LYS  17          2HZ       LYS  17   9.323   4.941 -29.212
  135   3HZ   LYS  17          3HZ       LYS  17   8.500   4.618 -30.661
  136    HA   PRO  18           HA       PRO  18   3.941  -0.532 -24.015
  137   1HB   PRO  18          2HB       PRO  18   5.455  -2.607 -22.711
  138   2HB   PRO  18          1HB       PRO  18   4.151  -2.770 -23.890
  139   1HG   PRO  18          2HG       PRO  18   6.736  -3.436 -24.401
  140   2HG   PRO  18          1HG       PRO  18   5.589  -2.917 -25.647
  141   1HD   PRO  18          2HD       PRO  18   7.708  -1.325 -24.246
  142   2HD   PRO  18          1HD       PRO  18   7.280  -1.346 -25.972
  143    H    GLY  19           H        GLY  19   3.350  -0.608 -21.912
  144   1HA   GLY  19          2HA       GLY  19   5.291   0.398 -19.942
  145   2HA   GLY  19          1HA       GLY  19   3.648   1.027 -20.034
  146    H    THR  20           H        THR  20   4.678  -2.243 -20.480
  147    HA   THR  20           HA       THR  20   2.702  -3.419 -18.909
  148    HB   THR  20           HB       THR  20   5.390  -4.686 -19.417
  149    HG1  THR  20           1HG      THR  20   4.344  -5.284 -21.504
  150   1HG2  THR  20          1HG2      THR  20   3.763  -5.968 -18.107
  151   2HG2  THR  20          2HG2      THR  20   4.037  -6.714 -19.684
  152   3HG2  THR  20          3HG2      THR  20   2.570  -5.777 -19.393
  153    H    GLU  21           H        GLU  21   6.071  -2.661 -18.154
  154    HA   GLU  21           HA       GLU  21   5.387  -2.591 -15.329
  155   1HB   GLU  21          2HB       GLU  21   7.845  -3.929 -16.475
  156   2HB   GLU  21          1HB       GLU  21   7.584  -3.613 -14.766
  157   1HG   GLU  21          2HG       GLU  21   5.666  -5.103 -14.768
  158   2HG   GLU  21          1HG       GLU  21   5.882  -5.395 -16.494
  159    H    VAL  22           H        VAL  22   5.930  -0.662 -14.540
  160    HA   VAL  22           HA       VAL  22   7.542   1.169 -16.047
  161    HB   VAL  22           HB       VAL  22   6.451   1.316 -13.223
  162   1HG1  VAL  22          1HG1      VAL  22   7.775   3.501 -14.830
  163   2HG1  VAL  22          2HG1      VAL  22   8.463   2.699 -13.418
  164   3HG1  VAL  22          3HG1      VAL  22   7.013   3.687 -13.250
  165   1HG2  VAL  22          1HG2      VAL  22   4.737   1.327 -14.934
  166   2HG2  VAL  22          2HG2      VAL  22   5.577   2.608 -15.806
  167   3HG2  VAL  22          3HG2      VAL  22   4.876   2.934 -14.221
  168    HA   PRO  23           HA       PRO  23  11.526  -0.338 -14.852
  169   1HB   PRO  23          2HB       PRO  23  12.252   2.550 -14.996
  170   2HB   PRO  23          1HB       PRO  23  13.023   1.156 -15.764
  171   1HG   PRO  23          2HG       PRO  23  11.481   2.815 -17.174
  172   2HG   PRO  23          1HG       PRO  23  11.463   1.067 -17.475
  173   1HD   PRO  23          2HD       PRO  23   9.475   2.781 -16.084
  174   2HD   PRO  23          1HD       PRO  23   9.218   1.335 -17.078
  175    HA   PRO  24           HA       PRO  24  11.087   0.065 -10.531
  176   1HB   PRO  24          2HB       PRO  24  13.631  -0.879  -9.892
  177   2HB   PRO  24          1HB       PRO  24  12.195  -1.874 -10.168
  178   1HG   PRO  24          2HG       PRO  24  14.389  -1.143 -12.063
  179   2HG   PRO  24          1HG       PRO  24  13.560  -2.699 -11.849
  180   1HD   PRO  24          2HD       PRO  24  12.910  -1.140 -13.885
  181   2HD   PRO  24          1HD       PRO  24  11.638  -1.952 -12.948
  182    H    VAL  25           H        VAL  25  11.448   1.482  -9.062
  183    HA   VAL  25           HA       VAL  25  13.263   3.676  -9.440
  184    HB   VAL  25           HB       VAL  25  11.486   2.995  -7.074
  185   1HG1  VAL  25          1HG1      VAL  25  11.678   5.376  -6.520
  186   2HG1  VAL  25          2HG1      VAL  25  12.825   5.583  -7.843
  187   3HG1  VAL  25          3HG1      VAL  25  13.237   4.556  -6.471
  188   1HG2  VAL  25          1HG2      VAL  25   9.912   4.623  -8.022
  189   2HG2  VAL  25          2HG2      VAL  25  10.168   3.250  -9.098
  190   3HG2  VAL  25          3HG2      VAL  25  10.953   4.794  -9.436
  191    H    ILE  26           H        ILE  26  15.086   4.046  -8.226
  192    HA   ILE  26           HA       ILE  26  16.582   1.718  -7.730
  193    HB   ILE  26           HB       ILE  26  17.307   4.558  -7.003
  194   1HG1  ILE  26          2HG1      ILE  26  16.757   4.418  -9.361
  195   2HG1  ILE  26          1HG1      ILE  26  18.503   4.553  -9.187
  196   1HG2  ILE  26          1HG2      ILE  26  18.721   2.882  -5.904
  197   2HG2  ILE  26          2HG2      ILE  26  19.618   3.805  -7.110
  198   3HG2  ILE  26          3HG2      ILE  26  19.081   2.164  -7.477
  199   1HD1  ILE  26          1HD1      ILE  26  17.903   2.940 -10.900
  200   2HD1  ILE  26          2HD1      ILE  26  16.975   2.019  -9.717
  201   3HD1  ILE  26          3HD1      ILE  26  18.723   2.155  -9.552
  202    H    ASP  27           H        ASP  27  14.702   3.698  -5.618
  203    HA   ASP  27           HA       ASP  27  15.972   2.544  -3.281
  204   1HB   ASP  27          2HB       ASP  27  13.806   4.634  -3.480
  205   2HB   ASP  27          1HB       ASP  27  14.543   4.068  -1.984
  206    H    GLY  28           H        GLY  28  13.780   1.799  -5.450
  207   1HA   GLY  28          2HA       GLY  28  11.693   0.630  -3.892
  208   2HA   GLY  28          1HA       GLY  28  12.052   0.295  -5.584
  209    H    SER  29           H        SER  29  14.900  -0.024  -4.208
  210    HA   SER  29           HA       SER  29  14.822  -2.885  -4.020
  211   1HB   SER  29          2HB       SER  29  17.049  -1.072  -3.105
  212   2HB   SER  29          1HB       SER  29  17.170  -2.746  -3.648
  213    HG   SER  29           HG       SER  29  17.189  -0.444  -5.104
  214    H    ILE  30           H        ILE  30  14.968  -0.154  -1.892
  215    HA   ILE  30           HA       ILE  30  15.144  -1.608   0.569
  216    HB   ILE  30           HB       ILE  30  13.725   1.002   0.645
  217   1HG1  ILE  30          2HG1      ILE  30  15.312   1.464  -1.188
  218   2HG1  ILE  30          1HG1      ILE  30  15.720   2.359   0.269
  219   1HG2  ILE  30          1HG2      ILE  30  14.453  -0.170   2.645
  220   2HG2  ILE  30          2HG2      ILE  30  15.209   1.417   2.500
  221   3HG2  ILE  30          3HG2      ILE  30  16.131  -0.037   2.116
  222   1HD1  ILE  30          1HD1      ILE  30  17.084  -0.159  -0.671
  223   2HD1  ILE  30          2HD1      ILE  30  17.501   0.775   0.768
  224   3HD1  ILE  30          3HD1      ILE  30  17.704   1.483  -0.837
  225    H    TRP  31           H        TRP  31  12.705  -0.377  -1.542
  226    HA   TRP  31           HA       TRP  31  10.483  -0.822   0.160
  227   1HB   TRP  31          2HB       TRP  31  10.672  -0.289  -2.820
  228   2HB   TRP  31          1HB       TRP  31   9.156  -0.386  -1.929
  229    HD1  TRP  31           HD       TRP  31  11.168   2.252  -3.212
  230    HE1  TRP  31           1HE      TRP  31  11.017   4.394  -1.746
  231    HE3  TRP  31           3HE      TRP  31   9.320   0.191   1.032
  232    HZ2  TRP  31           2HZ      TRP  31  10.248   5.061   0.853
  233    HZ3  TRP  31           3HZ      TRP  31   8.927   1.620   2.990
  234    HH2  TRP  31           HH       TRP  31   9.388   4.012   2.898
  235    H    ASP  32           H        ASP  32  12.096  -2.681  -2.323
  236    HA   ASP  32           HA       ASP  32  10.103  -4.731  -2.378
  237   1HB   ASP  32          2HB       ASP  32  11.448  -4.276  -4.347
  238   2HB   ASP  32          1HB       ASP  32  12.929  -4.637  -3.456
  239    H    ALA  33           H        ALA  33  13.221  -4.220  -0.746
  240    HA   ALA  33           HA       ALA  33  13.299  -6.813   0.387
  241   1HB   ALA  33          1HB       ALA  33  15.306  -5.453   0.161
  242   2HB   ALA  33          2HB       ALA  33  15.046  -5.933   1.838
  243   3HB   ALA  33          3HB       ALA  33  14.657  -4.292   1.320
  244    H    ILE  34           H        ILE  34  11.995  -3.705   1.463
  245    HA   ILE  34           HA       ILE  34  11.144  -4.538   4.031
  246    HB   ILE  34           HB       ILE  34  10.062  -2.450   2.157
  247   1HG1  ILE  34          2HG1      ILE  34  11.652  -2.253   4.728
  248   2HG1  ILE  34          1HG1      ILE  34  12.293  -2.023   3.106
  249   1HG2  ILE  34          1HG2      ILE  34   8.221  -3.183   3.552
  250   2HG2  ILE  34          2HG2      ILE  34   8.753  -1.585   4.072
  251   3HG2  ILE  34          3HG2      ILE  34   9.213  -3.012   4.999
  252   1HD1  ILE  34          1HD1      ILE  34  10.244  -0.296   4.472
  253   2HD1  ILE  34          2HD1      ILE  34  10.839  -0.074   2.826
  254   3HD1  ILE  34          3HD1      ILE  34  11.940   0.100   4.194
  255    H    ALA  35           H        ALA  35   9.557  -4.548   0.871
  256    HA   ALA  35           HA       ALA  35   7.100  -5.634   1.600
  257   1HB   ALA  35          1HB       ALA  35   8.663  -6.121  -0.933
  258   2HB   ALA  35          2HB       ALA  35   7.582  -4.760  -0.631
  259   3HB   ALA  35          3HB       ALA  35   6.936  -6.399  -0.712
  260    H    GLY  36           H        GLY  36  10.186  -7.142   0.934
  261   1HA   GLY  36          2HA       GLY  36   9.210  -9.843   1.054
  262   2HA   GLY  36          1HA       GLY  36  10.896  -9.342   1.087
  263    H    CYS  37           H        CYS  37  10.002  -7.503   3.377
  264    HA   CYS  37           HA       CYS  37  10.644  -9.409   5.457
  265   1HB   CYS  37          2HB       CYS  37  11.920  -7.409   5.535
  266   2HB   CYS  37          1HB       CYS  37  10.490  -6.404   5.354
  267    H    GLU  38           H        GLU  38   8.157  -6.885   4.978
  268    HA   GLU  38           HA       GLU  38   6.810  -7.875   7.359
  269   1HB   GLU  38          2HB       GLU  38   7.227  -5.426   6.948
  270   2HB   GLU  38          1HB       GLU  38   6.069  -5.513   5.630
  271   1HG   GLU  38          2HG       GLU  38   5.040  -4.613   7.622
  272   2HG   GLU  38          1HG       GLU  38   4.322  -6.167   7.199
  273    H    ALA  39           H        ALA  39   6.392  -7.715   3.894
  274    HA   ALA  39           HA       ALA  39   3.682  -8.721   4.147
  275   1HB   ALA  39          1HB       ALA  39   3.437  -8.257   1.776
  276   2HB   ALA  39          2HB       ALA  39   5.144  -7.829   1.680
  277   3HB   ALA  39          3HB       ALA  39   4.041  -6.839   2.635
  278    H    GLY  40           H        GLY  40   6.737  -9.954   3.860
  279   1HA   GLY  40          2HA       GLY  40   7.439 -12.144   3.545
  280   2HA   GLY  40          1HA       GLY  40   5.765 -12.588   3.197
  281    H    GLY  41           H        GLY  41   6.977  -9.899   1.588
  282   1HA   GLY  41          2HA       GLY  41   7.574  -9.455  -0.541
  283   2HA   GLY  41          1HA       GLY  41   8.047 -11.144  -0.736
  284    H    ASN  42           H        ASN  42   5.020  -9.326  -0.210
  285    HA   ASN  42           HA       ASN  42   3.852 -10.530  -2.575
  286   1HB   ASN  42          2HB       ASN  42   3.477 -11.957  -0.347
  287   2HB   ASN  42          1HB       ASN  42   2.226 -10.743  -0.083
  288   1HD2  ASN  42          1HD2      ASN  42   0.470 -10.632  -1.545
  289   2HD2  ASN  42          2HD2      ASN  42   0.094 -11.944  -2.608
  290    H    TRP  43           H        TRP  43   3.231  -8.726  -3.543
  291    HA   TRP  43           HA       TRP  43   2.625  -6.390  -1.955
  292   1HB   TRP  43          2HB       TRP  43   2.789  -6.787  -4.945
  293   2HB   TRP  43          1HB       TRP  43   2.575  -5.233  -4.140
  294    HD1  TRP  43           HD       TRP  43   5.118  -8.154  -3.964
  295    HE1  TRP  43           1HE      TRP  43   7.486  -7.151  -3.725
  296    HE3  TRP  43           3HE      TRP  43   3.870  -3.217  -3.832
  297    HZ2  TRP  43           2HZ      TRP  43   8.660  -4.562  -3.509
  298    HZ3  TRP  43           3HZ      TRP  43   5.646  -1.539  -3.614
  299    HH2  TRP  43           HH       TRP  43   7.989  -2.195  -3.467
  300    H    ALA  44           H        ALA  44   0.916  -8.948  -3.150
  301    HA   ALA  44           HA       ALA  44  -1.594  -7.404  -3.245
  302   1HB   ALA  44          1HB       ALA  44  -1.049  -8.714  -5.269
  303   2HB   ALA  44          2HB       ALA  44  -2.558  -9.221  -4.508
  304   3HB   ALA  44          3HB       ALA  44  -1.096 -10.186  -4.299
  305    H    ILE  45           H        ILE  45  -0.019  -8.626  -0.866
  306    HA   ILE  45           HA       ILE  45  -1.845 -10.626   0.111
  307    HB   ILE  45           HB       ILE  45   0.704 -10.694   0.394
  308   1HG1  ILE  45          2HG1      ILE  45  -1.038 -10.991   2.831
  309   2HG1  ILE  45          1HG1      ILE  45  -0.889 -12.172   1.536
  310   1HG2  ILE  45          1HG2      ILE  45   1.041  -8.416   1.162
  311   2HG2  ILE  45          2HG2      ILE  45   1.596  -9.566   2.379
  312   3HG2  ILE  45          3HG2      ILE  45   0.056  -8.732   2.589
  313   1HD1  ILE  45          1HD1      ILE  45   1.326 -11.274   3.359
  314   2HD1  ILE  45          2HD1      ILE  45   1.465 -12.471   2.073
  315   3HD1  ILE  45          3HD1      ILE  45   0.444 -12.796   3.474
  316    H    ASN  46           H        ASN  46  -3.199 -10.380   1.867
  317    HA   ASN  46           HA       ASN  46  -3.075  -7.974   3.455
  318   1HB   ASN  46          2HB       ASN  46  -4.538  -7.222   1.630
  319   2HB   ASN  46          1HB       ASN  46  -5.599  -8.603   1.908
  320   1HD2  ASN  46          1HD2      ASN  46  -7.377  -7.396   2.439
  321   2HD2  ASN  46          2HD2      ASN  46  -7.496  -6.480   3.901
  322    H    THR  47           H        THR  47  -3.034  -8.819   5.392
  323    HA   THR  47           HA       THR  47  -4.321 -11.321   5.948
  324    HB   THR  47           HB       THR  47  -3.429 -10.778   8.320
  325    HG1  THR  47           1HG      THR  47  -1.556  -9.223   7.993
  326   1HG2  THR  47          1HG2      THR  47  -1.506 -11.064   6.003
  327   2HG2  THR  47          2HG2      THR  47  -2.370 -12.383   6.794
  328   3HG2  THR  47          3HG2      THR  47  -1.160 -11.460   7.686
  329    H    GLY  48           H        GLY  48  -5.197  -8.045   6.092
  330   1HA   GLY  48          2HA       GLY  48  -7.373  -7.286   6.615
  331   2HA   GLY  48          1HA       GLY  48  -7.591  -8.702   7.639
  332    H    ASN  49           H        ASN  49  -4.631  -6.990   7.866
  333    HA   ASN  49           HA       ASN  49  -5.208  -6.391  10.627
  334   1HB   ASN  49          2HB       ASN  49  -2.856  -5.975  10.875
  335   2HB   ASN  49          1HB       ASN  49  -3.043  -7.418   9.884
  336   1HD2  ASN  49          1HD2      ASN  49  -2.538  -7.328   7.679
  337   2HD2  ASN  49          2HD2      ASN  49  -1.593  -6.031   7.026
  338    H    GLY  50           H        GLY  50  -5.591  -4.770   7.773
  339   1HA   GLY  50          2HA       GLY  50  -6.627  -2.646   7.668
  340   2HA   GLY  50          1HA       GLY  50  -5.838  -2.222   9.181
  341    H    TYR  51           H        TYR  51  -3.353  -3.543   7.889
  342    HA   TYR  51           HA       TYR  51  -2.617  -1.275   6.178
  343   1HB   TYR  51          2HB       TYR  51  -0.678  -3.241   7.420
  344   2HB   TYR  51          1HB       TYR  51  -0.311  -1.708   6.659
  345    HD1  TYR  51           1HD      TYR  51  -3.105  -0.964   8.509
  346    HD2  TYR  51           2HD      TYR  51   0.991  -1.997   9.058
  347    HE1  TYR  51           1HE      TYR  51  -3.116   0.131  10.721
  348    HE2  TYR  51           2HE      TYR  51   0.983  -0.909  11.264
  349    HH   TYR  51           HH       TYR  51  -0.236   0.731  12.507
  350    H    TYR  52           H        TYR  52  -1.829  -1.709   4.127
  351    HA   TYR  52           HA       TYR  52  -2.839  -4.302   3.222
  352   1HB   TYR  52          2HB       TYR  52  -2.570  -1.668   1.774
  353   2HB   TYR  52          1HB       TYR  52  -3.147  -3.158   1.024
  354    HD1  TYR  52           1HD      TYR  52  -3.850  -0.887   3.906
  355    HD2  TYR  52           2HD      TYR  52  -5.430  -3.666   1.097
  356    HE1  TYR  52           1HE      TYR  52  -6.112  -0.420   4.745
  357    HE2  TYR  52           2HE      TYR  52  -7.704  -3.204   1.920
  358    HH   TYR  52           HH       TYR  52  -8.493  -0.592   3.842
  359    H    GLY  53           H        GLY  53  -1.830  -5.278   1.316
  360   1HA   GLY  53          2HA       GLY  53   0.723  -6.037   2.142
  361   2HA   GLY  53          1HA       GLY  53  -0.054  -6.534   0.655
  362    H    GLY  54           H        GLY  54   2.344  -6.531   0.191
  363   1HA   GLY  54          2HA       GLY  54   3.895  -5.602  -1.286
  364   2HA   GLY  54          1HA       GLY  54   3.025  -4.074  -1.208
  365    H    VAL  55           H        VAL  55   3.800  -2.502   0.039
  366    HA   VAL  55           HA       VAL  55   6.220  -3.009   1.565
  367    HB   VAL  55           HB       VAL  55   4.749  -0.385   1.519
  368   1HG1  VAL  55          1HG1      VAL  55   6.962   0.553   1.762
  369   2HG1  VAL  55          2HG1      VAL  55   7.686  -1.049   1.615
  370   3HG1  VAL  55          3HG1      VAL  55   6.681  -0.660   3.010
  371   1HG2  VAL  55          1HG2      VAL  55   5.941   0.238  -0.511
  372   2HG2  VAL  55          2HG2      VAL  55   4.881  -1.140  -0.805
  373   3HG2  VAL  55          3HG2      VAL  55   6.617  -1.386  -0.627
  374    H    GLN  56           H        GLN  56   2.969  -3.199   2.019
  375    HA   GLN  56           HA       GLN  56   1.680  -3.797   3.750
  376   1HB   GLN  56          2HB       GLN  56   3.703  -5.334   4.014
  377   2HB   GLN  56          1HB       GLN  56   4.190  -4.282   5.335
  378   1HG   GLN  56          2HG       GLN  56   3.053  -6.100   6.305
  379   2HG   GLN  56          1HG       GLN  56   1.948  -4.729   6.376
  380   1HE2  GLN  56          1HE2      GLN  56   0.118  -4.723   5.090
  381   2HE2  GLN  56          2HE2      GLN  56  -0.464  -6.150   4.312
  382    H    PHE  57           H        PHE  57   2.053  -1.049   3.559
  383    HA   PHE  57           HA       PHE  57   1.991  -0.363   6.403
  384   1HB   PHE  57          2HB       PHE  57   2.387   1.979   5.801
  385   2HB   PHE  57          1HB       PHE  57   3.714   0.923   5.369
  386    HD1  PHE  57           1HD      PHE  57   1.841   3.633   4.344
  387    HD2  PHE  57           2HD      PHE  57   3.539   0.046   2.809
  388    HE1  PHE  57           1HE      PHE  57   1.916   4.635   2.098
  389    HE2  PHE  57           2HE      PHE  57   3.614   1.037   0.560
  390    HZ   PHE  57           HZ       PHE  57   2.819   3.346   0.198
  391    H    ASP  58           H        ASP  58   0.517   1.714   6.731
  392    HA   ASP  58           HA       ASP  58  -2.003   0.380   6.440
  393   1HB   ASP  58          2HB       ASP  58  -2.844   2.022   8.025
  394   2HB   ASP  58          1HB       ASP  58  -1.342   1.305   8.598
  395    H    GLN  59           H        GLN  59  -3.921   1.309   5.836
  396    HA   GLN  59           HA       GLN  59  -3.901   2.564   3.332
  397   1HB   GLN  59          2HB       GLN  59  -5.644   1.077   3.861
  398   2HB   GLN  59          1HB       GLN  59  -6.005   1.899   5.370
  399   1HG   GLN  59          2HG       GLN  59  -7.718   2.283   3.697
  400   2HG   GLN  59          1HG       GLN  59  -6.906   3.781   4.142
  401   1HE2  GLN  59          1HE2      GLN  59  -5.357   1.478   2.099
  402   2HE2  GLN  59          2HE2      GLN  59  -5.488   2.365   0.621
  403    H    GLY  60           H        GLY  60  -4.238   3.739   6.572
  404   1HA   GLY  60          2HA       GLY  60  -5.275   6.304   6.020
  405   2HA   GLY  60          1HA       GLY  60  -4.330   5.874   7.441
  406    H    THR  61           H        THR  61  -1.942   5.255   6.550
  407    HA   THR  61           HA       THR  61  -0.701   7.657   5.796
  408    HB   THR  61           HB       THR  61   0.309   4.846   5.742
  409    HG1  THR  61           1HG      THR  61   0.284   5.111   7.824
  410   1HG2  THR  61          1HG2      THR  61   1.699   6.284   4.335
  411   2HG2  THR  61          2HG2      THR  61   2.564   5.816   5.800
  412   3HG2  THR  61          3HG2      THR  61   1.864   7.430   5.664
  413    H    TRP  62           H        TRP  62  -1.509   4.752   3.988
  414    HA   TRP  62           HA       TRP  62  -0.356   5.347   1.530
  415   1HB   TRP  62          2HB       TRP  62  -1.359   3.186   2.092
  416   2HB   TRP  62          1HB       TRP  62  -2.943   3.944   2.207
  417    HD1  TRP  62           HD       TRP  62  -4.215   4.500  -0.026
  418    HE1  TRP  62           1HE      TRP  62  -3.930   3.660  -2.435
  419    HE3  TRP  62           3HE      TRP  62   0.451   2.475   0.396
  420    HZ2  TRP  62           2HZ      TRP  62  -1.941   2.290  -3.992
  421    HZ3  TRP  62           3HZ      TRP  62   1.483   1.430  -1.569
  422    HH2  TRP  62           HH       TRP  62   0.319   1.340  -3.714
  423    H    GLU  63           H        GLU  63  -3.560   6.080   2.801
  424    HA   GLU  63           HA       GLU  63  -4.458   7.498   0.533
  425   1HB   GLU  63          2HB       GLU  63  -6.086   6.572   1.988
  426   2HB   GLU  63          1HB       GLU  63  -5.395   7.357   3.401
  427   1HG   GLU  63          2HG       GLU  63  -6.139   9.516   2.608
  428   2HG   GLU  63          1HG       GLU  63  -6.720   8.799   1.109
  429    H    ALA  64           H        ALA  64  -2.783   8.403   3.473
  430    HA   ALA  64           HA       ALA  64  -3.131  11.194   3.340
  431   1HB   ALA  64          1HB       ALA  64  -0.811   9.658   4.505
  432   2HB   ALA  64          2HB       ALA  64  -2.317  10.038   5.341
  433   3HB   ALA  64          3HB       ALA  64  -1.229  11.336   4.851
  434    H    ASN  65           H        ASN  65  -0.645   9.065   2.000
  435    HA   ASN  65           HA       ASN  65   0.779  11.231   0.757
  436   1HB   ASN  65          2HB       ASN  65   1.006   8.277   0.165
  437   2HB   ASN  65          1HB       ASN  65   2.195   9.525  -0.186
  438   1HD2  ASN  65          1HD2      ASN  65   1.873  10.873   2.379
  439   2HD2  ASN  65          2HD2      ASN  65   2.616   9.844   3.558
  440    H    GLY  66           H        GLY  66  -2.021   9.531   0.068
  441   1HA   GLY  66          2HA       GLY  66  -3.503   9.935  -1.678
  442   2HA   GLY  66          1HA       GLY  66  -2.231  10.802  -2.527
  443    H    GLY  67           H        GLY  67  -2.510   7.476  -1.287
  444   1HA   GLY  67          2HA       GLY  67  -1.133   6.487  -3.613
  445   2HA   GLY  67          1HA       GLY  67  -1.692   5.545  -2.240
  446    H    LEU  68           H        LEU  68  -4.391   7.003  -2.764
  447    HA   LEU  68           HA       LEU  68  -5.584   4.727  -3.822
  448   1HB   LEU  68          2HB       LEU  68  -6.644   7.494  -3.401
  449   2HB   LEU  68          1HB       LEU  68  -7.652   6.163  -3.922
  450    HG   LEU  68           HG       LEU  68  -6.818   4.995  -1.771
  451   1HD1  LEU  68          1HD1      LEU  68  -6.196   7.867  -1.151
  452   2HD1  LEU  68          2HD1      LEU  68  -5.073   6.505  -1.160
  453   3HD1  LEU  68          3HD1      LEU  68  -6.347   6.590   0.055
  454   1HD2  LEU  68          1HD2      LEU  68  -8.630   6.023  -0.484
  455   2HD2  LEU  68          2HD2      LEU  68  -9.115   5.696  -2.149
  456   3HD2  LEU  68          3HD2      LEU  68  -8.709   7.340  -1.657
  457    H    ARG  69           H        ARG  69  -4.352   7.548  -5.341
  458    HA   ARG  69           HA       ARG  69  -5.757   7.377  -7.793
  459   1HB   ARG  69          2HB       ARG  69  -3.903   8.772  -8.664
  460   2HB   ARG  69          1HB       ARG  69  -4.580   9.400  -7.166
  461   1HG   ARG  69          2HG       ARG  69  -2.746   8.550  -5.902
  462   2HG   ARG  69          1HG       ARG  69  -2.112   7.696  -7.307
  463   1HD   ARG  69          2HD       ARG  69  -0.850   9.716  -6.902
  464   2HD   ARG  69          1HD       ARG  69  -1.732   9.840  -8.424
  465    HE   ARG  69           HE       ARG  69  -3.046  10.986  -6.098
  466   1HH1  ARG  69          1HH1      ARG  69  -0.994  11.521  -8.887
  467   2HH1  ARG  69          2HH1      ARG  69  -1.346  13.221  -8.974
  468   1HH2  ARG  69          1HH2      ARG  69  -3.509  13.229  -6.216
  469   2HH2  ARG  69          2HH2      ARG  69  -2.769  14.190  -7.465
  470    H    TYR  70           H        TYR  70  -2.927   5.833  -6.464
  471    HA   TYR  70           HA       TYR  70  -2.111   4.619  -8.968
  472   1HB   TYR  70          2HB       TYR  70  -1.315   4.038  -6.106
  473   2HB   TYR  70          1HB       TYR  70  -0.432   3.527  -7.542
  474    HD1  TYR  70           1HD      TYR  70   0.712   5.339  -8.935
  475    HD2  TYR  70           2HD      TYR  70  -0.976   6.052  -5.104
  476    HE1  TYR  70           1HE      TYR  70   2.047   7.399  -8.734
  477    HE2  TYR  70           2HE      TYR  70   0.341   8.097  -4.892
  478    HH   TYR  70           HH       TYR  70   1.977   9.523  -7.519
  479    H    ALA  71           H        ALA  71  -3.867   4.040  -6.092
  480    HA   ALA  71           HA       ALA  71  -5.643   2.130  -6.886
  481   1HB   ALA  71          1HB       ALA  71  -4.768   0.037  -5.946
  482   2HB   ALA  71          2HB       ALA  71  -3.230   0.825  -5.596
  483   3HB   ALA  71          3HB       ALA  71  -3.747   0.599  -7.269
  484    HA   PRO  72           HA       PRO  72  -6.851   3.894  -2.979
  485   1HB   PRO  72          2HB       PRO  72  -8.904   1.850  -2.943
  486   2HB   PRO  72          1HB       PRO  72  -9.050   3.599  -2.940
  487   1HG   PRO  72          2HG       PRO  72  -9.606   1.991  -5.096
  488   2HG   PRO  72          1HG       PRO  72  -9.213   3.715  -5.193
  489   1HD   PRO  72          2HD       PRO  72  -7.609   1.390  -5.963
  490   2HD   PRO  72          1HD       PRO  72  -7.418   3.098  -6.406
  491    H    ARG  73           H        ARG  73  -5.703   0.782  -3.482
  492    HA   ARG  73           HA       ARG  73  -5.156   0.507  -0.641
  493   1HB   ARG  73          2HB       ARG  73  -5.888  -1.787  -0.512
  494   2HB   ARG  73          1HB       ARG  73  -7.236  -0.802  -1.057
  495   1HG   ARG  73          2HG       ARG  73  -6.603  -1.486  -3.412
  496   2HG   ARG  73          1HG       ARG  73  -5.531  -2.678  -2.659
  497   1HD   ARG  73          2HD       ARG  73  -8.478  -2.475  -2.037
  498   2HD   ARG  73          1HD       ARG  73  -7.833  -3.504  -3.317
  499    HE   ARG  73           HE       ARG  73  -6.396  -4.397  -1.316
  500   1HH1  ARG  73          1HH1      ARG  73  -9.758  -3.417  -1.161
  501   2HH1  ARG  73          2HH1      ARG  73 -10.189  -4.653  -0.021
  502   1HH2  ARG  73          1HH2      ARG  73  -6.960  -6.012   0.159
  503   2HH2  ARG  73          2HH2      ARG  73  -8.595  -6.129   0.750
  504    H    ALA  74           H        ALA  74  -3.239  -0.377  -0.267
  505    HA   ALA  74           HA       ALA  74  -1.250  -0.195  -2.163
  506   1HB   ALA  74          1HB       ALA  74  -0.938  -0.065   0.296
  507   2HB   ALA  74          2HB       ALA  74   0.238  -1.092  -0.519
  508   3HB   ALA  74          3HB       ALA  74  -1.100  -1.820   0.367
  509    H    ASP  75           H        ASP  75  -3.160  -3.008  -1.242
  510    HA   ASP  75           HA       ASP  75  -1.297  -4.805  -2.489
  511   1HB   ASP  75          2HB       ASP  75  -2.877  -6.588  -1.878
  512   2HB   ASP  75          1HB       ASP  75  -2.436  -5.581  -0.507
  513    H    LEU  76           H        LEU  76  -3.742  -2.862  -3.587
  514    HA   LEU  76           HA       LEU  76  -4.330  -4.507  -5.912
  515   1HB   LEU  76          2HB       LEU  76  -6.069  -3.036  -4.965
  516   2HB   LEU  76          1HB       LEU  76  -5.055  -1.642  -5.279
  517    HG   LEU  76           HG       LEU  76  -5.209  -2.094  -7.703
  518   1HD1  LEU  76          1HD1      LEU  76  -5.584  -4.489  -7.638
  519   2HD1  LEU  76          2HD1      LEU  76  -6.893  -3.688  -8.511
  520   3HD1  LEU  76          3HD1      LEU  76  -7.147  -4.242  -6.856
  521   1HD2  LEU  76          1HD2      LEU  76  -7.842  -1.823  -6.262
  522   2HD2  LEU  76          2HD2      LEU  76  -7.558  -1.419  -7.956
  523   3HD2  LEU  76          3HD2      LEU  76  -6.736  -0.517  -6.681
  524    H    ALA  77           H        ALA  77  -2.380  -1.804  -4.914
  525    HA   ALA  77           HA       ALA  77  -1.291  -1.245  -7.498
  526   1HB   ALA  77          1HB       ALA  77  -1.494   0.480  -5.784
  527   2HB   ALA  77          2HB       ALA  77   0.189   0.262  -6.268
  528   3HB   ALA  77          3HB       ALA  77  -0.386  -0.415  -4.744
  529    H    THR  78           H        THR  78   0.882  -1.576  -8.111
  530    HA   THR  78           HA       THR  78   2.051  -4.000  -6.954
  531    HB   THR  78           HB       THR  78   3.169  -4.360  -9.031
  532    HG1  THR  78           1HG      THR  78   2.446  -1.667  -9.534
  533   1HG2  THR  78          1HG2      THR  78   0.825  -4.993  -9.033
  534   2HG2  THR  78          2HG2      THR  78   1.285  -4.403 -10.629
  535   3HG2  THR  78          3HG2      THR  78   0.363  -3.368  -9.534
  536    H    ARG  79           H        ARG  79   4.654  -3.725  -7.796
  537    HA   ARG  79           HA       ARG  79   5.838  -2.422  -5.681
  538   1HB   ARG  79          2HB       ARG  79   7.056  -2.923  -8.401
  539   2HB   ARG  79          1HB       ARG  79   7.948  -2.590  -6.924
  540   1HG   ARG  79          2HG       ARG  79   6.977  -4.664  -5.951
  541   2HG   ARG  79          1HG       ARG  79   6.277  -5.016  -7.532
  542   1HD   ARG  79          2HD       ARG  79   8.363  -6.210  -7.262
  543   2HD   ARG  79          1HD       ARG  79   8.523  -4.981  -8.514
  544    HE   ARG  79           HE       ARG  79   9.466  -4.486  -5.775
  545   1HH1  ARG  79          1HH1      ARG  79  10.038  -4.659  -9.227
  546   2HH1  ARG  79          2HH1      ARG  79  11.673  -4.082  -9.104
  547   1HH2  ARG  79          1HH2      ARG  79  11.606  -3.679  -5.636
  548   2HH2  ARG  79          2HH2      ARG  79  12.554  -3.509  -7.085
  549    H    GLU  80           H        GLU  80   5.407  -1.267  -8.972
  550    HA   GLU  80           HA       GLU  80   6.854   1.096  -8.765
  551   1HB   GLU  80          2HB       GLU  80   5.434   1.812 -10.765
  552   2HB   GLU  80          1HB       GLU  80   6.375   0.336 -10.924
  553   1HG   GLU  80          2HG       GLU  80   4.345  -0.967 -10.404
  554   2HG   GLU  80          1HG       GLU  80   3.425   0.532 -10.385
  555    H    GLU  81           H        GLU  81   3.285   0.691  -8.369
  556    HA   GLU  81           HA       GLU  81   2.816   3.383  -7.693
  557   1HB   GLU  81          2HB       GLU  81   1.269   0.947  -6.828
  558   2HB   GLU  81          1HB       GLU  81   0.703   2.604  -6.766
  559   1HG   GLU  81          2HG       GLU  81  -0.314   1.925  -8.644
  560   2HG   GLU  81          1HG       GLU  81   1.186   2.509  -9.351
  561    H    GLN  82           H        GLN  82   3.283   0.506  -5.650
  562    HA   GLN  82           HA       GLN  82   2.771   1.831  -3.221
  563   1HB   GLN  82          2HB       GLN  82   4.464  -0.624  -3.673
  564   2HB   GLN  82          1HB       GLN  82   3.839  -0.079  -2.124
  565   1HG   GLN  82          2HG       GLN  82   1.530  -0.286  -3.206
  566   2HG   GLN  82          1HG       GLN  82   2.357  -1.242  -4.441
  567   1HE2  GLN  82          1HE2      GLN  82   1.493  -3.214  -3.936
  568   2HE2  GLN  82          2HE2      GLN  82   1.770  -4.020  -2.426
  569    H    ILE  83           H        ILE  83   5.728   1.377  -5.072
  570    HA   ILE  83           HA       ILE  83   7.526   2.375  -3.160
  571    HB   ILE  83           HB       ILE  83   7.559   2.322  -6.164
  572   1HG1  ILE  83          2HG1      ILE  83   9.567   1.166  -4.240
  573   2HG1  ILE  83          1HG1      ILE  83   8.091   0.303  -4.644
  574   1HG2  ILE  83          1HG2      ILE  83   8.639   4.419  -5.582
  575   2HG2  ILE  83          2HG2      ILE  83   9.835   3.250  -6.145
  576   3HG2  ILE  83          3HG2      ILE  83   9.672   3.586  -4.420
  577   1HD1  ILE  83          1HD1      ILE  83   8.748   0.312  -7.003
  578   2HD1  ILE  83          2HD1      ILE  83   9.960  -0.467  -5.985
  579   3HD1  ILE  83          3HD1      ILE  83  10.229   1.169  -6.580
  580    H    ALA  84           H        ALA  84   5.634   4.025  -5.689
  581    HA   ALA  84           HA       ALA  84   6.581   6.618  -5.266
  582   1HB   ALA  84          1HB       ALA  84   5.276   5.988  -7.206
  583   2HB   ALA  84          2HB       ALA  84   4.503   7.339  -6.374
  584   3HB   ALA  84          3HB       ALA  84   3.861   5.705  -6.193
  585    H    VAL  85           H        VAL  85   3.774   5.007  -3.823
  586    HA   VAL  85           HA       VAL  85   2.902   7.191  -2.259
  587    HB   VAL  85           HB       VAL  85   2.510   4.255  -1.729
  588   1HG1  VAL  85          1HG1      VAL  85   0.921   6.670  -0.857
  589   2HG1  VAL  85          2HG1      VAL  85   1.900   5.631   0.177
  590   3HG1  VAL  85          3HG1      VAL  85   0.445   4.994  -0.589
  591   1HG2  VAL  85          1HG2      VAL  85   0.841   6.145  -3.378
  592   2HG2  VAL  85          2HG2      VAL  85   0.427   4.474  -2.997
  593   3HG2  VAL  85          3HG2      VAL  85   1.837   4.829  -3.994
  594    H    ALA  86           H        ALA  86   4.794   4.294  -1.378
  595    HA   ALA  86           HA       ALA  86   5.359   5.002   1.251
  596   1HB   ALA  86          1HB       ALA  86   7.208   3.424   1.108
  597   2HB   ALA  86          2HB       ALA  86   7.078   3.415  -0.651
  598   3HB   ALA  86          3HB       ALA  86   5.764   2.770   0.334
  599    H    GLU  87           H        GLU  87   6.711   6.047  -1.755
  600    HA   GLU  87           HA       GLU  87   9.150   7.113  -0.871
  601   1HB   GLU  87          2HB       GLU  87   7.344   7.758  -3.173
  602   2HB   GLU  87          1HB       GLU  87   8.730   8.786  -2.844
  603   1HG   GLU  87          2HG       GLU  87   8.828   5.828  -3.385
  604   2HG   GLU  87          1HG       GLU  87   9.188   7.102  -4.550
  605    H    VAL  88           H        VAL  88   5.929   8.624  -1.071
  606    HA   VAL  88           HA       VAL  88   6.785  11.172  -0.184
  607    HB   VAL  88           HB       VAL  88   4.065   9.880   0.117
  608   1HG1  VAL  88          1HG1      VAL  88   3.213  12.140   0.466
  609   2HG1  VAL  88          2HG1      VAL  88   4.853  12.784   0.394
  610   3HG1  VAL  88          3HG1      VAL  88   4.386  11.710   1.718
  611   1HG2  VAL  88          1HG2      VAL  88   4.789  10.110  -2.208
  612   2HG2  VAL  88          2HG2      VAL  88   5.111  11.825  -1.944
  613   3HG2  VAL  88          3HG2      VAL  88   3.460  11.209  -1.839
  614    H    THR  89           H        THR  89   5.378   8.434   1.597
  615    HA   THR  89           HA       THR  89   5.424   9.908   4.031
  616    HB   THR  89           HB       THR  89   3.729   8.171   3.591
  617    HG1  THR  89           1HG      THR  89   3.592   8.071   5.682
  618   1HG2  THR  89          1HG2      THR  89   5.437   6.548   2.592
  619   2HG2  THR  89          2HG2      THR  89   4.166   5.884   3.621
  620   3HG2  THR  89          3HG2      THR  89   5.787   6.119   4.270
  621    H    ARG  90           H        ARG  90   7.637   7.584   2.537
  622    HA   ARG  90           HA       ARG  90   9.144   6.971   4.829
  623   1HB   ARG  90          2HB       ARG  90  10.875   6.170   3.395
  624   2HB   ARG  90          1HB       ARG  90   9.354   5.798   2.601
  625   1HG   ARG  90          2HG       ARG  90   9.782   7.152   0.853
  626   2HG   ARG  90          1HG       ARG  90  10.621   8.351   1.844
  627   1HD   ARG  90          2HD       ARG  90  12.605   7.088   1.871
  628   2HD   ARG  90          1HD       ARG  90  11.792   5.648   1.267
  629    HE   ARG  90           HE       ARG  90  11.537   6.882  -0.874
  630   1HH1  ARG  90          1HH1      ARG  90  14.053   7.784   1.385
  631   2HH1  ARG  90          2HH1      ARG  90  15.115   8.400   0.165
  632   1HH2  ARG  90          1HH2      ARG  90  12.899   7.694  -2.487
  633   2HH2  ARG  90          2HH2      ARG  90  14.460   8.330  -2.060
  634    H    LEU  91           H        LEU  91   9.311   9.663   2.607
  635    HA   LEU  91           HA       LEU  91  11.874  10.540   3.511
  636   1HB   LEU  91          2HB       LEU  91  11.520  12.509   2.108
  637   2HB   LEU  91          1HB       LEU  91  11.202  11.020   1.249
  638    HG   LEU  91           HG       LEU  91   8.700  11.512   1.773
  639   1HD1  LEU  91          1HD1      LEU  91   9.888  14.272   2.086
  640   2HD1  LEU  91          2HD1      LEU  91   9.097  13.340   3.359
  641   3HD1  LEU  91          3HD1      LEU  91   8.171  13.887   1.960
  642   1HD2  LEU  91          1HD2      LEU  91   8.536  12.868  -0.254
  643   2HD2  LEU  91          2HD2      LEU  91   9.695  11.553  -0.452
  644   3HD2  LEU  91          3HD2      LEU  91  10.267  13.198  -0.177
  645    H    ARG  92           H        ARG  92   8.679  11.020   4.636
  646    HA   ARG  92           HA       ARG  92   9.163  13.544   5.926
  647   1HB   ARG  92          2HB       ARG  92   6.933  11.669   6.615
  648   2HB   ARG  92          1HB       ARG  92   6.960  13.424   6.699
  649   1HG   ARG  92          2HG       ARG  92   6.682  13.656   4.397
  650   2HG   ARG  92          1HG       ARG  92   7.125  11.973   4.086
  651   1HD   ARG  92          2HD       ARG  92   4.586  13.093   5.190
  652   2HD   ARG  92          1HD       ARG  92   4.825  11.918   3.893
  653    HE   ARG  92           HE       ARG  92   5.802  10.670   6.105
  654   1HH1  ARG  92          1HH1      ARG  92   2.692  12.038   5.197
  655   2HH1  ARG  92          2HH1      ARG  92   1.797  11.081   6.349
  656   1HH2  ARG  92          1HH2      ARG  92   4.602   9.421   7.625
  657   2HH2  ARG  92          2HH2      ARG  92   2.876   9.584   7.706
  658    H    GLN  93           H        GLN  93   8.800  10.181   6.812
  659    HA   GLN  93           HA       GLN  93   9.252  10.851   9.598
  660   1HB   GLN  93          2HB       GLN  93   8.352   8.630  10.069
  661   2HB   GLN  93          1HB       GLN  93   7.280   9.556   9.019
  662   1HG   GLN  93          2HG       GLN  93   8.531   8.340   7.104
  663   2HG   GLN  93          1HG       GLN  93   8.986   7.201   8.372
  664   1HE2  GLN  93          1HE2      GLN  93   7.261   6.905   6.021
  665   2HE2  GLN  93          2HE2      GLN  93   5.733   6.367   6.621
  666    H    GLY  94           H        GLY  94  10.753   8.949   7.023
  667   1HA   GLY  94          2HA       GLY  94  13.137   8.812   6.952
  668   2HA   GLY  94          1HA       GLY  94  13.168   8.934   8.707
  669    H    TRP  95           H        TRP  95  11.138   6.884   6.716
  670    HA   TRP  95           HA       TRP  95  10.859   4.688   6.519
  671   1HB   TRP  95          2HB       TRP  95  13.592   4.211   7.713
  672   2HB   TRP  95          1HB       TRP  95  12.687   3.165   6.618
  673    HD1  TRP  95           HD       TRP  95  14.690   6.446   6.604
  674    HE1  TRP  95           1HE      TRP  95  15.563   6.856   4.241
  675    HE3  TRP  95           3HE      TRP  95  12.301   2.618   4.216
  676    HZ2  TRP  95           2HZ      TRP  95  15.279   5.699   1.664
  677    HZ3  TRP  95           3HZ      TRP  95  12.654   2.340   1.797
  678    HH2  TRP  95           HH       TRP  95  14.112   3.848   0.550
  679    H    GLY  96           H        GLY  96  10.789   6.379   9.130
  680   1HA   GLY  96          2HA       GLY  96  11.069   4.676  11.335
  681   2HA   GLY  96          1HA       GLY  96  10.089   6.132  11.293
  682    H    ALA  97           H        ALA  97   8.324   5.169   9.172
  683    HA   ALA  97           HA       ALA  97   6.421   3.769  10.704
  684   1HB   ALA  97          1HB       ALA  97   5.152   3.530   8.644
  685   2HB   ALA  97          2HB       ALA  97   6.565   4.003   7.701
  686   3HB   ALA  97          3HB       ALA  97   5.798   5.166   8.783
  687    H    TRP  98           H        TRP  98   9.095   2.774   8.760
  688    HA   TRP  98           HA       TRP  98   8.194  -0.033   8.963
  689   1HB   TRP  98          2HB       TRP  98  10.316   1.223   7.207
  690   2HB   TRP  98          1HB       TRP  98   9.838  -0.471   7.181
  691    HD1  TRP  98           HD       TRP  98   7.421  -1.044   6.153
  692    HE1  TRP  98           1HE      TRP  98   5.992   0.184   4.408
  693    HE3  TRP  98           3HE      TRP  98   9.620   3.612   6.405
  694    HZ2  TRP  98           2HZ      TRP  98   5.828   2.777   3.261
  695    HZ3  TRP  98           3HZ      TRP  98   8.765   5.388   4.929
  696    HH2  TRP  98           HH       TRP  98   6.922   4.956   3.402
  697    HA   PRO  99           HA       PRO  99  11.267   0.138  12.236
  698   1HB   PRO  99          2HB       PRO  99  10.128  -2.467  13.004
  699   2HB   PRO  99          1HB       PRO  99  10.248  -0.969  13.928
  700   1HG   PRO  99          2HG       PRO  99   7.892  -1.773  12.995
  701   2HG   PRO  99          1HG       PRO  99   8.361  -0.059  12.948
  702   1HD   PRO  99          2HD       PRO  99   8.530  -2.091  10.725
  703   2HD   PRO  99          1HD       PRO  99   7.770  -0.478  10.701
  704    H    VAL 100           H        VAL 100  10.978  -3.350  11.945
  705    HA   VAL 100           HA       VAL 100  13.821  -3.557  11.754
  706    HB   VAL 100           HB       VAL 100  11.746  -5.743  11.484
  707   1HG1  VAL 100          1HG1      VAL 100  14.679  -5.889  12.178
  708   2HG1  VAL 100          2HG1      VAL 100  13.942  -6.406  10.662
  709   3HG1  VAL 100          3HG1      VAL 100  13.551  -7.247  12.162
  710   1HG2  VAL 100          1HG2      VAL 100  12.166  -6.173  13.869
  711   2HG2  VAL 100          2HG2      VAL 100  11.465  -4.578  13.588
  712   3HG2  VAL 100          3HG2      VAL 100  13.188  -4.736  13.932
  713    H    CYS 101           H        CYS 101  11.209  -3.499   9.551
  714    HA   CYS 101           HA       CYS 101  12.426  -5.072   7.505
  715   1HB   CYS 101          2HB       CYS 101  10.045  -3.218   7.436
  716   2HB   CYS 101          1HB       CYS 101  10.541  -4.253   6.096
  717    H    ALA 102           H        ALA 102  12.199  -1.599   8.136
  718    HA   ALA 102           HA       ALA 102  13.295  -0.831   5.624
  719   1HB   ALA 102          1HB       ALA 102  13.593   1.368   6.619
  720   2HB   ALA 102          2HB       ALA 102  13.269   0.701   8.220
  721   3HB   ALA 102          3HB       ALA 102  11.996   0.722   6.999
  722    H    ALA 103           H        ALA 103  14.659  -1.343   8.851
  723    HA   ALA 103           HA       ALA 103  17.292  -0.590   8.265
  724   1HB   ALA 103          1HB       ALA 103  16.340  -2.620  10.281
  725   2HB   ALA 103          2HB       ALA 103  16.460  -0.881  10.549
  726   3HB   ALA 103          3HB       ALA 103  17.918  -1.833  10.266
  727    H    ARG 104           H        ARG 104  15.614  -3.656   7.937
  728    HA   ARG 104           HA       ARG 104  17.867  -5.170   7.123
  729   1HB   ARG 104          2HB       ARG 104  15.004  -5.553   7.434
  730   2HB   ARG 104          1HB       ARG 104  15.658  -6.426   6.050
  731   1HG   ARG 104          2HG       ARG 104  15.589  -7.613   8.284
  732   2HG   ARG 104          1HG       ARG 104  17.100  -7.674   7.378
  733   1HD   ARG 104          2HD       ARG 104  18.216  -6.451   8.909
  734   2HD   ARG 104          1HD       ARG 104  16.825  -5.415   9.239
  735    HE   ARG 104           HE       ARG 104  15.955  -7.459  10.453
  736   1HH1  ARG 104          1HH1      ARG 104  19.351  -6.683  10.209
  737   2HH1  ARG 104          2HH1      ARG 104  19.771  -7.427  11.724
  738   1HH2  ARG 104          1HH2      ARG 104  16.479  -8.423  12.474
  739   2HH2  ARG 104          2HH2      ARG 104  18.130  -8.402  13.024
  740    H    ALA 105           H        ALA 105  15.788  -2.966   5.499
  741    HA   ALA 105           HA       ALA 105  16.337  -4.064   2.841
  742   1HB   ALA 105          1HB       ALA 105  14.650  -2.504   2.094
  743   2HB   ALA 105          2HB       ALA 105  14.569  -1.794   3.706
  744   3HB   ALA 105          3HB       ALA 105  14.054  -3.462   3.450
  745    H    GLY 106           H        GLY 106  17.323  -1.472   4.915
  746   1HA   GLY 106          2HA       GLY 106  19.458  -0.379   4.210
  747   2HA   GLY 106          1HA       GLY 106  18.694  -0.166   2.642
  748    H    ALA 107           H        ALA 107  17.889   0.481   6.033
  749    HA   ALA 107           HA       ALA 107  16.209   2.691   5.419
  750   1HB   ALA 107          1HB       ALA 107  15.840   1.252   7.380
  751   2HB   ALA 107          2HB       ALA 107  15.984   2.955   7.816
  752   3HB   ALA 107          3HB       ALA 107  17.337   1.858   8.085
  753    H    ARG 108           H        ARG 108  16.524   4.870   6.023
  754    HA   ARG 108           HA       ARG 108  19.340   5.677   6.193
  755   1HB   ARG 108          2HB       ARG 108  17.270   6.883   4.354
  756   2HB   ARG 108          1HB       ARG 108  18.958   7.358   4.477
  757   1HG   ARG 108          2HG       ARG 108  19.702   5.338   3.513
  758   2HG   ARG 108          1HG       ARG 108  18.113   4.581   3.683
  759   1HD   ARG 108          2HD       ARG 108  17.186   6.176   2.074
  760   2HD   ARG 108          1HD       ARG 108  18.766   6.946   1.919
  761    HE   ARG 108           HE       ARG 108  19.225   4.326   1.302
  762   1HH1  ARG 108          1HH1      ARG 108  17.109   6.840   0.083
  763   2HH1  ARG 108          2HH1      ARG 108  17.037   6.166  -1.520
  764   1HH2  ARG 108          1HH2      ARG 108  19.154   3.468  -0.812
  765   2HH2  ARG 108          2HH2      ARG 108  18.186   4.268  -2.030