*HEADER    DE NOVO PROTEIN                         25-JUN-07   2JRE              
*TITLE     C60-1, A PDZ DOMAIN DESIGNED USING STATISTICAL COUPLING               
*TITLE    2 ANALYSIS                                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: C60-1 PDZ DOMAIN PEPTIDE;                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE PEPTIDE IS A SYNTHETIC CONSTRUCT                  
*SOURCE   4 DESIGNED USING STATISTICAL COUPLING ANALYSIS AND EXPRESSED           
*SOURCE   5 IN ESCHERICHIA COLI BL21 CELLS USING THE PHIS8.3 VECTOR.             
*KEYWDS    C60-1, PDZ, DE NOVO PROTEIN                                           
*EXPDTA    NMR, 25 STRUCTURES                                                    
*AUTHOR    C.LARSON, M.STIFFLER, P.LI, M.ROSEN, G.MACBEATH,                      
*AUTHOR   2 R.RANGANATHAN                                                        
*REVDAT   1   01-JUL-08 2JRE    0                                                


 ASSI {    1}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 72   and name HG2%)
      3.900     1.900     1.900 peak     1 spectrum    1 weight  0.10000E+01 volume  0.18813E-02 ppm1      9.971 ppm2      0.559 CV     1
 ASSI {    1}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 98   and name HD2%)
      3.900     1.900     1.900 peak     1 spectrum    1 weight  0.10000E+01 volume  0.60819E-03 ppm1      9.970 ppm2      0.675 CV     1
 ASSI {    2}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 96   and name HG1%)
      4.500     2.500     1.500 peak     2 spectrum    1 weight  0.10000E+01 volume  0.38923E-03 ppm1      9.971 ppm2      0.745 CV     1
 ASSI {    3}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      5.100     3.300     0.900 peak     3 spectrum    1 weight  0.10000E+01 volume  0.14507E-03 ppm1      9.974 ppm2      0.872 CV     1
 ASSI {    4}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HB  ))
      3.200     1.300     1.300 peak     4 spectrum    1 weight  0.10000E+01 volume  0.13059E-02 ppm1      9.974 ppm2      1.656 CV     1
 ASSI {    5}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      2.300     0.700     0.700 peak     5 spectrum    1 weight  0.10000E+01 volume  0.34577E-02 ppm1      9.969 ppm2      4.028 CV     1
 ASSI {    6}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      2.400     0.700     0.700 peak     6 spectrum    1 weight  0.10000E+01 volume  0.31944E-02 ppm1      9.970 ppm2      4.251 CV     1
 ASSI {    7}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      4.100     2.100     1.900 peak     7 spectrum    1 weight  0.10000E+01 volume  0.24321E-03 ppm1      9.974 ppm2      5.132 CV     1
 ASSI {    9}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
      3.400     1.500     1.500 peak     9 spectrum    1 weight  0.10000E+01 volume  0.77735E-03 ppm1      9.698 ppm2      0.556 CV     1
 ASSI {   10}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
      3.300     1.300     1.300 peak    10 spectrum    1 weight  0.10000E+01 volume  0.14395E-02 ppm1      9.702 ppm2      2.123 CV     1
 OR {   10}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HG1 ))
 ASSI {   11}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HB1 ))
      4.000     2.000     2.000 peak    11 spectrum    1 weight  0.10000E+01 volume  0.42231E-03 ppm1      9.704 ppm2      2.935 CV     1
 OR {   11}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI {   12}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      2.500     0.800     0.800 peak    12 spectrum    1 weight  0.10000E+01 volume  0.30420E-02 ppm1      9.700 ppm2      3.789 CV     1
 ASSI {   13}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      2.600     0.800     0.800 peak    13 spectrum    1 weight  0.10000E+01 volume  0.27293E-02 ppm1      9.698 ppm2      4.186 CV     1
 ASSI {   15}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
      2.900     1.000     1.000 peak    15 spectrum    1 weight  0.10000E+01 volume  0.20304E-02 ppm1      9.430 ppm2      0.564 CV     1
 ASSI {   16}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
      4.400     2.400     1.600 peak    16 spectrum    1 weight  0.10000E+01 volume  0.56795E-03 ppm1      9.429 ppm2      0.678 CV     1
 ASSI {   17}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HG2 ))
      4.600     2.700     1.400 peak    17 spectrum    1 weight  0.10000E+01 volume  0.36985E-03 ppm1      9.427 ppm2      1.220 CV     1
 OR {   17}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HG1 ))
 ASSI {   19}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
      2.900     1.000     1.000 peak    19 spectrum    1 weight  0.10000E+01 volume  0.10843E-02 ppm1      9.428 ppm2      1.483 CV     1
 OR {   19}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
 ASSI {   21}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      2.400     0.700     0.700 peak    21 spectrum    1 weight  0.10000E+01 volume  0.20266E-02 ppm1      9.426 ppm2      3.678 CV     1
 ASSI {   22}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      3.200     1.300     1.300 peak    22 spectrum    1 weight  0.10000E+01 volume  0.70218E-03 ppm1      9.427 ppm2      4.295 CV     1
 ASSI {   23}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      3.100     1.200     1.200 peak    23 spectrum    1 weight  0.10000E+01 volume  0.91933E-03 ppm1      9.422 ppm2      5.194 CV     1
 ASSI {   25}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      4.300     2.300     1.700 peak    25 spectrum    1 weight  0.10000E+01 volume  0.31138E-03 ppm1      9.428 ppm2      8.837 CV     1
 ASSI {   26}
   (( segid "    " and resid 14   and name HN  ))
   (  segid "    " and resid 100  and name HD1%)
      4.000     2.000     2.000 peak    26 spectrum    1 weight  0.10000E+01 volume  0.24999E-03 ppm1      9.179 ppm2      0.516 CV     1
 ASSI {   27}
   (( segid "    " and resid 14   and name HN  ))
   (  segid "    " and resid 13   and name HD2%)
      3.200     1.300     1.300 peak    27 spectrum    1 weight  0.10000E+01 volume  0.31179E-02 ppm1      9.184 ppm2      0.694 CV     1
 ASSI {   28}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 101  and name HG12))
      4.800     2.900     1.200 peak    28 spectrum    1 weight  0.10000E+01 volume  0.28587E-03 ppm1      9.189 ppm2      0.837 CV     1
 OR {   28}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 101  and name HG11))
 ASSI {   29}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 100  and name HB1 ))
      4.300     2.400     1.700 peak    29 spectrum    1 weight  0.10000E+01 volume  0.24768E-03 ppm1      9.179 ppm2      1.222 CV     1
 OR {   29}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 100  and name HB2 ))
 ASSI {   30}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HB1 ))
      3.200     1.300     1.300 peak    30 spectrum    1 weight  0.10000E+01 volume  0.17076E-02 ppm1      9.185 ppm2      1.383 CV     1
 OR {   30}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HB2 ))
 ASSI {   32}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 14   and name HB2 ))
      3.100     1.200     1.200 peak    32 spectrum    1 weight  0.10000E+01 volume  0.10195E-02 ppm1      9.185 ppm2      2.821 CV     1
 OR {   32}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 14   and name HB1 ))
 ASSI {   33}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 14   and name HA  ))
      3.000     1.200     1.200 peak    33 spectrum    1 weight  0.10000E+01 volume  0.10616E-02 ppm1      9.183 ppm2      4.836 CV     1
 ASSI {   34}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      2.100     0.600     0.600 peak    34 spectrum    1 weight  0.10000E+01 volume  0.58098E-02 ppm1      9.186 ppm2      5.178 CV     1
 ASSI {   37}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 100  and name HN  ))
      3.300     1.300     1.300 peak    37 spectrum    1 weight  0.10000E+01 volume  0.64887E-03 ppm1      9.183 ppm2      8.878 CV     1
 ASSI {   38}
   (( segid "    " and resid 19   and name HN  ))
   (  segid "    " and resid 18   and name HD2%)
      3.800     1.800     1.800 peak    38 spectrum    1 weight  0.10000E+01 volume  0.18294E-02 ppm1      9.110 ppm2      0.749 CV     1
 ASSI {   39}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HB1 ))
      3.200     1.300     1.300 peak    39 spectrum    1 weight  0.10000E+01 volume  0.95269E-03 ppm1      9.108 ppm2      1.110 CV     1
 OR {   39}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HB2 ))
 ASSI {   40}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HG  ))
      4.600     2.700     1.400 peak    40 spectrum    1 weight  0.10000E+01 volume  0.42312E-03 ppm1      9.112 ppm2      1.372 CV     1
 ASSI {   42}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      2.600     0.800     0.800 peak    42 spectrum    1 weight  0.10000E+01 volume  0.44870E-02 ppm1      9.110 ppm2      2.847 CV     1
 OR {   42}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI {   43}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
      2.800     1.000     1.000 peak    43 spectrum    1 weight  0.10000E+01 volume  0.10614E-02 ppm1      9.111 ppm2      4.562 CV     1
 ASSI {   44}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      3.900     1.900     1.900 peak    44 spectrum    1 weight  0.10000E+01 volume  0.56282E-03 ppm1      9.110 ppm2      8.680 CV     1
 ASSI {   45}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 56   and name HB% )
      2.400     0.700     0.700 peak    45 spectrum    1 weight  0.10000E+01 volume  0.40861E-02 ppm1      9.111 ppm2      1.503 CV     1
 ASSI {   46}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
      3.100     1.200     1.200 peak    46 spectrum    1 weight  0.10000E+01 volume  0.96570E-03 ppm1      9.105 ppm2      3.706 CV     1
 OR {   46}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
 ASSI {   47}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      2.700     0.900     0.900 peak    47 spectrum    1 weight  0.10000E+01 volume  0.26986E-02 ppm1      9.114 ppm2      4.088 CV     1
 ASSI {   48}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      2.600     0.800     0.800 peak    48 spectrum    1 weight  0.10000E+01 volume  0.31771E-02 ppm1      9.113 ppm2      4.394 CV     1
 ASSI {   51}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 101  and name HD1%)
      5.100     3.200     0.900 peak    51 spectrum    1 weight  0.10000E+01 volume  0.32603E-03 ppm1      9.061 ppm2      0.435 CV     1
 ASSI {   52}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 101  and name HG2%)
      3.700     1.700     1.700 peak    52 spectrum    1 weight  0.10000E+01 volume  0.10461E-02 ppm1      9.056 ppm2      0.768 CV     1
 ASSI {   54}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HG12))
      3.000     1.100     1.100 peak    54 spectrum    1 weight  0.10000E+01 volume  0.94447E-03 ppm1      9.048 ppm2      1.397 CV     1
 OR {   54}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HG11))
 ASSI {   55}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HB  ))
      3.800     1.800     1.800 peak    55 spectrum    1 weight  0.10000E+01 volume  0.11658E-02 ppm1      9.055 ppm2      1.493 CV     1
 ASSI {   56}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 102  and name HB2 ))
      2.800     1.000     1.000 peak    56 spectrum    1 weight  0.10000E+01 volume  0.16490E-02 ppm1      9.049 ppm2      1.810 CV     1
 OR {   56}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 102  and name HB1 ))
 ASSI {   57}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      2.200     0.600     0.600 peak    57 spectrum    1 weight  0.10000E+01 volume  0.39756E-02 ppm1      9.056 ppm2      5.217 CV     1
 ASSI {   58}
   (( segid "    " and resid 12   and name HN  ))
   (  segid "    " and resid 104  and name HD2%)
      3.600     1.600     1.600 peak    58 spectrum    1 weight  0.10000E+01 volume  0.10811E-02 ppm1      9.040 ppm2      0.750 CV     1
 ASSI {   59}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 104  and name HG  ))
      3.000     1.100     1.100 peak    59 spectrum    1 weight  0.10000E+01 volume  0.11932E-02 ppm1      9.043 ppm2      1.357 CV     1
 ASSI {   60}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 102  and name HB1 ))
      4.300     2.300     1.700 peak    60 spectrum    1 weight  0.10000E+01 volume  0.23624E-03 ppm1      9.051 ppm2      1.807 CV     1
 OR {   60}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 102  and name HB2 ))
 ASSI {   62}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HB1 ))
      3.400     1.500     1.500 peak    62 spectrum    1 weight  0.10000E+01 volume  0.13859E-02 ppm1      9.049 ppm2      2.876 CV     1
 OR {   62}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HB2 ))
 ASSI {   63}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HB2 ))
      2.800     1.000     1.000 peak    63 spectrum    1 weight  0.10000E+01 volume  0.20269E-02 ppm1      9.045 ppm2      3.661 CV     1
 OR {   63}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HB1 ))
 ASSI {   64}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      4.000     2.000     2.000 peak    64 spectrum    1 weight  0.10000E+01 volume  0.40671E-03 ppm1      9.040 ppm2      4.236 CV     1
 ASSI {   65}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      3.200     1.300     1.300 peak    65 spectrum    1 weight  0.10000E+01 volume  0.81076E-03 ppm1      9.045 ppm2      4.724 CV     1
 ASSI {   66}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      2.300     0.700     0.700 peak    66 spectrum    1 weight  0.10000E+01 volume  0.41465E-02 ppm1      9.041 ppm2      5.270 CV     1
 ASSI {   69}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 46   and name HD1%)
      3.500     1.500     1.500 peak    69 spectrum    1 weight  0.10000E+01 volume  0.67876E-03 ppm1      9.005 ppm2      0.592 CV     1
 ASSI {   70}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 81   and name HB% )
      2.700     0.900     0.900 peak    70 spectrum    1 weight  0.10000E+01 volume  0.27873E-02 ppm1      9.006 ppm2      1.410 CV     1
 ASSI {   71}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HB1 ))
      2.300     0.600     0.600 peak    71 spectrum    1 weight  0.10000E+01 volume  0.57775E-02 ppm1      9.006 ppm2      2.007 CV     1
 OR {   71}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HB2 ))
 ASSI {   72}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HG2 ))
      3.600     1.600     1.600 peak    72 spectrum    1 weight  0.10000E+01 volume  0.20692E-02 ppm1      9.006 ppm2      2.160 CV     1
 OR {   72}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HG1 ))
 ASSI {   73}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      2.800     1.000     1.000 peak    73 spectrum    1 weight  0.10000E+01 volume  0.17536E-02 ppm1      9.005 ppm2      3.572 CV     1
 ASSI {   74}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HA  ))
      2.300     0.600     0.600 peak    74 spectrum    1 weight  0.10000E+01 volume  0.56113E-02 ppm1      9.005 ppm2      4.254 CV     1
 ASSI {   77}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 59   and name HD1%)
      4.500     2.600     1.500 peak    77 spectrum    1 weight  0.10000E+01 volume  0.32194E-03 ppm1      9.011 ppm2      0.709 CV     1
 ASSI {   78}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 59   and name HD2%)
      3.700     1.700     1.700 peak    78 spectrum    1 weight  0.10000E+01 volume  0.51084E-03 ppm1      9.012 ppm2      0.779 CV     1
 ASSI {   79}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 58   and name HB% )
      2.800     1.000     1.000 peak    79 spectrum    1 weight  0.10000E+01 volume  0.17497E-02 ppm1      9.012 ppm2      1.365 CV     1
 ASSI {   81}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HG1 ))
      3.000     3.000     3.000 peak    81 spectrum    1 weight  0.10000E+01 volume  0.34712E-03 ppm1      9.006 ppm2      1.911 CV     1
 OR {   81}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HG2 ))
 ASSI {   82}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
      3.800     1.800     1.800 peak    82 spectrum    1 weight  0.10000E+01 volume  0.86050E-03 ppm1      9.011 ppm2      2.230 CV     1
 OR {   82}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
 ASSI {   83}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HA2 ))
      2.500     0.800     0.800 peak    83 spectrum    1 weight  0.10000E+01 volume  0.36657E-02 ppm1      9.011 ppm2      3.473 CV     1
 OR {   83}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HA1 ))
 ASSI {   84}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      2.000     0.500     0.500 peak    84 spectrum    1 weight  0.10000E+01 volume  0.82113E-02 ppm1      9.011 ppm2      4.112 CV     1
 ASSI {   86}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 69   and name HG2%)
      2.400     0.700     0.700 peak    86 spectrum    1 weight  0.10000E+01 volume  0.36707E-02 ppm1      8.962 ppm2      0.514 CV     1
 ASSI {   88}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 101  and name HG2%)
      4.800     2.900     1.200 peak    88 spectrum    1 weight  0.10000E+01 volume  0.29673E-03 ppm1      8.961 ppm2      0.745 CV     1
 ASSI {   90}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HB2 ))
      2.600     0.800     0.800 peak    90 spectrum    1 weight  0.10000E+01 volume  0.25243E-02 ppm1      8.963 ppm2      1.331 CV     1
 OR {   90}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HB1 ))
 ASSI {   91}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      2.500     0.800     0.800 peak    91 spectrum    1 weight  0.10000E+01 volume  0.14516E-02 ppm1      8.962 ppm2      3.862 CV     1
 ASSI {   92}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      3.300     1.400     1.400 peak    92 spectrum    1 weight  0.10000E+01 volume  0.40245E-03 ppm1      8.972 ppm2      5.321 CV     1
 ASSI {   94}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 100  and name HD1%)
      3.700     3.700     2.300 peak    94 spectrum    1 weight  0.10000E+01 volume  0.10267E-02 ppm1      8.913 ppm2      0.524 CV     1
 ASSI {   95}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 98   and name HD1%)
      3.600     1.600     1.600 peak    95 spectrum    1 weight  0.10000E+01 volume  0.15674E-02 ppm1      8.909 ppm2      0.577 CV     1
 ASSI {   96}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 98   and name HD2%)
      3.700     1.700     1.700 peak    96 spectrum    1 weight  0.10000E+01 volume  0.10706E-02 ppm1      8.909 ppm2      0.680 CV     1
 ASSI {   97}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 16   and name HG2%)
      3.700     1.700     1.700 peak    97 spectrum    1 weight  0.10000E+01 volume  0.11943E-02 ppm1      8.904 ppm2      0.744 CV     1
 ASSI {   98}
   (( segid "    " and resid 98   and name HN  ))
   (  segid "    " and resid 16   and name HG1%)
      4.200     2.200     1.800 peak    98 spectrum    1 weight  0.10000E+01 volume  0.41917E-03 ppm1      8.912 ppm2      0.857 CV     1
 ASSI {   99}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 98   and name HB2 ))
      3.000     1.100     1.100 peak    99 spectrum    1 weight  0.10000E+01 volume  0.12412E-02 ppm1      8.905 ppm2      1.162 CV     1
 OR {   99}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 98   and name HB1 ))
 ASSI {  100}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HG2 ))
      3.000     1.100     1.100 peak   100 spectrum    1 weight  0.10000E+01 volume  0.10707E-02 ppm1      8.914 ppm2      1.313 CV     1
 OR {  100}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HG1 ))
 ASSI {  101}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 98   and name HG  ))
      2.600     0.800     0.800 peak   101 spectrum    1 weight  0.10000E+01 volume  0.21140E-02 ppm1      8.909 ppm2      1.460 CV     1
 ASSI {  104}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      2.300     0.700     0.700 peak   104 spectrum    1 weight  0.10000E+01 volume  0.40010E-02 ppm1      8.909 ppm2      4.958 CV     1
 ASSI {  105}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
      3.000     1.100     1.100 peak   105 spectrum    1 weight  0.10000E+01 volume  0.16700E-02 ppm1      8.910 ppm2      5.079 CV     1
 ASSI {  106}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
      4.600     2.700     1.400 peak   106 spectrum    1 weight  0.10000E+01 volume  0.23237E-03 ppm1      8.903 ppm2      5.440 CV     1
 ASSI {  109}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 18   and name HN  ))
      4.100     2.100     1.900 peak   109 spectrum    1 weight  0.10000E+01 volume  0.40231E-03 ppm1      8.909 ppm2      8.719 CV     1
 ASSI {  110}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 100  and name HD1%)
      2.500     0.800     0.800 peak   110 spectrum    1 weight  0.10000E+01 volume  0.25833E-02 ppm1      8.887 ppm2      0.522 CV     1
 ASSI {  111}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 99   and name HD1%)
      2.600     0.800     0.800 peak   111 spectrum    1 weight  0.10000E+01 volume  0.61273E-02 ppm1      8.887 ppm2      0.690 CV     1
 ASSI {  112}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
      3.400     1.400     1.400 peak   112 spectrum    1 weight  0.10000E+01 volume  0.23969E-02 ppm1      8.889 ppm2      1.212 CV     1
 OR {  112}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
 ASSI {  113}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      2.200     0.600     0.600 peak   113 spectrum    1 weight  0.10000E+01 volume  0.39499E-02 ppm1      8.881 ppm2      4.842 CV     1
 ASSI {  114}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      3.000     1.100     1.100 peak   114 spectrum    1 weight  0.10000E+01 volume  0.83955E-03 ppm1      8.888 ppm2      5.321 CV     1
 ASSI {  115}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
      3.100     1.200     1.200 peak   115 spectrum    1 weight  0.10000E+01 volume  0.89748E-03 ppm1      8.894 ppm2      5.453 CV     1
 ASSI {  116}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
      3.900     1.900     1.900 peak   116 spectrum    1 weight  0.10000E+01 volume  0.50720E-03 ppm1      8.884 ppm2      8.745 CV     1
 ASSI {  118}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
      3.600     1.700     1.700 peak   118 spectrum    1 weight  0.10000E+01 volume  0.16292E-02 ppm1      8.871 ppm2      0.553 CV     1
 ASSI {  119}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
      2.400     0.700     0.700 peak   119 spectrum    1 weight  0.10000E+01 volume  0.31148E-02 ppm1      8.871 ppm2      0.680 CV     1
 ASSI {  120}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HB  ))
      2.700     0.900     0.900 peak   120 spectrum    1 weight  0.10000E+01 volume  0.16534E-02 ppm1      8.873 ppm2      2.115 CV     1
 ASSI {  121}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HB1 ))
      3.000     1.100     1.100 peak   121 spectrum    1 weight  0.10000E+01 volume  0.19331E-02 ppm1      8.874 ppm2      2.559 CV     1
 OR {  121}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI {  122}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      3.100     1.200     1.200 peak   122 spectrum    1 weight  0.10000E+01 volume  0.64678E-03 ppm1      8.873 ppm2      3.676 CV     1
 ASSI {  123}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      3.900     1.900     1.900 peak   123 spectrum    1 weight  0.10000E+01 volume  0.39901E-03 ppm1      8.871 ppm2      4.662 CV     1
 ASSI {  124}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      2.400     0.700     0.700 peak   124 spectrum    1 weight  0.10000E+01 volume  0.24922E-02 ppm1      8.871 ppm2      5.112 CV     1
 ASSI {  125}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 51   and name HD2%)
      3.700     1.700     1.700 peak   125 spectrum    1 weight  0.10000E+01 volume  0.11524E-02 ppm1      8.849 ppm2      0.567 CV     1
 ASSI {  126}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 52   and name HD1%)
      3.500     1.500     1.500 peak   126 spectrum    1 weight  0.10000E+01 volume  0.14386E-02 ppm1      8.855 ppm2      0.663 CV     1
 ASSI {  127}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 52   and name HG2%)
      3.800     1.800     1.800 peak   127 spectrum    1 weight  0.10000E+01 volume  0.12244E-02 ppm1      8.854 ppm2      0.882 CV     1
 ASSI {  129}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HG12))
      2.700     0.900     0.900 peak   129 spectrum    1 weight  0.10000E+01 volume  0.25184E-02 ppm1      8.855 ppm2      1.387 CV     1
 OR {  129}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HG11))
 ASSI {  130}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HB  ))
      2.400     0.700     0.700 peak   130 spectrum    1 weight  0.10000E+01 volume  0.31169E-02 ppm1      8.853 ppm2      1.590 CV     1
 ASSI {  131}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 28   and name HA1 ))
      3.900     1.900     1.900 peak   131 spectrum    1 weight  0.10000E+01 volume  0.25890E-03 ppm1      8.852 ppm2      3.459 CV     1
 OR {  131}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 28   and name HA2 ))
 ASSI {  132}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      4.800     2.900     1.200 peak   132 spectrum    1 weight  0.10000E+01 volume  0.19707E-03 ppm1      8.857 ppm2      3.701 CV     1
 OR {  132}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
 ASSI {  133}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
      3.100     1.200     1.200 peak   133 spectrum    1 weight  0.10000E+01 volume  0.79461E-03 ppm1      8.852 ppm2      4.120 CV     1
 ASSI {  134}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      2.400     0.700     0.700 peak   134 spectrum    1 weight  0.10000E+01 volume  0.29236E-02 ppm1      8.857 ppm2      5.258 CV     1
 ASSI {  135}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 31   and name HG2%)
      3.400     1.500     1.500 peak   135 spectrum    1 weight  0.10000E+01 volume  0.22911E-02 ppm1      8.831 ppm2      0.577 CV     1
 ASSI {  136}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      3.600     1.600     1.600 peak   136 spectrum    1 weight  0.10000E+01 volume  0.14870E-02 ppm1      8.829 ppm2      0.670 CV     1
 ASSI {  137}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HG12))
      4.000     2.000     2.000 peak   137 spectrum    1 weight  0.10000E+01 volume  0.49976E-03 ppm1      8.825 ppm2      1.198 CV     1
 OR {  137}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HG11))
 ASSI {  138}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HB  ))
      2.600     0.800     0.800 peak   138 spectrum    1 weight  0.10000E+01 volume  0.22083E-02 ppm1      8.834 ppm2      1.754 CV     1
 ASSI {  139}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HB1 ))
      3.300     1.400     1.400 peak   139 spectrum    1 weight  0.10000E+01 volume  0.74342E-03 ppm1      8.832 ppm2      3.431 CV     1
 ASSI {  140}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HB1 ))
      3.100     1.200     1.200 peak   140 spectrum    1 weight  0.10000E+01 volume  0.11534E-02 ppm1      8.830 ppm2      3.671 CV     1
 OR {  140}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
 ASSI {  141}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      2.900     1.100     1.100 peak   141 spectrum    1 weight  0.10000E+01 volume  0.12504E-02 ppm1      8.832 ppm2      4.519 CV     1
 ASSI {  142}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      2.400     0.700     0.700 peak   142 spectrum    1 weight  0.10000E+01 volume  0.34101E-02 ppm1      8.831 ppm2      5.188 CV     1
 ASSI {  144}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 104  and name HD2%)
      4.100     2.100     1.900 peak   144 spectrum    1 weight  0.10000E+01 volume  0.49108E-03 ppm1      8.826 ppm2      0.731 CV     1
 OR {  144}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 104  and name HD1%)
 ASSI {  145}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HG1 ))
      3.500     1.600     1.600 peak   145 spectrum    1 weight  0.10000E+01 volume  0.12057E-02 ppm1      8.827 ppm2      1.509 CV     1
 OR {  145}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HG2 ))
 ASSI {  146}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HD2 ))
      4.500     2.500     1.500 peak   146 spectrum    1 weight  0.10000E+01 volume  0.36629E-03 ppm1      8.826 ppm2      2.999 CV     1
 OR {  146}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HD1 ))
 ASSI {  147}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HD1 ))
      4.100     2.100     1.900 peak   147 spectrum    1 weight  0.10000E+01 volume  0.21384E-03 ppm1      8.821 ppm2      3.191 CV     1
 OR {  147}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HD2 ))
 ASSI {  148}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      3.000     1.100     1.100 peak   148 spectrum    1 weight  0.10000E+01 volume  0.11112E-02 ppm1      8.823 ppm2      4.230 CV     1
 ASSI {  149}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HN  ))
      4.000     2.000     2.000 peak   149 spectrum    1 weight  0.10000E+01 volume  0.52144E-03 ppm1      8.825 ppm2      9.050 CV     1
 ASSI {  151}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 27   and name HD2%)
      4.100     2.100     1.900 peak   151 spectrum    1 weight  0.10000E+01 volume  0.73659E-03 ppm1      8.788 ppm2      0.733 CV     1
 ASSI {  152}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 27   and name HD1%)
      4.400     2.500     1.600 peak   152 spectrum    1 weight  0.10000E+01 volume  0.44055E-03 ppm1      8.786 ppm2      0.812 CV     1
 ASSI {  153}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HB1 ))
      2.800     0.900     0.900 peak   153 spectrum    1 weight  0.10000E+01 volume  0.15057E-02 ppm1      8.784 ppm2      1.460 CV     1
 OR {  153}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HB2 ))
 ASSI {  154}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 52   and name HB  ))
      4.800     2.800     1.200 peak   154 spectrum    1 weight  0.10000E+01 volume  0.10160E-02 ppm1      8.782 ppm2      1.619 CV     1
 ASSI {  157}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HB1 ))
      3.600     1.600     1.600 peak   157 spectrum    1 weight  0.10000E+01 volume  0.67210E-03 ppm1      8.783 ppm2      3.871 CV     1
 OR {  157}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HB2 ))
 ASSI {  158}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HA  ))
      3.000     1.100     1.100 peak   158 spectrum    1 weight  0.10000E+01 volume  0.96958E-03 ppm1      8.782 ppm2      4.108 CV     1
 ASSI {  159}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      2.300     0.700     0.700 peak   159 spectrum    1 weight  0.10000E+01 volume  0.39256E-02 ppm1      8.782 ppm2      4.442 CV     1
 ASSI {  160}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 28   and name HN  ))
      2.800     1.000     1.000 peak   160 spectrum    1 weight  0.10000E+01 volume  0.97055E-03 ppm1      8.784 ppm2      8.149 CV     1
 ASSI {  161}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HN  ))
      4.700     2.700     1.300 peak   161 spectrum    1 weight  0.10000E+01 volume  0.19919E-03 ppm1      8.778 ppm2      8.364 CV     1
 ASSI {  162}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
      3.800     1.800     1.800 peak   162 spectrum    1 weight  0.10000E+01 volume  0.56434E-03 ppm1      8.788 ppm2      0.901 CV     1
 ASSI {  163}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 81   and name HB% )
      2.300     0.700     0.700 peak   163 spectrum    1 weight  0.10000E+01 volume  0.62229E-02 ppm1      8.789 ppm2      1.412 CV     1
 ASSI {  164}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HB2 ))
      3.000     1.100     1.100 peak   164 spectrum    1 weight  0.10000E+01 volume  0.13975E-02 ppm1      8.789 ppm2      1.821 CV     1
 OR {  164}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HB1 ))
 ASSI {  165}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 80   and name HE% )
      3.700     1.700     1.700 peak   165 spectrum    1 weight  0.10000E+01 volume  0.25248E-02 ppm1      8.790 ppm2      1.898 CV     1
 ASSI {  167}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HG2 ))
      3.700     1.700     1.700 peak   167 spectrum    1 weight  0.10000E+01 volume  0.10849E-02 ppm1      8.791 ppm2      2.483 CV     1
 ASSI {  168}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 84   and name HB2 ))
      3.400     1.500     1.500 peak   168 spectrum    1 weight  0.10000E+01 volume  0.70173E-03 ppm1      8.787 ppm2      2.689 CV     1
 OR {  168}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 84   and name HB1 ))
 ASSI {  170}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      2.000     0.500     0.500 peak   170 spectrum    1 weight  0.10000E+01 volume  0.99352E-02 ppm1      8.789 ppm2      4.193 CV     1
 ASSI {  171}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 84   and name HN  ))
      3.900     1.900     1.900 peak   171 spectrum    1 weight  0.10000E+01 volume  0.50282E-03 ppm1      8.786 ppm2      6.972 CV     1
 ASSI {  173}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 82   and name HN  ))
      4.500     2.500     1.500 peak   173 spectrum    1 weight  0.10000E+01 volume  0.52477E-03 ppm1      8.788 ppm2      9.003 CV     1
 ASSI {  174}
   (( segid "    " and resid 62   and name HE  ))
   (  segid "    " and resid 16   and name HG2%)
      3.800     1.900     1.900 peak   174 spectrum    1 weight  0.10000E+01 volume  0.32995E-03 ppm1      8.784 ppm2      0.746 CV     1
 ASSI {  175}
   (( segid "    " and resid 62   and name HE  ))
   (  segid "    " and resid 16   and name HG1%)
      3.600     1.600     1.600 peak   175 spectrum    1 weight  0.10000E+01 volume  0.51823E-03 ppm1      8.785 ppm2      0.855 CV     1
 ASSI {  176}
   (( segid "    " and resid 62   and name HE  ))
   (( segid "    " and resid 62   and name HB1 ))
      2.400     0.700     0.700 peak   176 spectrum    1 weight  0.10000E+01 volume  0.33002E-02 ppm1      8.792 ppm2      1.565 CV     1
 OR {  176}
   (( segid "    " and resid 62   and name HE  ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI {  178}
   (( segid "    " and resid 62   and name HE  ))
   (( segid "    " and resid 62   and name HD2 ))
      3.300     1.400     1.400 peak   178 spectrum    1 weight  0.10000E+01 volume  0.66176E-03 ppm1      8.785 ppm2      3.031 CV     1
 OR {  178}
   (( segid "    " and resid 62   and name HE  ))
   (( segid "    " and resid 62   and name HD1 ))
 ASSI {  181}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 100  and name HD1%)
      3.200     1.300     1.300 peak   181 spectrum    1 weight  0.10000E+01 volume  0.17836E-02 ppm1      8.742 ppm2      0.520 CV     1
 ASSI {  182}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 100  and name HD2%)
      2.300     2.300     3.700 peak   182 spectrum    1 weight  0.10000E+01 volume  0.17669E-02 ppm1      8.741 ppm2      0.681 CV     1
 ASSI {  183}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 101  and name HG2%)
      2.400     0.700     0.700 peak   183 spectrum    1 weight  0.10000E+01 volume  0.25479E-02 ppm1      8.745 ppm2      0.762 CV     1
 ASSI {  184}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 70   and name HG  ))
      2.700     0.900     0.900 peak   184 spectrum    1 weight  0.10000E+01 volume  0.16071E-02 ppm1      8.747 ppm2      1.312 CV     1
 ASSI {  185}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HB  ))
      3.000     1.100     1.100 peak   185 spectrum    1 weight  0.10000E+01 volume  0.12286E-02 ppm1      8.742 ppm2      1.480 CV     1
 ASSI {  186}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 68   and name HB1 ))
      4.600     2.600     1.400 peak   186 spectrum    1 weight  0.10000E+01 volume  0.20531E-03 ppm1      8.738 ppm2      1.681 CV     1
 OR {  186}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
 ASSI {  187}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      2.800     1.000     1.000 peak   187 spectrum    1 weight  0.10000E+01 volume  0.11325E-02 ppm1      8.738 ppm2      5.219 CV     1
 ASSI {  188}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      2.400     0.700     0.700 peak   188 spectrum    1 weight  0.10000E+01 volume  0.23783E-02 ppm1      8.742 ppm2      5.325 CV     1
 ASSI {  189}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      3.100     1.200     1.200 peak   189 spectrum    1 weight  0.10000E+01 volume  0.96104E-03 ppm1      8.744 ppm2      8.562 CV     1
 ASSI {  192}
   (( segid "    " and resid 18   and name HN  ))
   (  segid "    " and resid 18   and name HD2%)
      2.800     1.000     1.000 peak   192 spectrum    1 weight  0.10000E+01 volume  0.23879E-02 ppm1      8.716 ppm2      0.742 CV     1
 ASSI {  193}
   (( segid "    " and resid 18   and name HN  ))
   (  segid "    " and resid 16   and name HG1%)
      3.700     1.700     1.700 peak   193 spectrum    1 weight  0.10000E+01 volume  0.74734E-03 ppm1      8.715 ppm2      0.855 CV     1
 ASSI {  194}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HB2 ))
      2.600     0.800     0.800 peak   194 spectrum    1 weight  0.10000E+01 volume  0.15162E-02 ppm1      8.712 ppm2      1.110 CV     1
 ASSI {  195}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HG  ))
      3.600     1.700     1.700 peak   195 spectrum    1 weight  0.10000E+01 volume  0.14610E-02 ppm1      8.710 ppm2      1.418 CV     1
 ASSI {  196}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HB1 ))
      3.400     1.500     1.500 peak   196 spectrum    1 weight  0.10000E+01 volume  0.18216E-02 ppm1      8.716 ppm2      1.489 CV     1
 ASSI {  197}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HB1 ))
      3.600     1.600     1.600 peak   197 spectrum    1 weight  0.10000E+01 volume  0.85782E-03 ppm1      8.712 ppm2      1.678 CV     1
 ASSI {  198}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HG1 ))
      3.800     1.800     1.800 peak   198 spectrum    1 weight  0.10000E+01 volume  0.17612E-02 ppm1      8.713 ppm2      1.772 CV     1
 OR {  198}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HG2 ))
 ASSI {  199}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HB2 ))
      2.900     1.000     1.000 peak   199 spectrum    1 weight  0.10000E+01 volume  0.22987E-02 ppm1      8.734 ppm2      2.564 CV     1
 OR {  199}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 47   and name HB1 ))
 ASSI {  200}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      2.200     0.600     0.600 peak   200 spectrum    1 weight  0.10000E+01 volume  0.47182E-02 ppm1      8.731 ppm2      4.480 CV     1
 ASSI {  201}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
      2.200     0.600     0.600 peak   201 spectrum    1 weight  0.10000E+01 volume  0.55649E-02 ppm1      8.714 ppm2      5.069 CV     1
 ASSI {  202}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
      4.200     2.200     1.800 peak   202 spectrum    1 weight  0.10000E+01 volume  0.49735E-03 ppm1      8.733 ppm2      8.339 CV     1
 ASSI {  203}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 96   and name HN  ))
      3.000     1.200     1.200 peak   203 spectrum    1 weight  0.10000E+01 volume  0.10651E-02 ppm1      8.721 ppm2      8.482 CV     1
 ASSI {  204}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HN  ))
      4.700     2.800     1.300 peak   204 spectrum    1 weight  0.10000E+01 volume  0.23247E-03 ppm1      8.721 ppm2      7.741 CV     1
 ASSI {  205}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 19   and name HN  ))
      4.600     2.600     1.400 peak   205 spectrum    1 weight  0.10000E+01 volume  0.27966E-03 ppm1      8.715 ppm2      9.114 CV     1
 ASSI {  206}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 86   and name HG2%)
      4.100     2.100     1.900 peak   206 spectrum    1 weight  0.10000E+01 volume  0.44350E-03 ppm1      8.714 ppm2      1.020 CV     1
 ASSI {  207}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 81   and name HB% )
      2.800     1.000     1.000 peak   207 spectrum    1 weight  0.10000E+01 volume  0.22726E-02 ppm1      8.712 ppm2      1.412 CV     1
 ASSI {  208}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HG1 ))
      2.700     0.900     0.900 peak   208 spectrum    1 weight  0.10000E+01 volume  0.47567E-02 ppm1      8.712 ppm2      2.004 CV     1
 OR {  208}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HG2 ))
 ASSI {  210}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      3.400     1.500     1.500 peak   210 spectrum    1 weight  0.10000E+01 volume  0.93640E-03 ppm1      8.711 ppm2      3.572 CV     1
 ASSI {  212}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      2.600     0.800     0.800 peak   212 spectrum    1 weight  0.10000E+01 volume  0.31897E-02 ppm1      8.712 ppm2      3.940 CV     1
 ASSI {  213}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 81   and name HA  ))
      4.100     2.100     1.900 peak   213 spectrum    1 weight  0.10000E+01 volume  0.77112E-03 ppm1      8.715 ppm2      4.236 CV     1
 ASSI {  214}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 83   and name HB1 ))
      2.600     0.800     0.800 peak   214 spectrum    1 weight  0.10000E+01 volume  0.33742E-02 ppm1      8.712 ppm2      3.813 CV     1
 OR {  214}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 83   and name HB2 ))
 ASSI {  215}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 84   and name HN  ))
      2.600     0.800     0.800 peak   215 spectrum    1 weight  0.10000E+01 volume  0.28767E-02 ppm1      8.712 ppm2      6.967 CV     1
 ASSI {  216}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 85   and name HN  ))
      3.900     1.900     1.900 peak   216 spectrum    1 weight  0.10000E+01 volume  0.38457E-03 ppm1      8.714 ppm2      7.904 CV     1
 ASSI {  217}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HN  ))
      2.800     1.000     1.000 peak   217 spectrum    1 weight  0.10000E+01 volume  0.20991E-02 ppm1      8.711 ppm2      9.004 CV     1
 ASSI {  218}
   (( segid "    " and resid 76   and name HN  ))
   (  segid "    " and resid 75   and name HG1%)
      2.800     0.900     0.900 peak   218 spectrum    1 weight  0.10000E+01 volume  0.22983E-02 ppm1      8.696 ppm2      0.678 CV     1
 ASSI {  219}
   (( segid "    " and resid 76   and name HN  ))
   (  segid "    " and resid 75   and name HG2%)
      4.000     2.000     2.000 peak   219 spectrum    1 weight  0.10000E+01 volume  0.14398E-02 ppm1      8.699 ppm2      0.846 CV     1
 ASSI {  220}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HB  ))
      4.400     2.400     1.600 peak   220 spectrum    1 weight  0.10000E+01 volume  0.34415E-03 ppm1      8.692 ppm2      2.201 CV     1
 ASSI {  221}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HB1 ))
      2.600     0.900     0.900 peak   221 spectrum    1 weight  0.10000E+01 volume  0.33944E-02 ppm1      8.698 ppm2      2.681 CV     1
 OR {  221}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI {  223}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      2.200     0.600     0.600 peak   223 spectrum    1 weight  0.10000E+01 volume  0.63843E-02 ppm1      8.697 ppm2      3.826 CV     1
 ASSI {  224}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      3.900     1.900     1.900 peak   224 spectrum    1 weight  0.10000E+01 volume  0.70490E-03 ppm1      8.700 ppm2      7.486 CV     1
 ASSI {  225}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HB2 ))
      3.200     1.300     1.300 peak   225 spectrum    1 weight  0.10000E+01 volume  0.14053E-02 ppm1      8.684 ppm2      1.952 CV     1
 OR {  225}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HB1 ))
 ASSI {  228}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HG2 ))
      3.500     1.500     1.500 peak   228 spectrum    1 weight  0.10000E+01 volume  0.68896E-03 ppm1      8.685 ppm2      2.384 CV     1
 ASSI {  229}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HA2 ))
      2.600     0.800     0.800 peak   229 spectrum    1 weight  0.10000E+01 volume  0.33977E-02 ppm1      8.686 ppm2      3.793 CV     1
 OR {  229}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 79   and name HA1 ))
 ASSI {  231}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
      2.300     0.700     0.700 peak   231 spectrum    1 weight  0.10000E+01 volume  0.52192E-02 ppm1      8.685 ppm2      4.022 CV     1
 ASSI {  232}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 80   and name HN  ))
      2.300     0.700     0.700 peak   232 spectrum    1 weight  0.10000E+01 volume  0.24480E-02 ppm1      8.684 ppm2      7.522 CV     1
 ASSI {  234}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HB1 ))
      2.300     0.700     0.700 peak   234 spectrum    1 weight  0.10000E+01 volume  0.43408E-02 ppm1      8.679 ppm2      1.391 CV     1
 OR {  234}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HB2 ))
 ASSI {  236}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
      3.000     1.100     1.100 peak   236 spectrum    1 weight  0.10000E+01 volume  0.30513E-02 ppm1      8.676 ppm2      2.876 CV     1
 OR {  236}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
 ASSI {  237}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HA  ))
      2.900     1.100     1.100 peak   237 spectrum    1 weight  0.10000E+01 volume  0.12942E-02 ppm1      8.679 ppm2      4.257 CV     1
 ASSI {  238}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
      2.100     0.600     0.600 peak   238 spectrum    1 weight  0.10000E+01 volume  0.46972E-02 ppm1      8.677 ppm2      4.563 CV     1
 ASSI {  239}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      3.800     1.800     1.800 peak   239 spectrum    1 weight  0.10000E+01 volume  0.30082E-03 ppm1      8.676 ppm2      4.987 CV     1
 ASSI {  241}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 94   and name HD21))
      3.700     1.700     1.700 peak   241 spectrum    1 weight  0.10000E+01 volume  0.42756E-03 ppm1      8.683 ppm2      7.698 CV     1
 ASSI {  243}
   (( segid "    " and resid 31   and name HN  ))
   (  segid "    " and resid 31   and name HG2%)
      2.700     0.900     0.900 peak   243 spectrum    1 weight  0.10000E+01 volume  0.21732E-02 ppm1      8.653 ppm2      0.578 CV     1
 ASSI {  244}
   (( segid "    " and resid 31   and name HN  ))
   (  segid "    " and resid 31   and name HD1%)
      3.900     1.900     1.900 peak   244 spectrum    1 weight  0.10000E+01 volume  0.18075E-02 ppm1      8.656 ppm2      0.664 CV     1
 ASSI {  245}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HG11))
      2.300     0.700     0.700 peak   245 spectrum    1 weight  0.10000E+01 volume  0.30301E-02 ppm1      8.651 ppm2      1.012 CV     1
 OR {  245}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HG12))
 ASSI {  247}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HB  ))
      3.600     1.600     1.600 peak   247 spectrum    1 weight  0.10000E+01 volume  0.10455E-02 ppm1      8.653 ppm2      1.755 CV     1
 ASSI {  249}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HB1 ))
      3.800     1.800     1.800 peak   249 spectrum    1 weight  0.10000E+01 volume  0.11216E-02 ppm1      8.654 ppm2      3.772 CV     1
 OR {  249}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HB2 ))
 ASSI {  250}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      3.000     1.100     1.100 peak   250 spectrum    1 weight  0.10000E+01 volume  0.86000E-03 ppm1      8.653 ppm2      5.179 CV     1
 ASSI {  252}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      4.100     2.100     1.900 peak   252 spectrum    1 weight  0.10000E+01 volume  0.64640E-03 ppm1      8.653 ppm2      8.835 CV     1
 ASSI {  253}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 96   and name HG1%)
      3.800     1.800     1.800 peak   253 spectrum    1 weight  0.10000E+01 volume  0.15702E-02 ppm1      8.644 ppm2      0.748 CV     1
 ASSI {  254}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      3.400     1.400     1.400 peak   254 spectrum    1 weight  0.10000E+01 volume  0.19673E-02 ppm1      8.639 ppm2      0.863 CV     1
 ASSI {  256}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HG2 ))
      3.300     1.400     1.400 peak   256 spectrum    1 weight  0.10000E+01 volume  0.16229E-02 ppm1      8.639 ppm2      1.436 CV     1
 OR {  256}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HG1 ))
 ASSI {  257}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HB2 ))
      2.200     0.600     0.600 peak   257 spectrum    1 weight  0.10000E+01 volume  0.37297E-02 ppm1      8.640 ppm2      1.685 CV     1
 OR {  257}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HB1 ))
 ASSI {  258}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      3.400     1.500     1.500 peak   258 spectrum    1 weight  0.10000E+01 volume  0.64086E-03 ppm1      8.643 ppm2      1.970 CV     1
 ASSI {  259}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 98   and name HB2 ))
      4.600     2.600     1.400 peak   259 spectrum    1 weight  0.10000E+01 volume  0.31497E-03 ppm1      8.646 ppm2      1.529 CV     1
 OR {  259}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 98   and name HB1 ))
 ASSI {  260}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      2.100     0.500     0.500 peak   260 spectrum    1 weight  0.10000E+01 volume  0.59575E-02 ppm1      8.639 ppm2      4.306 CV     1
 ASSI {  261}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      3.700     1.700     1.700 peak   261 spectrum    1 weight  0.10000E+01 volume  0.67717E-03 ppm1      8.647 ppm2      4.046 CV     1
 ASSI {  262}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      2.900     1.100     1.100 peak   262 spectrum    1 weight  0.10000E+01 volume  0.77304E-03 ppm1      8.640 ppm2      4.952 CV     1
 ASSI {  263}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
      3.900     1.900     1.900 peak   263 spectrum    1 weight  0.10000E+01 volume  0.54189E-03 ppm1      8.647 ppm2      9.978 CV     1
 ASSI {  264}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      4.300     2.400     1.700 peak   264 spectrum    1 weight  0.10000E+01 volume  0.28967E-03 ppm1      8.645 ppm2      8.905 CV     1
 ASSI {  265}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 24   and name HG2%)
      4.200     2.200     1.800 peak   265 spectrum    1 weight  0.10000E+01 volume  0.37254E-03 ppm1      8.624 ppm2      1.137 CV     1
 ASSI {  266}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HG2 ))
      4.100     2.100     1.900 peak   266 spectrum    1 weight  0.10000E+01 volume  0.11276E-02 ppm1      8.623 ppm2      1.314 CV     1
 OR {  266}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HG1 ))
 ASSI {  267}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HD2 ))
      4.800     2.900     1.200 peak   267 spectrum    1 weight  0.10000E+01 volume  0.23993E-03 ppm1      8.623 ppm2      1.563 CV     1
 OR {  267}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HD1 ))
 ASSI {  268}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HB2 ))
      2.700     0.900     0.900 peak   268 spectrum    1 weight  0.10000E+01 volume  0.24918E-02 ppm1      8.623 ppm2      1.735 CV     1
 OR {  268}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HB1 ))
 ASSI {  269}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HB2 ))
      2.600     0.800     0.800 peak   269 spectrum    1 weight  0.10000E+01 volume  0.38907E-02 ppm1      8.623 ppm2      2.683 CV     1
 OR {  269}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HB1 ))
 ASSI {  270}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      2.100     0.500     0.500 peak   270 spectrum    1 weight  0.10000E+01 volume  0.96981E-02 ppm1      8.624 ppm2      4.221 CV     1
 ASSI {  271}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 24   and name HN  ))
      2.800     1.000     1.000 peak   271 spectrum    1 weight  0.10000E+01 volume  0.19967E-02 ppm1      8.623 ppm2      7.512 CV     1
 ASSI {  272}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      4.000     2.000     2.000 peak   272 spectrum    1 weight  0.10000E+01 volume  0.65496E-03 ppm1      8.620 ppm2      8.223 CV     1
 ASSI {  273}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 75   and name HG2%)
      3.500     1.500     1.500 peak   273 spectrum    1 weight  0.10000E+01 volume  0.81285E-03 ppm1      8.609 ppm2      0.843 CV     1
 ASSI {  274}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HG2 ))
      2.800     1.000     1.000 peak   274 spectrum    1 weight  0.10000E+01 volume  0.27938E-02 ppm1      8.614 ppm2      1.396 CV     1
 OR {  274}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HG1 ))
 ASSI {  275}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HB1 ))
      3.500     1.500     1.500 peak   275 spectrum    1 weight  0.10000E+01 volume  0.14349E-02 ppm1      8.611 ppm2      1.617 CV     1
 OR {  275}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HB2 ))
 ASSI {  276}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 21   and name HB2 ))
      2.700     0.900     0.900 peak   276 spectrum    1 weight  0.10000E+01 volume  0.29341E-02 ppm1      8.614 ppm2      1.916 CV     1
 OR {  276}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 21   and name HB1 ))
 ASSI {  278}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HB  ))
      2.800     1.000     1.000 peak   278 spectrum    1 weight  0.10000E+01 volume  0.18234E-02 ppm1      8.613 ppm2      2.196 CV     1
 ASSI {  279}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 21   and name HG1 ))
      3.400     1.500     1.500 peak   279 spectrum    1 weight  0.10000E+01 volume  0.99754E-03 ppm1      8.615 ppm2      2.280 CV     1
 ASSI {  280}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HD2 ))
      4.100     2.100     1.900 peak   280 spectrum    1 weight  0.10000E+01 volume  0.56560E-03 ppm1      8.613 ppm2      2.870 CV     1
 OR {  280}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HD1 ))
 ASSI {  282}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HA  ))
      2.100     0.600     0.600 peak   282 spectrum    1 weight  0.10000E+01 volume  0.63900E-02 ppm1      8.614 ppm2      4.258 CV     1
 ASSI {  284}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 100  and name HD1%)
      3.700     1.800     1.800 peak   284 spectrum    1 weight  0.10000E+01 volume  0.62880E-03 ppm1      8.590 ppm2      0.520 CV     1
 ASSI {  285}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 98   and name HD1%)
      4.600     2.600     1.400 peak   285 spectrum    1 weight  0.10000E+01 volume  0.29200E-03 ppm1      8.602 ppm2      0.582 CV     1
 ASSI {  287}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 16   and name HG2%)
      2.800     1.000     1.000 peak   287 spectrum    1 weight  0.10000E+01 volume  0.20234E-02 ppm1      8.590 ppm2      0.746 CV     1
 ASSI {  288}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 16   and name HG1%)
      4.000     2.000     2.000 peak   288 spectrum    1 weight  0.10000E+01 volume  0.89767E-03 ppm1      8.594 ppm2      0.853 CV     1
 ASSI {  289}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HB  ))
      2.900     1.100     1.100 peak   289 spectrum    1 weight  0.10000E+01 volume  0.11805E-02 ppm1      8.589 ppm2      1.830 CV     1
 ASSI {  290}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HB1 ))
      3.200     1.200     1.200 peak   290 spectrum    1 weight  0.10000E+01 volume  0.22475E-02 ppm1      8.590 ppm2      3.623 CV     1
 OR {  290}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HB2 ))
 ASSI {  291}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
      3.000     1.100     1.100 peak   291 spectrum    1 weight  0.10000E+01 volume  0.10852E-02 ppm1      8.584 ppm2      4.376 CV     1
 ASSI {  292}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      3.700     1.700     1.700 peak   292 spectrum    1 weight  0.10000E+01 volume  0.75226E-03 ppm1      8.586 ppm2      4.839 CV     1
 ASSI {  293}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
      2.200     0.600     0.600 peak   293 spectrum    1 weight  0.10000E+01 volume  0.53376E-02 ppm1      8.591 ppm2      5.450 CV     1
 ASSI {  295}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      2.800     1.000     1.000 peak   295 spectrum    1 weight  0.10000E+01 volume  0.15912E-02 ppm1      8.591 ppm2      8.907 CV     1
 ASSI {  296}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 70   and name HD2%)
      4.300     2.300     1.700 peak   296 spectrum    1 weight  0.10000E+01 volume  0.56313E-03 ppm1      8.557 ppm2      0.554 CV     1
 ASSI {  298}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HG2 ))
      3.400     1.400     1.400 peak   298 spectrum    1 weight  0.10000E+01 volume  0.21384E-02 ppm1      8.558 ppm2      0.767 CV     1
 OR {  298}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HG1 ))
 ASSI {  299}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 101  and name HG11))
      4.000     2.000     2.000 peak   299 spectrum    1 weight  0.10000E+01 volume  0.51887E-03 ppm1      8.561 ppm2      0.845 CV     1
 OR {  299}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 101  and name HG12))
 ASSI {  300}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HD2 ))
      3.500     1.500     1.500 peak   300 spectrum    1 weight  0.10000E+01 volume  0.26799E-02 ppm1      8.555 ppm2      1.414 CV     1
 OR {  300}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HD1 ))
 ASSI {  301}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HB1 ))
      2.800     1.000     1.000 peak   301 spectrum    1 weight  0.10000E+01 volume  0.14611E-02 ppm1      8.558 ppm2      1.689 CV     1
 OR {  301}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
 ASSI {  302}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HB1 ))
      3.500     1.500     1.500 peak   302 spectrum    1 weight  0.10000E+01 volume  0.85594E-03 ppm1      8.560 ppm2      2.493 CV     1
 OR {  302}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 ASSI {  303}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HE2 ))
      4.900     3.000     1.100 peak   303 spectrum    1 weight  0.10000E+01 volume  0.54042E-03 ppm1      8.556 ppm2      2.667 CV     1
 OR {  303}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HE1 ))
 ASSI {  304}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 100  and name HA  ))
      4.900     3.000     1.100 peak   304 spectrum    1 weight  0.10000E+01 volume  0.19821E-03 ppm1      8.550 ppm2      5.329 CV     1
 ASSI {  306}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
      4.100     2.100     1.900 peak   306 spectrum    1 weight  0.10000E+01 volume  0.45715E-03 ppm1      8.554 ppm2      8.366 CV     1
 ASSI {  308}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 96   and name HG1%)
      5.600     4.000     0.400 peak   308 spectrum    1 weight  0.10000E+01 volume  0.29999E-03 ppm1      8.544 ppm2      0.748 CV     1
 ASSI {  309}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      4.300     2.300     1.700 peak   309 spectrum    1 weight  0.10000E+01 volume  0.60926E-03 ppm1      8.550 ppm2      0.866 CV     1
 ASSI {  310}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      2.200     0.600     0.600 peak   310 spectrum    1 weight  0.10000E+01 volume  0.41353E-02 ppm1      8.546 ppm2      1.410 CV     1
 ASSI {  311}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 93   and name HA1 ))
      2.300     0.600     0.600 peak   311 spectrum    1 weight  0.10000E+01 volume  0.44140E-02 ppm1      8.546 ppm2      3.592 CV     1
 OR {  311}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 93   and name HA2 ))
 ASSI {  313}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      2.700     0.900     0.900 peak   313 spectrum    1 weight  0.10000E+01 volume  0.61551E-02 ppm1      8.546 ppm2      4.166 CV     1
 ASSI {  316}
   (( segid "    " and resid 102  and name HE  ))
   (( segid "    " and resid 102  and name HG1 ))
      3.300     1.300     1.300 peak   316 spectrum    1 weight  0.10000E+01 volume  0.77530E-03 ppm1      8.524 ppm2      1.522 CV     1
 OR {  316}
   (( segid "    " and resid 102  and name HE  ))
   (( segid "    " and resid 102  and name HG2 ))
 ASSI {  317}
   (( segid "    " and resid 102  and name HE  ))
   (( segid "    " and resid 102  and name HB1 ))
      3.900     1.900     1.900 peak   317 spectrum    1 weight  0.10000E+01 volume  0.49952E-03 ppm1      8.530 ppm2      1.811 CV     1
 OR {  317}
   (( segid "    " and resid 102  and name HE  ))
   (( segid "    " and resid 102  and name HB2 ))
 ASSI {  319}
   (( segid "    " and resid 102  and name HE  ))
   (( segid "    " and resid 102  and name HD2 ))
      3.400     1.500     1.500 peak   319 spectrum    1 weight  0.10000E+01 volume  0.49082E-03 ppm1      8.529 ppm2      3.200 CV     1
 OR {  319}
   (( segid "    " and resid 102  and name HE  ))
   (( segid "    " and resid 102  and name HD1 ))
 ASSI {  320}
   (( segid "    " and resid 13   and name HN  ))
   (  segid "    " and resid 13   and name HD2%)
      3.500     1.500     1.500 peak   320 spectrum    1 weight  0.10000E+01 volume  0.16151E-02 ppm1      8.501 ppm2      0.694 CV     1
 ASSI {  321}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HB2 ))
      2.500     0.800     0.800 peak   321 spectrum    1 weight  0.10000E+01 volume  0.36438E-02 ppm1      8.502 ppm2      1.385 CV     1
 OR {  321}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HB1 ))
 ASSI {  323}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HB2 ))
      3.400     1.400     1.400 peak   323 spectrum    1 weight  0.10000E+01 volume  0.19067E-02 ppm1      8.502 ppm2      3.661 CV     1
 OR {  323}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HB1 ))
 ASSI {  324}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      2.200     0.600     0.600 peak   324 spectrum    1 weight  0.10000E+01 volume  0.62245E-02 ppm1      8.502 ppm2      4.717 CV     1
 ASSI {  325}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      2.900     1.000     1.000 peak   325 spectrum    1 weight  0.10000E+01 volume  0.12841E-02 ppm1      8.510 ppm2      5.173 CV     1
 ASSI {  326}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
      4.200     2.200     1.800 peak   326 spectrum    1 weight  0.10000E+01 volume  0.43836E-03 ppm1      8.503 ppm2      9.054 CV     1
 ASSI {  327}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 14   and name HN  ))
      4.600     2.600     1.400 peak   327 spectrum    1 weight  0.10000E+01 volume  0.32230E-03 ppm1      8.506 ppm2      9.184 CV     1
 ASSI {  328}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 96   and name HG1%)
      2.800     1.000     1.000 peak   328 spectrum    1 weight  0.10000E+01 volume  0.22818E-02 ppm1      8.482 ppm2      0.746 CV     1
 ASSI {  329}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      2.700     0.900     0.900 peak   329 spectrum    1 weight  0.10000E+01 volume  0.15252E-02 ppm1      8.489 ppm2      0.869 CV     1
 ASSI {  330}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 18   and name HB1 ))
      3.200     1.300     1.300 peak   330 spectrum    1 weight  0.10000E+01 volume  0.11772E-02 ppm1      8.482 ppm2      1.095 CV     1
 OR {  330}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 18   and name HB2 ))
 ASSI {  331}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 96   and name HB  ))
      3.500     1.600     1.600 peak   331 spectrum    1 weight  0.10000E+01 volume  0.11172E-02 ppm1      8.481 ppm2      1.955 CV     1
 ASSI {  332}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      2.500     2.500     3.500 peak   332 spectrum    1 weight  0.10000E+01 volume  0.10554E-02 ppm1      8.483 ppm2      4.987 CV     1
 ASSI {  334}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 51   and name HD2%)
      3.500     1.500     1.500 peak   334 spectrum    1 weight  0.10000E+01 volume  0.20354E-02 ppm1      8.494 ppm2      0.564 CV     1
 ASSI {  335}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 51   and name HD1%)
      3.600     1.600     1.600 peak   335 spectrum    1 weight  0.10000E+01 volume  0.19572E-02 ppm1      8.488 ppm2      0.639 CV     1
 ASSI {  337}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 51   and name HG  ))
      2.600     0.900     0.900 peak   337 spectrum    1 weight  0.10000E+01 volume  0.29115E-02 ppm1      8.490 ppm2      1.339 CV     1
 ASSI {  338}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 51   and name HB2 ))
      2.600     0.800     0.800 peak   338 spectrum    1 weight  0.10000E+01 volume  0.32075E-02 ppm1      8.492 ppm2      1.582 CV     1
 OR {  338}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 51   and name HB1 ))
 ASSI {  339}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
      2.700     0.900     0.900 peak   339 spectrum    1 weight  0.10000E+01 volume  0.32917E-02 ppm1      8.491 ppm2      3.681 CV     1
 OR {  339}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
 ASSI {  341}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      2.200     0.600     0.600 peak   341 spectrum    1 weight  0.10000E+01 volume  0.66911E-02 ppm1      8.492 ppm2      4.261 CV     1
 ASSI {  342}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      3.000     1.200     1.200 peak   342 spectrum    1 weight  0.10000E+01 volume  0.10413E-02 ppm1      8.492 ppm2      5.260 CV     1
 ASSI {  343}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
      4.200     2.200     1.800 peak   343 spectrum    1 weight  0.10000E+01 volume  0.37822E-03 ppm1      8.483 ppm2      7.526 CV     1
 ASSI {  344}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 59   and name HD1%)
      3.700     1.700     1.700 peak   344 spectrum    1 weight  0.10000E+01 volume  0.17862E-02 ppm1      8.494 ppm2      0.710 CV     1
 ASSI {  345}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 59   and name HD2%)
      3.700     1.700     1.700 peak   345 spectrum    1 weight  0.10000E+01 volume  0.14988E-02 ppm1      8.494 ppm2      0.782 CV     1
 ASSI {  346}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 58   and name HB% )
      2.500     0.800     0.800 peak   346 spectrum    1 weight  0.10000E+01 volume  0.31283E-02 ppm1      8.493 ppm2      1.363 CV     1
 ASSI {  347}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HG  ))
      2.400     0.700     0.700 peak   347 spectrum    1 weight  0.10000E+01 volume  0.33509E-02 ppm1      8.493 ppm2      1.586 CV     1
 ASSI {  348}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB1 ))
      2.600     0.800     0.800 peak   348 spectrum    1 weight  0.10000E+01 volume  0.28392E-02 ppm1      8.495 ppm2      1.671 CV     1
 OR {  348}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI {  349}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      2.700     0.900     0.900 peak   349 spectrum    1 weight  0.10000E+01 volume  0.33761E-02 ppm1      8.492 ppm2      3.942 CV     1
 ASSI {  350}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      3.200     1.300     1.300 peak   350 spectrum    1 weight  0.10000E+01 volume  0.99176E-03 ppm1      8.494 ppm2      4.077 CV     1
 ASSI {  353}
   (( segid "    " and resid 33   and name HN  ))
   (  segid "    " and resid 46   and name HD1%)
      3.900     1.900     1.900 peak   353 spectrum    1 weight  0.10000E+01 volume  0.55421E-03 ppm1      8.453 ppm2      0.594 CV     1
 ASSI {  354}
   (( segid "    " and resid 33   and name HN  ))
   (  segid "    " and resid 31   and name HD1%)
      5.000     3.200     1.000 peak   354 spectrum    1 weight  0.10000E+01 volume  0.17366E-03 ppm1      8.451 ppm2      0.663 CV     1
 ASSI {  355}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 82   and name HB1 ))
      4.100     2.100     1.900 peak   355 spectrum    1 weight  0.10000E+01 volume  0.39030E-03 ppm1      8.451 ppm2      2.014 CV     1
 OR {  355}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 82   and name HB2 ))
 ASSI {  356}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 82   and name HG2 ))
      4.400     2.400     1.600 peak   356 spectrum    1 weight  0.10000E+01 volume  0.51210E-03 ppm1      8.445 ppm2      2.155 CV     1
 OR {  356}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 82   and name HG1 ))
 ASSI {  357}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HB1 ))
      3.700     1.700     1.700 peak   357 spectrum    1 weight  0.10000E+01 volume  0.87089E-03 ppm1      8.448 ppm2      3.433 CV     1
 OR {  357}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
 ASSI {  358}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HA1 ))
      2.300     0.700     0.700 peak   358 spectrum    1 weight  0.10000E+01 volume  0.57865E-02 ppm1      8.445 ppm2      3.704 CV     1
 OR {  358}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HA2 ))
 ASSI {  359}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      2.200     0.600     0.600 peak   359 spectrum    1 weight  0.10000E+01 volume  0.59373E-02 ppm1      8.446 ppm2      4.520 CV     1
 ASSI {  361}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 82   and name HE22))
      3.500     1.600     1.600 peak   361 spectrum    1 weight  0.10000E+01 volume  0.42107E-03 ppm1      8.446 ppm2      6.786 CV     1
 ASSI {  362}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      4.500     2.600     1.500 peak   362 spectrum    1 weight  0.10000E+01 volume  0.28641E-03 ppm1      8.449 ppm2      8.844 CV     1
 ASSI {  363}
   (( segid "    " and resid 43   and name HN  ))
   (  segid "    " and resid 43   and name HB% )
      2.300     0.700     0.700 peak   363 spectrum    1 weight  0.10000E+01 volume  0.80928E-02 ppm1      8.412 ppm2      1.316 CV     1
 ASSI {  365}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HB2 ))
      3.000     1.100     1.100 peak   365 spectrum    1 weight  0.10000E+01 volume  0.21089E-02 ppm1      8.410 ppm2      1.944 CV     1
 OR {  365}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HB1 ))
 ASSI {  366}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HG2 ))
      3.800     1.800     1.800 peak   366 spectrum    1 weight  0.10000E+01 volume  0.15987E-02 ppm1      8.412 ppm2      2.140 CV     1
 OR {  366}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HG1 ))
 ASSI {  367}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
      2.100     0.500     0.500 peak   367 spectrum    1 weight  0.10000E+01 volume  0.11000E-01 ppm1      8.412 ppm2      4.214 CV     1
 ASSI {  368}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
      2.600     0.800     0.800 peak   368 spectrum    1 weight  0.10000E+01 volume  0.37359E-02 ppm1      8.413 ppm2      4.358 CV     1
 ASSI {  371}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HB2 ))
      2.600     0.800     0.800 peak   371 spectrum    1 weight  0.10000E+01 volume  0.26430E-02 ppm1      8.391 ppm2      1.932 CV     1
 OR {  371}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HB1 ))
 ASSI {  372}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HG1 ))
      3.600     1.600     1.600 peak   372 spectrum    1 weight  0.10000E+01 volume  0.19789E-02 ppm1      8.393 ppm2      2.340 CV     1
 OR {  372}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HG2 ))
 ASSI {  373}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HA2 ))
      2.600     0.800     0.800 peak   373 spectrum    1 weight  0.10000E+01 volume  0.30201E-02 ppm1      8.392 ppm2      3.712 CV     1
 OR {  373}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HA1 ))
 ASSI {  375}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 51   and name HD2%)
      4.100     2.100     1.900 peak   375 spectrum    1 weight  0.10000E+01 volume  0.66074E-03 ppm1      8.403 ppm2      0.570 CV     1
 ASSI {  376}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 57   and name HB% )
      2.300     0.700     0.700 peak   376 spectrum    1 weight  0.10000E+01 volume  0.53882E-02 ppm1      8.395 ppm2      1.189 CV     1
 ASSI {  377}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 58   and name HB% )
      4.000     2.000     2.000 peak   377 spectrum    1 weight  0.10000E+01 volume  0.88514E-03 ppm1      8.391 ppm2      1.357 CV     1
 ASSI {  378}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 56   and name HB% )
      2.400     0.700     0.700 peak   378 spectrum    1 weight  0.10000E+01 volume  0.41682E-02 ppm1      8.394 ppm2      1.502 CV     1
 ASSI {  379}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HA  ))
      2.500     0.800     0.800 peak   379 spectrum    1 weight  0.10000E+01 volume  0.36029E-02 ppm1      8.393 ppm2      3.961 CV     1
 ASSI {  380}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      3.200     1.300     1.300 peak   380 spectrum    1 weight  0.10000E+01 volume  0.14220E-02 ppm1      8.392 ppm2      4.091 CV     1
 ASSI {  381}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      3.900     1.900     1.900 peak   381 spectrum    1 weight  0.10000E+01 volume  0.10507E-02 ppm1      8.389 ppm2      4.389 CV     1
 ASSI {  382}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 29   and name HN  ))
      4.700     2.800     1.300 peak   382 spectrum    1 weight  0.10000E+01 volume  0.13474E-03 ppm1      8.389 ppm2      7.456 CV     1
 ASSI {  383}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      2.700     0.900     0.900 peak   383 spectrum    1 weight  0.10000E+01 volume  0.20362E-02 ppm1      8.393 ppm2      7.658 CV     1
 ASSI {  384}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HN  ))
      2.900     1.100     1.100 peak   384 spectrum    1 weight  0.10000E+01 volume  0.13347E-02 ppm1      8.393 ppm2      9.111 CV     1
 ASSI {  385}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HG2 ))
      2.800     1.000     1.000 peak   385 spectrum    1 weight  0.10000E+01 volume  0.25417E-02 ppm1      8.390 ppm2      1.383 CV     1
 OR {  385}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HG1 ))
 ASSI {  386}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HB2 ))
      3.700     1.700     1.700 peak   386 spectrum    1 weight  0.10000E+01 volume  0.13601E-02 ppm1      8.392 ppm2      1.932 CV     1
 OR {  386}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HB1 ))
 ASSI {  387}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HG1 ))
      3.600     1.600     1.600 peak   387 spectrum    1 weight  0.10000E+01 volume  0.66278E-03 ppm1      8.395 ppm2      2.339 CV     1
 OR {  387}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HG2 ))
 ASSI {  388}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HD2 ))
      3.600     1.600     1.600 peak   388 spectrum    1 weight  0.10000E+01 volume  0.45605E-03 ppm1      8.388 ppm2      3.042 CV     1
 OR {  388}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HD1 ))
 ASSI {  389}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      2.800     1.000     1.000 peak   389 spectrum    1 weight  0.10000E+01 volume  0.18061E-02 ppm1      8.391 ppm2      4.098 CV     1
 ASSI {  390}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
      2.200     0.600     0.600 peak   390 spectrum    1 weight  0.10000E+01 volume  0.67201E-02 ppm1      8.391 ppm2      4.483 CV     1
 ASSI {  391}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 99   and name HD1%)
      3.500     1.500     1.500 peak   391 spectrum    1 weight  0.10000E+01 volume  0.10214E-02 ppm1      8.390 ppm2      0.684 CV     1
 ASSI {  392}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HB1 ))
      2.600     0.900     0.900 peak   392 spectrum    1 weight  0.10000E+01 volume  0.49652E-02 ppm1      8.390 ppm2      2.828 CV     1
 OR {  392}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HB2 ))
 ASSI {  393}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 15   and name HB2 ))
      2.600     0.900     0.900 peak   393 spectrum    1 weight  0.10000E+01 volume  0.36315E-02 ppm1      8.388 ppm2      3.628 CV     1
 OR {  393}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 15   and name HB1 ))
 ASSI {  394}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HA  ))
      2.300     0.600     0.600 peak   394 spectrum    1 weight  0.10000E+01 volume  0.63831E-02 ppm1      8.389 ppm2      4.834 CV     1
 ASSI {  395}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
      3.000     1.100     1.100 peak   395 spectrum    1 weight  0.10000E+01 volume  0.11321E-02 ppm1      8.384 ppm2      5.453 CV     1
 ASSI {  396}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 16   and name HN  ))
      4.000     2.000     2.000 peak   396 spectrum    1 weight  0.10000E+01 volume  0.64633E-03 ppm1      8.386 ppm2      8.582 CV     1
 ASSI {  397}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HN  ))
      4.500     2.600     1.500 peak   397 spectrum    1 weight  0.10000E+01 volume  0.34182E-03 ppm1      8.386 ppm2      9.188 CV     1
 ASSI {  398}
   (( segid "    " and resid 30   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
      2.200     0.600     0.600 peak   398 spectrum    1 weight  0.10000E+01 volume  0.69403E-02 ppm1      8.370 ppm2      0.572 CV     1
 ASSI {  399}
   (( segid "    " and resid 30   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
      2.800     1.000     1.000 peak   399 spectrum    1 weight  0.10000E+01 volume  0.35088E-02 ppm1      8.368 ppm2      0.671 CV     1
 ASSI {  400}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HG1 ))
      2.800     1.000     1.000 peak   400 spectrum    1 weight  0.10000E+01 volume  0.20480E-02 ppm1      8.365 ppm2      0.762 CV     1
 OR {  400}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HG2 ))
 ASSI {  401}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HB  ))
      2.400     0.700     0.700 peak   401 spectrum    1 weight  0.10000E+01 volume  0.32444E-02 ppm1      8.369 ppm2      1.313 CV     1
 ASSI {  402}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HG11))
      2.400     0.700     0.700 peak   402 spectrum    1 weight  0.10000E+01 volume  0.22952E-02 ppm1      8.367 ppm2      1.426 CV     1
 OR {  402}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HG12))
 ASSI {  403}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HB  ))
      3.400     1.400     1.400 peak   403 spectrum    1 weight  0.10000E+01 volume  0.16580E-02 ppm1      8.368 ppm2      1.560 CV     1
 ASSI {  404}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HB1 ))
      4.200     2.300     1.800 peak   404 spectrum    1 weight  0.10000E+01 volume  0.51262E-03 ppm1      8.378 ppm2      1.666 CV     1
 OR {  404}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
 ASSI {  405}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 46   and name HB  ))
      3.900     1.900     1.900 peak   405 spectrum    1 weight  0.10000E+01 volume  0.33775E-03 ppm1      8.369 ppm2      1.963 CV     1
 ASSI {  406}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HB1 ))
      2.600     0.900     0.900 peak   406 spectrum    1 weight  0.10000E+01 volume  0.25167E-02 ppm1      8.371 ppm2      3.676 CV     1
 OR {  406}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HB2 ))
 ASSI {  408}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
      2.100     0.600     0.600 peak   408 spectrum    1 weight  0.10000E+01 volume  0.60997E-02 ppm1      8.370 ppm2      4.205 CV     1
 ASSI {  409}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      2.400     0.700     0.700 peak   409 spectrum    1 weight  0.10000E+01 volume  0.19840E-02 ppm1      8.366 ppm2      4.672 CV     1
 ASSI {  410}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      3.200     1.300     1.300 peak   410 spectrum    1 weight  0.10000E+01 volume  0.65009E-03 ppm1      8.374 ppm2      5.267 CV     1
 ASSI {  411}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      2.600     0.900     0.900 peak   411 spectrum    1 weight  0.10000E+01 volume  0.12678E-02 ppm1      8.362 ppm2      5.116 CV     1
 ASSI {  412}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
      3.100     1.200     1.200 peak   412 spectrum    1 weight  0.10000E+01 volume  0.11345E-02 ppm1      8.368 ppm2      7.527 CV     1
 ASSI {  413}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      3.600     1.700     1.700 peak   413 spectrum    1 weight  0.10000E+01 volume  0.68409E-03 ppm1      8.372 ppm2      8.657 CV     1
 ASSI {  414}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 52   and name HN  ))
      3.900     1.900     1.900 peak   414 spectrum    1 weight  0.10000E+01 volume  0.62079E-03 ppm1      8.375 ppm2      8.850 CV     1
 ASSI {  415}
   (( segid "    " and resid 10   and name HN  ))
   (  segid "    " and resid 104  and name HD1%)
      3.600     1.700     1.700 peak   415 spectrum    1 weight  0.10000E+01 volume  0.99164E-03 ppm1      8.374 ppm2      0.718 CV     1
 ASSI {  416}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 104  and name HB2 ))
      4.300     2.300     1.700 peak   416 spectrum    1 weight  0.10000E+01 volume  0.80450E-03 ppm1      8.375 ppm2      1.292 CV     1
 OR {  416}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 104  and name HB1 ))
 ASSI {  417}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HA2 ))
      2.100     0.500     0.500 peak   417 spectrum    1 weight  0.10000E+01 volume  0.11387E-01 ppm1      8.376 ppm2      3.815 CV     1
 OR {  417}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HA1 ))
 ASSI {  418}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
      2.400     0.800     0.800 peak   418 spectrum    1 weight  0.10000E+01 volume  0.51640E-02 ppm1      8.376 ppm2      4.289 CV     1
 ASSI {  419}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 11   and name HN  ))
      2.600     0.900     0.900 peak   419 spectrum    1 weight  0.10000E+01 volume  0.28075E-02 ppm1      8.376 ppm2      7.953 CV     1
 ASSI {  420}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HN  ))
      2.600     0.900     0.900 peak   420 spectrum    1 weight  0.10000E+01 volume  0.25329E-02 ppm1      8.376 ppm2      8.240 CV     1
 ASSI {  421}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 24   and name HG2%)
      2.900     2.900     3.100 peak   421 spectrum    1 weight  0.10000E+01 volume  0.43577E-03 ppm1      8.364 ppm2      1.129 CV     1
 ASSI {  423}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HB2 ))
      2.500     0.800     0.800 peak   423 spectrum    1 weight  0.10000E+01 volume  0.49676E-02 ppm1      8.364 ppm2      3.882 CV     1
 OR {  423}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HB1 ))
 ASSI {  424}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
      2.500     0.800     0.800 peak   424 spectrum    1 weight  0.10000E+01 volume  0.41789E-02 ppm1      8.365 ppm2      4.343 CV     1
 ASSI {  425}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      2.900     1.000     1.000 peak   425 spectrum    1 weight  0.10000E+01 volume  0.16121E-02 ppm1      8.361 ppm2      4.442 CV     1
 ASSI {  427}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HB2 ))
      2.700     0.900     0.900 peak   427 spectrum    1 weight  0.10000E+01 volume  0.38688E-02 ppm1      8.351 ppm2      1.906 CV     1
 OR {  427}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HB1 ))
 ASSI {  429}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HG2 ))
      2.800     1.000     1.000 peak   429 spectrum    1 weight  0.10000E+01 volume  0.23769E-02 ppm1      8.352 ppm2      2.244 CV     1
 OR {  429}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HG1 ))
 ASSI {  430}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      2.500     0.800     0.800 peak   430 spectrum    1 weight  0.10000E+01 volume  0.45451E-02 ppm1      8.351 ppm2      4.195 CV     1
 ASSI {  432}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 46   and name HD1%)
      3.400     1.500     1.500 peak   432 spectrum    1 weight  0.10000E+01 volume  0.15620E-02 ppm1      8.342 ppm2      0.595 CV     1
 ASSI {  433}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      3.800     1.800     1.800 peak   433 spectrum    1 weight  0.10000E+01 volume  0.11998E-02 ppm1      8.341 ppm2      0.671 CV     1
 ASSI {  434}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HG12))
      3.000     1.100     1.100 peak   434 spectrum    1 weight  0.10000E+01 volume  0.13145E-02 ppm1      8.337 ppm2      1.531 CV     1
 OR {  434}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HG11))
 ASSI {  435}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 69   and name HB  ))
      3.900     1.900     1.900 peak   435 spectrum    1 weight  0.10000E+01 volume  0.49136E-03 ppm1      8.329 ppm2      1.302 CV     1
 ASSI {  436}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HB  ))
      2.700     0.900     0.900 peak   436 spectrum    1 weight  0.10000E+01 volume  0.22201E-02 ppm1      8.340 ppm2      1.972 CV     1
 ASSI {  437}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 68   and name HE1 ))
      3.300     1.300     1.300 peak   437 spectrum    1 weight  0.10000E+01 volume  0.90373E-03 ppm1      8.332 ppm2      2.629 CV     1
 OR {  437}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 68   and name HE2 ))
 ASSI {  439}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HA1 ))
      2.600     0.800     0.800 peak   439 spectrum    1 weight  0.10000E+01 volume  0.33927E-02 ppm1      8.339 ppm2      4.035 CV     1
 OR {  439}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HA2 ))
 ASSI {  440}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      2.900     1.100     1.100 peak   440 spectrum    1 weight  0.10000E+01 volume  0.12919E-02 ppm1      8.337 ppm2      4.473 CV     1
 ASSI {  442}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      3.300     1.300     1.300 peak   442 spectrum    1 weight  0.10000E+01 volume  0.12448E-02 ppm1      8.318 ppm2      1.493 CV     1
 OR {  442}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI {  443}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HB  ))
      2.900     1.100     1.100 peak   443 spectrum    1 weight  0.10000E+01 volume  0.10240E-02 ppm1      8.325 ppm2      1.646 CV     1
 ASSI {  444}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 77   and name HG1%)
      3.200     1.300     1.300 peak   444 spectrum    1 weight  0.10000E+01 volume  0.11007E-02 ppm1      8.329 ppm2      0.750 CV     1
 ASSI {  445}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      2.700     0.900     0.900 peak   445 spectrum    1 weight  0.10000E+01 volume  0.19565E-02 ppm1      8.323 ppm2      4.216 CV     1
 ASSI {  446}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      2.500     0.800     0.800 peak   446 spectrum    1 weight  0.10000E+01 volume  0.18516E-02 ppm1      8.323 ppm2      5.132 CV     1
 ASSI {  447}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HA  ))
      3.000     1.100     1.100 peak   447 spectrum    1 weight  0.10000E+01 volume  0.15408E-02 ppm1      8.329 ppm2      4.554 CV     1
 ASSI {  448}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 5    and name HN  ))
      3.600     1.600     1.600 peak   448 spectrum    1 weight  0.10000E+01 volume  0.59982E-03 ppm1      8.331 ppm2      8.158 CV     1
 ASSI {  449}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 44   and name HG2%)
      3.800     1.800     1.800 peak   449 spectrum    1 weight  0.10000E+01 volume  0.18042E-02 ppm1      8.319 ppm2      1.116 CV     1
 ASSI {  450}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 43   and name HB% )
      2.500     2.500     3.500 peak   450 spectrum    1 weight  0.10000E+01 volume  0.90682E-03 ppm1      8.320 ppm2      1.313 CV     1
 ASSI {  451}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HA2 ))
      2.500     0.800     0.800 peak   451 spectrum    1 weight  0.10000E+01 volume  0.47175E-02 ppm1      8.320 ppm2      3.752 CV     1
 OR {  451}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HA1 ))
 ASSI {  453}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HB  ))
      2.500     0.800     0.800 peak   453 spectrum    1 weight  0.10000E+01 volume  0.33699E-02 ppm1      8.320 ppm2      4.229 CV     1
 ASSI {  454}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      2.300     0.600     0.600 peak   454 spectrum    1 weight  0.10000E+01 volume  0.65149E-02 ppm1      8.320 ppm2      4.466 CV     1
 ASSI {  456}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HB1 ))
      3.500     1.500     1.500 peak   456 spectrum    1 weight  0.10000E+01 volume  0.10479E-02 ppm1      8.311 ppm2      2.090 CV     1
 OR {  456}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HB2 ))
 ASSI {  457}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HG1 ))
      3.900     1.900     1.900 peak   457 spectrum    1 weight  0.10000E+01 volume  0.68680E-03 ppm1      8.309 ppm2      2.246 CV     1
 OR {  457}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HG2 ))
 ASSI {  458}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
      2.800     1.000     1.000 peak   458 spectrum    1 weight  0.10000E+01 volume  0.28235E-02 ppm1      8.309 ppm2      3.767 CV     1
 OR {  458}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI {  460}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
      2.400     0.700     0.700 peak   460 spectrum    1 weight  0.10000E+01 volume  0.49731E-02 ppm1      8.309 ppm2      4.195 CV     1
 ASSI {  461}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      2.600     0.900     0.900 peak   461 spectrum    1 weight  0.10000E+01 volume  0.32208E-02 ppm1      8.308 ppm2      4.402 CV     1
 ASSI {  462}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 63   and name HD1%)
      2.900     1.100     1.100 peak   462 spectrum    1 weight  0.10000E+01 volume  0.32886E-02 ppm1      8.290 ppm2      0.741 CV     1
 ASSI {  463}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 16   and name HG1%)
      3.900     1.900     1.900 peak   463 spectrum    1 weight  0.10000E+01 volume  0.47087E-03 ppm1      8.290 ppm2      0.845 CV     1
 ASSI {  464}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 51   and name HD2%)
      4.200     2.200     1.800 peak   464 spectrum    1 weight  0.10000E+01 volume  0.61829E-03 ppm1      8.284 ppm2      0.572 CV     1
 ASSI {  465}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HB  ))
      2.500     0.800     0.800 peak   465 spectrum    1 weight  0.10000E+01 volume  0.31849E-02 ppm1      8.288 ppm2      1.389 CV     1
 ASSI {  466}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB2 ))
      2.900     1.100     1.100 peak   466 spectrum    1 weight  0.10000E+01 volume  0.14433E-02 ppm1      8.286 ppm2      1.553 CV     1
 OR {  466}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB1 ))
 ASSI {  467}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HG11))
      2.700     0.900     0.900 peak   467 spectrum    1 weight  0.10000E+01 volume  0.24033E-02 ppm1      8.289 ppm2      1.764 CV     1
 OR {  467}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HG12))
 ASSI {  469}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      3.400     1.400     1.400 peak   469 spectrum    1 weight  0.10000E+01 volume  0.79794E-03 ppm1      8.289 ppm2      4.029 CV     1
 ASSI {  470}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
      3.000     1.100     1.100 peak   470 spectrum    1 weight  0.10000E+01 volume  0.11201E-02 ppm1      8.290 ppm2      4.279 CV     1
 ASSI {  471}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HN  ))
      2.700     0.900     0.900 peak   471 spectrum    1 weight  0.10000E+01 volume  0.20570E-02 ppm1      8.287 ppm2      8.103 CV     1
 ASSI {  472}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HG2 ))
      3.300     1.300     1.300 peak   472 spectrum    1 weight  0.10000E+01 volume  0.23414E-02 ppm1      8.283 ppm2      1.381 CV     1
 OR {  472}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HG1 ))
 ASSI {  473}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HD1 ))
      3.200     3.200     2.800 peak   473 spectrum    1 weight  0.10000E+01 volume  0.23940E-03 ppm1      8.278 ppm2      3.028 CV     1
 OR {  473}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HD2 ))
 ASSI {  474}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      2.200     0.600     0.600 peak   474 spectrum    1 weight  0.10000E+01 volume  0.75728E-02 ppm1      8.284 ppm2      4.101 CV     1
 ASSI {  475}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.500     0.800     0.800 peak   475 spectrum    1 weight  0.10000E+01 volume  0.48023E-02 ppm1      8.283 ppm2      4.475 CV     1
 ASSI {  476}
   (( segid "    " and resid 107  and name HN  ))
   (  segid "    " and resid 107  and name HD2%)
      3.000     1.200     1.200 peak   476 spectrum    1 weight  0.10000E+01 volume  0.14027E-02 ppm1      8.261 ppm2      0.726 CV     1
 ASSI {  477}
   (( segid "    " and resid 107  and name HN  ))
   (  segid "    " and resid 107  and name HD1%)
      3.800     1.800     1.800 peak   477 spectrum    1 weight  0.10000E+01 volume  0.11640E-02 ppm1      8.261 ppm2      0.781 CV     1
 ASSI {  478}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
      2.000     0.500     0.500 peak   478 spectrum    1 weight  0.10000E+01 volume  0.12178E-01 ppm1      8.261 ppm2      1.484 CV     1
 OR {  478}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
 ASSI {  479}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 106  and name HA  ))
      1.900     0.500     0.500 peak   479 spectrum    1 weight  0.10000E+01 volume  0.12392E-01 ppm1      8.261 ppm2      4.197 CV     1
 ASSI {  480}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HA  ))
      2.300     0.700     0.700 peak   480 spectrum    1 weight  0.10000E+01 volume  0.57870E-02 ppm1      8.261 ppm2      4.279 CV     1
 ASSI {  483}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HB1 ))
      3.400     1.400     1.400 peak   483 spectrum    1 weight  0.10000E+01 volume  0.14737E-02 ppm1      8.243 ppm2      2.928 CV     1
 OR {  483}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HB2 ))
 ASSI {  485}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
      2.700     0.900     0.900 peak   485 spectrum    1 weight  0.10000E+01 volume  0.24908E-02 ppm1      8.242 ppm2      4.353 CV     1
 ASSI {  486}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      2.300     0.700     0.700 peak   486 spectrum    1 weight  0.10000E+01 volume  0.62093E-02 ppm1      8.242 ppm2      4.483 CV     1
 ASSI {  488}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 8    and name HB% )
      3.300     1.400     1.400 peak   488 spectrum    1 weight  0.10000E+01 volume  0.27048E-02 ppm1      8.239 ppm2      1.285 CV     1
 ASSI {  489}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 7    and name HB2 ))
      2.900     2.900     3.100 peak   489 spectrum    1 weight  0.10000E+01 volume  0.41727E-03 ppm1      8.235 ppm2      2.594 CV     1
 OR {  489}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 7    and name HB1 ))
 ASSI {  490}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 9    and name HB1 ))
      2.500     0.800     0.800 peak   490 spectrum    1 weight  0.10000E+01 volume  0.70061E-02 ppm1      8.239 ppm2      3.785 CV     1
 OR {  490}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 9    and name HB2 ))
 ASSI {  491}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
      2.000     0.500     0.500 peak   491 spectrum    1 weight  0.10000E+01 volume  0.11500E-01 ppm1      8.239 ppm2      4.274 CV     1
 ASSI {  492}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 7    and name HA  ))
      4.000     2.000     2.000 peak   492 spectrum    1 weight  0.10000E+01 volume  0.64635E-03 ppm1      8.234 ppm2      4.507 CV     1
 ASSI {  494}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 11   and name HN  ))
      4.300     2.300     1.700 peak   494 spectrum    1 weight  0.10000E+01 volume  0.34938E-03 ppm1      8.240 ppm2      7.952 CV     1
 ASSI {  495}
   (( segid "    " and resid 8    and name HN  ))
   (  segid "    " and resid 8    and name HB% )
      2.400     0.700     0.700 peak   495 spectrum    1 weight  0.10000E+01 volume  0.62243E-02 ppm1      8.231 ppm2      1.285 CV     1
 ASSI {  496}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 7    and name HB2 ))
      3.200     1.300     1.300 peak   496 spectrum    1 weight  0.10000E+01 volume  0.31697E-02 ppm1      8.230 ppm2      2.600 CV     1
 OR {  496}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 7    and name HB1 ))
 ASSI {  497}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 9    and name HB1 ))
      3.700     1.700     1.700 peak   497 spectrum    1 weight  0.10000E+01 volume  0.63503E-03 ppm1      8.230 ppm2      3.771 CV     1
 OR {  497}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 9    and name HB2 ))
 ASSI {  498}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 8    and name HA  ))
      2.300     0.700     0.700 peak   498 spectrum    1 weight  0.10000E+01 volume  0.62716E-02 ppm1      8.230 ppm2      4.268 CV     1
 ASSI {  499}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 7    and name HA  ))
      2.300     0.700     0.700 peak   499 spectrum    1 weight  0.10000E+01 volume  0.57373E-02 ppm1      8.230 ppm2      4.499 CV     1
 ASSI {  500}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 8    and name HB% )
      4.500     2.500     1.500 peak   500 spectrum    1 weight  0.10000E+01 volume  0.26808E-03 ppm1      8.239 ppm2      1.285 CV     1
 ASSI {  501}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 7    and name HB1 ))
      2.600     0.800     0.800 peak   501 spectrum    1 weight  0.10000E+01 volume  0.56703E-02 ppm1      8.240 ppm2      2.604 CV     1
 OR {  501}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 7    and name HB2 ))
 ASSI {  502}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HB1 ))
      3.500     1.500     1.500 peak   502 spectrum    1 weight  0.10000E+01 volume  0.17660E-02 ppm1      8.239 ppm2      3.757 CV     1
 OR {  502}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HB2 ))
 ASSI {  503}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
      2.200     0.600     0.600 peak   503 spectrum    1 weight  0.10000E+01 volume  0.67900E-02 ppm1      8.240 ppm2      4.350 CV     1
 ASSI {  504}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 7    and name HA  ))
      2.500     0.800     0.800 peak   504 spectrum    1 weight  0.10000E+01 volume  0.33892E-02 ppm1      8.240 ppm2      4.498 CV     1
 ASSI {  505}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HG1 ))
      2.900     1.100     1.100 peak   505 spectrum    1 weight  0.10000E+01 volume  0.14684E-02 ppm1      8.223 ppm2      1.317 CV     1
 OR {  505}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HG2 ))
 ASSI {  506}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HD1 ))
      3.500     1.500     1.500 peak   506 spectrum    1 weight  0.10000E+01 volume  0.10002E-02 ppm1      8.226 ppm2      1.573 CV     1
 OR {  506}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HD2 ))
 ASSI {  507}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HB1 ))
      2.300     0.700     0.700 peak   507 spectrum    1 weight  0.10000E+01 volume  0.44304E-02 ppm1      8.223 ppm2      1.726 CV     1
 OR {  507}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HB2 ))
 ASSI {  509}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HB2 ))
      3.300     1.300     1.300 peak   509 spectrum    1 weight  0.10000E+01 volume  0.15501E-02 ppm1      8.224 ppm2      2.015 CV     1
 OR {  509}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HB1 ))
 ASSI {  510}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HG1 ))
      4.200     2.200     1.800 peak   510 spectrum    1 weight  0.10000E+01 volume  0.36740E-03 ppm1      8.225 ppm2      2.275 CV     1
 OR {  510}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HG2 ))
 ASSI {  511}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      2.600     0.900     0.900 peak   511 spectrum    1 weight  0.10000E+01 volume  0.41101E-02 ppm1      8.224 ppm2      4.043 CV     1
 ASSI {  512}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      2.600     0.800     0.800 peak   512 spectrum    1 weight  0.10000E+01 volume  0.27852E-02 ppm1      8.223 ppm2      4.213 CV     1
 ASSI {  513}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
      2.500     0.800     0.800 peak   513 spectrum    1 weight  0.10000E+01 volume  0.17429E-02 ppm1      8.223 ppm2      8.617 CV     1
 ASSI {  514}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 40   and name HG2%)
      3.400     1.500     1.500 peak   514 spectrum    1 weight  0.10000E+01 volume  0.14932E-02 ppm1      8.222 ppm2      1.095 CV     1
 ASSI {  515}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HA1 ))
      2.400     0.700     0.700 peak   515 spectrum    1 weight  0.10000E+01 volume  0.63277E-02 ppm1      8.224 ppm2      3.793 CV     1
 OR {  515}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HA2 ))
 ASSI {  517}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      2.500     0.800     0.800 peak   517 spectrum    1 weight  0.10000E+01 volume  0.55732E-02 ppm1      8.223 ppm2      4.275 CV     1
 ASSI {  518}
   (( segid "    " and resid 44   and name HN  ))
   (  segid "    " and resid 44   and name HG2%)
      2.800     1.000     1.000 peak   518 spectrum    1 weight  0.10000E+01 volume  0.25826E-02 ppm1      8.210 ppm2      1.117 CV     1
 ASSI {  519}
   (( segid "    " and resid 44   and name HN  ))
   (  segid "    " and resid 43   and name HB% )
      3.100     1.200     1.200 peak   519 spectrum    1 weight  0.10000E+01 volume  0.33552E-02 ppm1      8.210 ppm2      1.316 CV     1
 ASSI {  520}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HB  ))
      3.000     1.100     1.100 peak   520 spectrum    1 weight  0.10000E+01 volume  0.26549E-02 ppm1      8.210 ppm2      4.230 CV     1
 ASSI {  521}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
      2.200     0.600     0.600 peak   521 spectrum    1 weight  0.10000E+01 volume  0.89306E-02 ppm1      8.210 ppm2      4.359 CV     1
 ASSI {  522}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      2.600     0.900     0.900 peak   522 spectrum    1 weight  0.10000E+01 volume  0.28187E-02 ppm1      8.210 ppm2      4.466 CV     1
 ASSI {  523}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
      2.900     1.100     1.100 peak   523 spectrum    1 weight  0.10000E+01 volume  0.21163E-02 ppm1      8.210 ppm2      8.410 CV     1
 ASSI {  524}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 72   and name HG1%)
      3.900     1.900     1.900 peak   524 spectrum    1 weight  0.10000E+01 volume  0.65353E-03 ppm1      8.203 ppm2      0.551 CV     1
 ASSI {  525}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 89   and name HD1%)
      3.600     1.600     1.600 peak   525 spectrum    1 weight  0.10000E+01 volume  0.18854E-02 ppm1      8.202 ppm2      0.684 CV     1
 ASSI {  526}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 88   and name HG1%)
      3.000     1.200     1.200 peak   526 spectrum    1 weight  0.10000E+01 volume  0.17174E-02 ppm1      8.204 ppm2      0.742 CV     1
 ASSI {  527}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 89   and name HD2%)
      3.500     1.600     1.600 peak   527 spectrum    1 weight  0.10000E+01 volume  0.14663E-02 ppm1      8.203 ppm2      0.637 CV     1
 ASSI {  528}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 88   and name HG2%)
      4.200     2.200     1.800 peak   528 spectrum    1 weight  0.10000E+01 volume  0.80289E-03 ppm1      8.202 ppm2      0.955 CV     1
 ASSI {  529}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 86   and name HG1%)
      3.900     1.900     1.900 peak   529 spectrum    1 weight  0.10000E+01 volume  0.53542E-03 ppm1      8.206 ppm2      0.888 CV     1
 ASSI {  531}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HG  ))
      2.300     0.700     0.700 peak   531 spectrum    1 weight  0.10000E+01 volume  0.27053E-02 ppm1      8.202 ppm2      1.576 CV     1
 ASSI {  532}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HB2 ))
      2.500     0.800     0.800 peak   532 spectrum    1 weight  0.10000E+01 volume  0.32991E-02 ppm1      8.204 ppm2      1.881 CV     1
 OR {  532}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HB1 ))
 ASSI {  533}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HB  ))
      2.500     0.800     0.800 peak   533 spectrum    1 weight  0.10000E+01 volume  0.18606E-02 ppm1      8.205 ppm2      2.157 CV     1
 ASSI {  535}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      3.500     1.600     1.600 peak   535 spectrum    1 weight  0.10000E+01 volume  0.56598E-03 ppm1      8.194 ppm2      3.572 CV     1
 ASSI {  536}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      2.800     1.000     1.000 peak   536 spectrum    1 weight  0.10000E+01 volume  0.14831E-02 ppm1      8.204 ppm2      3.781 CV     1
 ASSI {  537}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 87   and name HN  ))
      3.900     1.900     1.900 peak   537 spectrum    1 weight  0.10000E+01 volume  0.35297E-03 ppm1      8.206 ppm2      6.990 CV     1
 ASSI {  540}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 106  and name HD1%)
      4.400     2.400     1.600 peak   540 spectrum    1 weight  0.10000E+01 volume  0.60472E-03 ppm1      8.190 ppm2      0.777 CV     1
 ASSI {  541}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 106  and name HD2%)
      3.900     1.900     1.900 peak   541 spectrum    1 weight  0.10000E+01 volume  0.88131E-03 ppm1      8.189 ppm2      0.725 CV     1
 ASSI {  542}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HB1 ))
      2.200     0.600     0.600 peak   542 spectrum    1 weight  0.10000E+01 volume  0.10433E-01 ppm1      8.189 ppm2      1.457 CV     1
 OR {  542}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HB2 ))
 ASSI {  543}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HB1 ))
      3.200     1.300     1.300 peak   543 spectrum    1 weight  0.10000E+01 volume  0.19867E-02 ppm1      8.190 ppm2      1.729 CV     1
 OR {  543}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HB2 ))
 ASSI {  544}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HG2 ))
      3.200     1.300     1.300 peak   544 spectrum    1 weight  0.10000E+01 volume  0.11735E-02 ppm1      8.190 ppm2      1.893 CV     1
 ASSI {  546}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HD2 ))
      3.700     1.700     1.700 peak   546 spectrum    1 weight  0.10000E+01 volume  0.31338E-03 ppm1      8.191 ppm2      3.513 CV     1
 ASSI {  547}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HA  ))
      2.000     0.500     0.500 peak   547 spectrum    1 weight  0.10000E+01 volume  0.13153E-01 ppm1      8.190 ppm2      4.271 CV     1
 ASSI {  548}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
      3.400     1.400     1.400 peak   548 spectrum    1 weight  0.10000E+01 volume  0.16082E-02 ppm1      8.189 ppm2      3.770 CV     1
 OR {  548}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI {  550}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HB  ))
      3.200     1.300     1.300 peak   550 spectrum    1 weight  0.10000E+01 volume  0.21302E-02 ppm1      8.189 ppm2      4.211 CV     1
 ASSI {  551}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 29   and name HG2%)
      5.100     3.300     0.900 peak   551 spectrum    1 weight  0.10000E+01 volume  0.31875E-03 ppm1      8.153 ppm2      0.577 CV     1
 ASSI {  552}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 52   and name HD1%)
      4.200     2.200     1.800 peak   552 spectrum    1 weight  0.10000E+01 volume  0.50922E-03 ppm1      8.158 ppm2      0.669 CV     1
 ASSI {  553}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 27   and name HD2%)
      4.900     3.000     1.100 peak   553 spectrum    1 weight  0.10000E+01 volume  0.36536E-03 ppm1      8.147 ppm2      0.723 CV     1
 ASSI {  554}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 52   and name HB  ))
      4.200     2.200     1.800 peak   554 spectrum    1 weight  0.10000E+01 volume  0.81696E-03 ppm1      8.158 ppm2      1.613 CV     1
 ASSI {  555}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HB1 ))
      3.800     1.800     1.800 peak   555 spectrum    1 weight  0.10000E+01 volume  0.49807E-03 ppm1      8.152 ppm2      1.699 CV     1
 OR {  555}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HB2 ))
 ASSI {  556}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 28   and name HA2 ))
      2.500     0.800     0.800 peak   556 spectrum    1 weight  0.10000E+01 volume  0.21689E-02 ppm1      8.151 ppm2      3.443 CV     1
 OR {  556}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 28   and name HA1 ))
 ASSI {  557}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 26   and name HB1 ))
      3.500     1.500     1.500 peak   557 spectrum    1 weight  0.10000E+01 volume  0.66064E-03 ppm1      8.154 ppm2      3.695 CV     1
 OR {  557}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 26   and name HB2 ))
 ASSI {  559}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HA  ))
      3.400     1.400     1.400 peak   559 spectrum    1 weight  0.10000E+01 volume  0.67265E-03 ppm1      8.156 ppm2      4.102 CV     1
 ASSI {  560}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      4.400     2.400     1.600 peak   560 spectrum    1 weight  0.10000E+01 volume  0.61680E-03 ppm1      8.147 ppm2      4.451 CV     1
 ASSI {  562}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 29   and name HN  ))
      2.600     0.800     0.800 peak   562 spectrum    1 weight  0.10000E+01 volume  0.19678E-02 ppm1      8.153 ppm2      7.467 CV     1
 ASSI {  564}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 31   and name HD1%)
      3.300     1.400     1.400 peak   564 spectrum    1 weight  0.10000E+01 volume  0.11504E-02 ppm1      8.166 ppm2      0.658 CV     1
 ASSI {  565}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 85   and name HG1%)
      3.300     1.300     1.300 peak   565 spectrum    1 weight  0.10000E+01 volume  0.16368E-02 ppm1      8.164 ppm2      0.715 CV     1
 ASSI {  566}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 86   and name HG1%)
      3.500     1.500     1.500 peak   566 spectrum    1 weight  0.10000E+01 volume  0.26958E-02 ppm1      8.167 ppm2      0.880 CV     1
 ASSI {  567}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 86   and name HG2%)
      2.300     0.700     0.700 peak   567 spectrum    1 weight  0.10000E+01 volume  0.44851E-02 ppm1      8.167 ppm2      1.018 CV     1
 ASSI {  568}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HB  ))
      2.500     0.800     0.800 peak   568 spectrum    1 weight  0.10000E+01 volume  0.21467E-02 ppm1      8.162 ppm2      1.964 CV     1
 ASSI {  569}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HB  ))
      2.300     0.700     0.700 peak   569 spectrum    1 weight  0.10000E+01 volume  0.50109E-02 ppm1      8.167 ppm2      2.107 CV     1
 ASSI {  570}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HB2 ))
      2.500     0.800     0.800 peak   570 spectrum    1 weight  0.10000E+01 volume  0.43948E-02 ppm1      8.152 ppm2      2.812 CV     1
 OR {  570}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HB1 ))
 ASSI {  572}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      2.700     0.900     0.900 peak   572 spectrum    1 weight  0.10000E+01 volume  0.21095E-02 ppm1      8.167 ppm2      3.408 CV     1
 ASSI {  573}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 4    and name HA2 ))
      2.200     0.600     0.600 peak   573 spectrum    1 weight  0.10000E+01 volume  0.93888E-02 ppm1      8.152 ppm2      3.768 CV     1
 OR {  573}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 4    and name HA1 ))
 ASSI {  574}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      2.700     0.900     0.900 peak   574 spectrum    1 weight  0.10000E+01 volume  0.28142E-02 ppm1      8.152 ppm2      4.482 CV     1
 ASSI {  576}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 88   and name HN  ))
      3.800     1.800     1.800 peak   576 spectrum    1 weight  0.10000E+01 volume  0.43061E-03 ppm1      8.155 ppm2      7.788 CV     1
 ASSI {  578}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 16   and name HG1%)
      4.200     2.200     1.800 peak   578 spectrum    1 weight  0.10000E+01 volume  0.38650E-03 ppm1      8.107 ppm2      0.854 CV     1
 ASSI {  579}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HB2 ))
      2.300     0.700     0.700 peak   579 spectrum    1 weight  0.10000E+01 volume  0.52656E-02 ppm1      8.106 ppm2      1.567 CV     1
 OR {  579}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HB1 ))
 ASSI {  581}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HD2 ))
      4.800     2.900     1.200 peak   581 spectrum    1 weight  0.10000E+01 volume  0.27293E-03 ppm1      8.093 ppm2      3.019 CV     1
 OR {  581}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HD1 ))
 ASSI {  582}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HA2 ))
      3.500     1.500     1.500 peak   582 spectrum    1 weight  0.10000E+01 volume  0.63853E-03 ppm1      8.101 ppm2      3.724 CV     1
 OR {  582}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HA1 ))
 ASSI {  583}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      2.600     0.800     0.800 peak   583 spectrum    1 weight  0.10000E+01 volume  0.32665E-02 ppm1      8.106 ppm2      4.015 CV     1
 ASSI {  584}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      4.300     2.300     1.700 peak   584 spectrum    1 weight  0.10000E+01 volume  0.20939E-03 ppm1      8.105 ppm2      4.261 CV     1
 ASSI {  585}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      3.100     1.200     1.200 peak   585 spectrum    1 weight  0.10000E+01 volume  0.11082E-02 ppm1      8.105 ppm2      7.101 CV     1
 ASSI {  587}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HE  ))
      4.300     2.300     1.700 peak   587 spectrum    1 weight  0.10000E+01 volume  0.67814E-03 ppm1      8.103 ppm2      8.791 CV     1
 ASSI {  588}
   (( segid "    " and resid 104  and name HN  ))
   (  segid "    " and resid 104  and name HD1%)
      3.500     1.500     1.500 peak   588 spectrum    1 weight  0.10000E+01 volume  0.19613E-02 ppm1      8.095 ppm2      0.725 CV     1
 ASSI {  589}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 104  and name HG  ))
      2.000     0.500     0.500 peak   589 spectrum    1 weight  0.10000E+01 volume  0.84688E-02 ppm1      8.097 ppm2      1.333 CV     1
 ASSI {  590}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HB2 ))
      3.800     1.800     1.800 peak   590 spectrum    1 weight  0.10000E+01 volume  0.76591E-03 ppm1      8.097 ppm2      1.652 CV     1
 OR {  590}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HB1 ))
 ASSI {  591}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HD1 ))
      2.900     2.900     3.100 peak   591 spectrum    1 weight  0.10000E+01 volume  0.41591E-03 ppm1      8.095 ppm2      2.991 CV     1
 OR {  591}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HD2 ))
 ASSI {  592}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 105  and name HD2 ))
      5.200     3.300     0.800 peak   592 spectrum    1 weight  0.10000E+01 volume  0.22524E-03 ppm1      8.096 ppm2      3.521 CV     1
 OR {  592}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 105  and name HD1 ))
 ASSI {  593}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 10   and name HA1 ))
      3.500     1.600     1.600 peak   593 spectrum    1 weight  0.10000E+01 volume  0.44811E-03 ppm1      8.090 ppm2      3.807 CV     1
 OR {  593}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 10   and name HA2 ))
 ASSI {  594}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      2.200     0.600     0.600 peak   594 spectrum    1 weight  0.10000E+01 volume  0.52641E-02 ppm1      8.097 ppm2      4.230 CV     1
 ASSI {  595}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 104  and name HA  ))
      2.800     1.000     1.000 peak   595 spectrum    1 weight  0.10000E+01 volume  0.14243E-02 ppm1      8.093 ppm2      4.461 CV     1
 ASSI {  596}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      3.300     1.400     1.400 peak   596 spectrum    1 weight  0.10000E+01 volume  0.13480E-02 ppm1      8.098 ppm2      5.276 CV     1
 ASSI {  597}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HN  ))
      4.600     2.600     1.400 peak   597 spectrum    1 weight  0.10000E+01 volume  0.30720E-03 ppm1      8.101 ppm2      8.825 CV     1
 ASSI {  598}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
      4.500     2.500     1.500 peak   598 spectrum    1 weight  0.10000E+01 volume  0.28924E-03 ppm1      8.096 ppm2      9.044 CV     1
 ASSI {  599}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 77   and name HG2%)
      3.400     1.500     1.500 peak   599 spectrum    1 weight  0.10000E+01 volume  0.12712E-02 ppm1      8.089 ppm2      0.412 CV     1
 ASSI {  600}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 69   and name HG2%)
      2.800     2.800     3.200 peak   600 spectrum    1 weight  0.10000E+01 volume  0.52472E-03 ppm1      8.091 ppm2      0.541 CV     1
 ASSI {  601}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 77   and name HG1%)
      3.900     1.900     1.900 peak   601 spectrum    1 weight  0.10000E+01 volume  0.83613E-03 ppm1      8.089 ppm2      0.752 CV     1
 ASSI {  602}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HB2 ))
      2.500     0.800     0.800 peak   602 spectrum    1 weight  0.10000E+01 volume  0.38267E-02 ppm1      8.090 ppm2      1.956 CV     1
 OR {  602}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HB1 ))
 ASSI {  605}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HG2 ))
      2.700     0.900     0.900 peak   605 spectrum    1 weight  0.10000E+01 volume  0.28653E-02 ppm1      8.090 ppm2      2.395 CV     1
 OR {  605}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HG1 ))
 ASSI {  606}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
      4.000     2.000     2.000 peak   606 spectrum    1 weight  0.10000E+01 volume  0.26247E-03 ppm1      8.091 ppm2      2.949 CV     1
 OR {  606}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 76   and name HB1 ))
 ASSI {  607}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
      2.800     0.900     0.900 peak   607 spectrum    1 weight  0.10000E+01 volume  0.23733E-02 ppm1      8.088 ppm2      4.024 CV     1
 ASSI {  608}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HA  ))
      3.000     1.100     1.100 peak   608 spectrum    1 weight  0.10000E+01 volume  0.92763E-03 ppm1      8.089 ppm2      4.475 CV     1
 ASSI {  609}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      3.800     1.800     1.800 peak   609 spectrum    1 weight  0.10000E+01 volume  0.69524E-03 ppm1      8.088 ppm2      4.702 CV     1
 ASSI {  610}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      2.300     0.700     0.700 peak   610 spectrum    1 weight  0.10000E+01 volume  0.39767E-02 ppm1      8.088 ppm2      7.485 CV     1
 ASSI {  611}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 79   and name HN  ))
      3.100     1.200     1.200 peak   611 spectrum    1 weight  0.10000E+01 volume  0.82103E-03 ppm1      8.090 ppm2      8.688 CV     1
 ASSI {  612}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 43   and name HB% )
      4.300     2.300     1.700 peak   612 spectrum    1 weight  0.10000E+01 volume  0.29835E-03 ppm1      8.093 ppm2      1.321 CV     1
 ASSI {  613}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HB1 ))
      2.500     0.800     0.800 peak   613 spectrum    1 weight  0.10000E+01 volume  0.51319E-02 ppm1      8.096 ppm2      1.818 CV     1
 OR {  613}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HB2 ))
 ASSI {  615}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HG1 ))
      2.700     0.900     0.900 peak   615 spectrum    1 weight  0.10000E+01 volume  0.36034E-02 ppm1      8.096 ppm2      2.145 CV     1
 OR {  615}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HG2 ))
 ASSI {  616}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HA1 ))
      2.500     0.800     0.800 peak   616 spectrum    1 weight  0.10000E+01 volume  0.47070E-02 ppm1      8.096 ppm2      3.793 CV     1
 OR {  616}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HA2 ))
 ASSI {  618}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
      2.400     0.700     0.700 peak   618 spectrum    1 weight  0.10000E+01 volume  0.48190E-02 ppm1      8.096 ppm2      4.211 CV     1
 ASSI {  619}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
      3.500     1.500     1.500 peak   619 spectrum    1 weight  0.10000E+01 volume  0.18957E-02 ppm1      8.096 ppm2      8.411 CV     1
 ASSI {  620}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 100  and name HD1%)
      4.100     2.100     1.900 peak   620 spectrum    1 weight  0.10000E+01 volume  0.89726E-03 ppm1      8.073 ppm2      0.518 CV     1
 ASSI {  621}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 99   and name HD2%)
      3.700     1.700     1.700 peak   621 spectrum    1 weight  0.10000E+01 volume  0.24209E-02 ppm1      8.079 ppm2      0.675 CV     1
 ASSI {  622}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
      2.500     0.800     0.800 peak   622 spectrum    1 weight  0.10000E+01 volume  0.32087E-02 ppm1      8.081 ppm2      1.215 CV     1
 OR {  622}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
 ASSI {  624}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HA  ))
      2.300     0.700     0.700 peak   624 spectrum    1 weight  0.10000E+01 volume  0.35851E-02 ppm1      8.080 ppm2      5.140 CV     1
 ASSI {  625}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 71   and name HN  ))
      3.300     1.400     1.400 peak   625 spectrum    1 weight  0.10000E+01 volume  0.81499E-03 ppm1      8.081 ppm2      7.555 CV     1
 ASSI {  626}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      3.700     1.700     1.700 peak   626 spectrum    1 weight  0.10000E+01 volume  0.76926E-03 ppm1      8.083 ppm2      8.925 CV     1
 ASSI {  627}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 40   and name HG2%)
      2.500     0.800     0.800 peak   627 spectrum    1 weight  0.10000E+01 volume  0.39311E-02 ppm1      8.050 ppm2      1.095 CV     1
 ASSI {  628}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
      2.600     2.600     3.400 peak   628 spectrum    1 weight  0.10000E+01 volume  0.70145E-03 ppm1      8.051 ppm2      3.773 CV     1
 OR {  628}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI {  629}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HB  ))
      2.500     0.800     0.800 peak   629 spectrum    1 weight  0.10000E+01 volume  0.40695E-02 ppm1      8.051 ppm2      4.206 CV     1
 ASSI {  630}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      2.200     0.600     0.600 peak   630 spectrum    1 weight  0.10000E+01 volume  0.59061E-02 ppm1      8.051 ppm2      4.341 CV     1
 ASSI {  631}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 63   and name HG2%)
      2.900     1.100     1.100 peak   631 spectrum    1 weight  0.10000E+01 volume  0.22508E-02 ppm1      8.005 ppm2      0.760 CV     1
 ASSI {  632}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
      3.900     3.900     2.100 peak   632 spectrum    1 weight  0.10000E+01 volume  0.46958E-03 ppm1      8.018 ppm2      0.547 CV     1
 ASSI {  633}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 65   and name HG2 ))
      3.400     3.400     2.600 peak   633 spectrum    1 weight  0.10000E+01 volume  0.87204E-03 ppm1      8.003 ppm2      1.572 CV     1
 ASSI {  634}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HB2 ))
      3.300     1.300     1.300 peak   634 spectrum    1 weight  0.10000E+01 volume  0.78862E-03 ppm1      8.005 ppm2      1.872 CV     1
 OR {  634}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HB1 ))
 ASSI {  635}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
      2.600     0.900     0.900 peak   635 spectrum    1 weight  0.10000E+01 volume  0.20842E-02 ppm1      8.006 ppm2      4.272 CV     1
 ASSI {  636}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 24   and name HG2%)
      4.500     2.500     1.500 peak   636 spectrum    1 weight  0.10000E+01 volume  0.51488E-03 ppm1      8.005 ppm2      1.129 CV     1
 ASSI {  637}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 22   and name HB2 ))
      3.900     1.900     1.900 peak   637 spectrum    1 weight  0.10000E+01 volume  0.42840E-03 ppm1      8.007 ppm2      1.739 CV     1
 ASSI {  638}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 25   and name HB2 ))
      3.200     1.300     1.300 peak   638 spectrum    1 weight  0.10000E+01 volume  0.14500E-02 ppm1      8.008 ppm2      3.838 CV     1
 OR {  638}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 25   and name HB1 ))
 ASSI {  640}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      2.700     0.900     0.900 peak   640 spectrum    1 weight  0.10000E+01 volume  0.36795E-02 ppm1      8.008 ppm2      4.287 CV     1
 ASSI {  642}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 26   and name HN  ))
      3.100     1.200     1.200 peak   642 spectrum    1 weight  0.10000E+01 volume  0.10874E-02 ppm1      8.007 ppm2      8.367 CV     1
 ASSI {  643}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 89   and name HD1%)
      2.500     2.500     3.500 peak   643 spectrum    1 weight  0.10000E+01 volume  0.96142E-03 ppm1      7.963 ppm2      0.684 CV     1
 ASSI {  644}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 86   and name HG1%)
      4.200     2.200     1.800 peak   644 spectrum    1 weight  0.10000E+01 volume  0.40324E-03 ppm1      7.968 ppm2      0.866 CV     1
 ASSI {  645}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HB2 ))
      2.900     1.100     1.100 peak   645 spectrum    1 weight  0.10000E+01 volume  0.12316E-02 ppm1      7.967 ppm2      1.403 CV     1
 OR {  645}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HB1 ))
 ASSI {  646}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HG2 ))
      2.900     1.000     1.000 peak   646 spectrum    1 weight  0.10000E+01 volume  0.14678E-02 ppm1      7.964 ppm2      1.543 CV     1
 OR {  646}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HG1 ))
 ASSI {  648}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      2.100     0.600     0.600 peak   648 spectrum    1 weight  0.10000E+01 volume  0.84685E-02 ppm1      7.964 ppm2      1.837 CV     1
 OR {  648}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HB1 ))
 ASSI {  649}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 87   and name HB1 ))
      4.200     2.200     1.800 peak   649 spectrum    1 weight  0.10000E+01 volume  0.43301E-03 ppm1      7.961 ppm2      2.046 CV     1
 OR {  649}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI {  650}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HD1 ))
      5.100     3.300     0.900 peak   650 spectrum    1 weight  0.10000E+01 volume  0.27486E-03 ppm1      7.967 ppm2      3.069 CV     1
 OR {  650}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HD2 ))
 ASSI {  651}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      4.100     2.100     1.900 peak   651 spectrum    1 weight  0.10000E+01 volume  0.24775E-03 ppm1      7.959 ppm2      3.404 CV     1
 ASSI {  652}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      3.300     1.400     1.400 peak   652 spectrum    1 weight  0.10000E+01 volume  0.72166E-03 ppm1      7.963 ppm2      3.797 CV     1
 ASSI {  653}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HA  ))
      2.700     0.900     0.900 peak   653 spectrum    1 weight  0.10000E+01 volume  0.23365E-02 ppm1      7.964 ppm2      3.957 CV     1
 ASSI {  654}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      3.000     1.100     1.100 peak   654 spectrum    1 weight  0.10000E+01 volume  0.13939E-02 ppm1      7.967 ppm2      4.113 CV     1
 ASSI {  655}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      4.000     2.000     2.000 peak   655 spectrum    1 weight  0.10000E+01 volume  0.63670E-03 ppm1      7.967 ppm2      6.976 CV     1
 ASSI {  656}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 91   and name HN  ))
      2.500     0.800     0.800 peak   656 spectrum    1 weight  0.10000E+01 volume  0.22616E-02 ppm1      7.965 ppm2      7.648 CV     1
 ASSI {  657}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HN  ))
      2.500     0.800     0.800 peak   657 spectrum    1 weight  0.10000E+01 volume  0.22394E-02 ppm1      7.964 ppm2      8.203 CV     1
 ASSI {  658}
   (( segid "    " and resid 11   and name HN  ))
   (  segid "    " and resid 104  and name HD1%)
      3.400     1.400     1.400 peak   658 spectrum    1 weight  0.10000E+01 volume  0.12633E-02 ppm1      7.952 ppm2      0.714 CV     1
 ASSI {  659}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 104  and name HB2 ))
      4.300     2.300     1.700 peak   659 spectrum    1 weight  0.10000E+01 volume  0.48699E-03 ppm1      7.956 ppm2      1.295 CV     1
 OR {  659}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 104  and name HB1 ))
 ASSI {  660}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 104  and name HG  ))
      4.000     2.000     2.000 peak   660 spectrum    1 weight  0.10000E+01 volume  0.38838E-03 ppm1      7.957 ppm2      1.351 CV     1
 ASSI {  661}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HB2 ))
      2.900     1.000     1.000 peak   661 spectrum    1 weight  0.10000E+01 volume  0.18370E-02 ppm1      7.954 ppm2      2.793 CV     1
 OR {  661}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HB1 ))
 ASSI {  663}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HA1 ))
      2.300     0.600     0.600 peak   663 spectrum    1 weight  0.10000E+01 volume  0.82538E-02 ppm1      7.954 ppm2      3.822 CV     1
 OR {  663}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HA2 ))
 ASSI {  664}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
      3.500     1.500     1.500 peak   664 spectrum    1 weight  0.10000E+01 volume  0.11726E-02 ppm1      7.952 ppm2      4.283 CV     1
 ASSI {  665}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      2.800     1.000     1.000 peak   665 spectrum    1 weight  0.10000E+01 volume  0.18746E-02 ppm1      7.955 ppm2      5.274 CV     1
 ASSI {  667}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
      3.900     1.900     1.900 peak   667 spectrum    1 weight  0.10000E+01 volume  0.79126E-03 ppm1      7.955 ppm2      9.044 CV     1
 ASSI {  668}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
      3.200     1.300     1.300 peak   668 spectrum    1 weight  0.10000E+01 volume  0.18979E-02 ppm1      7.935 ppm2      0.550 CV     1
 ASSI {  669}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
      3.300     1.400     1.400 peak   669 spectrum    1 weight  0.10000E+01 volume  0.25096E-02 ppm1      7.938 ppm2      0.678 CV     1
 ASSI {  670}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 48   and name HB  ))
      2.600     0.800     0.800 peak   670 spectrum    1 weight  0.10000E+01 volume  0.27728E-02 ppm1      7.937 ppm2      2.115 CV     1
 ASSI {  672}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
      2.700     0.900     0.900 peak   672 spectrum    1 weight  0.10000E+01 volume  0.29612E-02 ppm1      7.937 ppm2      2.687 CV     1
 OR {  672}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HB1 ))
 ASSI {  674}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HB2 ))
      4.300     2.300     1.700 peak   674 spectrum    1 weight  0.10000E+01 volume  0.39247E-03 ppm1      7.936 ppm2      3.365 CV     1
 OR {  674}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HB1 ))
 ASSI {  675}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      4.300     2.300     1.700 peak   675 spectrum    1 weight  0.10000E+01 volume  0.24447E-03 ppm1      7.935 ppm2      3.679 CV     1
 ASSI {  676}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      3.300     1.300     1.300 peak   676 spectrum    1 weight  0.10000E+01 volume  0.12438E-02 ppm1      7.936 ppm2      3.782 CV     1
 ASSI {  677}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      3.100     1.200     1.200 peak   677 spectrum    1 weight  0.10000E+01 volume  0.11654E-02 ppm1      7.936 ppm2      4.194 CV     1
 ASSI {  678}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      4.200     2.200     1.800 peak   678 spectrum    1 weight  0.10000E+01 volume  0.49935E-03 ppm1      7.934 ppm2      8.555 CV     1
 ASSI {  679}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
      3.300     1.400     1.400 peak   679 spectrum    1 weight  0.10000E+01 volume  0.68057E-03 ppm1      7.936 ppm2      8.867 CV     1
 ASSI {  680}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      2.900     1.000     1.000 peak   680 spectrum    1 weight  0.10000E+01 volume  0.17652E-02 ppm1      7.936 ppm2      9.703 CV     1
 ASSI {  681}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      4.500     2.500     1.500 peak   681 spectrum    1 weight  0.10000E+01 volume  0.19669E-03 ppm1      7.941 ppm2      0.865 CV     1
 ASSI {  684}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      2.700     0.900     0.900 peak   684 spectrum    1 weight  0.10000E+01 volume  0.34524E-02 ppm1      7.941 ppm2      2.812 CV     1
 OR {  684}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HB1 ))
 ASSI {  685}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HA1 ))
      2.400     0.700     0.700 peak   685 spectrum    1 weight  0.10000E+01 volume  0.63140E-02 ppm1      7.941 ppm2      3.590 CV     1
 OR {  685}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HA2 ))
 ASSI {  687}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      3.900     1.900     1.900 peak   687 spectrum    1 weight  0.10000E+01 volume  0.48715E-03 ppm1      7.945 ppm2      4.167 CV     1
 ASSI {  688}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      2.700     0.900     0.900 peak   688 spectrum    1 weight  0.10000E+01 volume  0.20139E-02 ppm1      7.942 ppm2      4.986 CV     1
 ASSI {  689}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HD22))
      4.800     2.800     1.200 peak   689 spectrum    1 weight  0.10000E+01 volume  0.21427E-03 ppm1      7.939 ppm2      7.096 CV     1
 ASSI {  690}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HD21))
      3.400     1.500     1.500 peak   690 spectrum    1 weight  0.10000E+01 volume  0.56493E-03 ppm1      7.939 ppm2      7.695 CV     1
 ASSI {  691}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 93   and name HN  ))
      2.800     1.000     1.000 peak   691 spectrum    1 weight  0.10000E+01 volume  0.15411E-02 ppm1      7.941 ppm2      8.544 CV     1
 ASSI {  693}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 85   and name HG1%)
      3.800     1.800     1.800 peak   693 spectrum    1 weight  0.10000E+01 volume  0.15795E-02 ppm1      7.897 ppm2      0.727 CV     1
 ASSI {  694}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
      2.200     0.600     0.600 peak   694 spectrum    1 weight  0.10000E+01 volume  0.42754E-02 ppm1      7.897 ppm2      0.901 CV     1
 ASSI {  695}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 86   and name HG2%)
      4.000     2.000     2.000 peak   695 spectrum    1 weight  0.10000E+01 volume  0.83147E-03 ppm1      7.894 ppm2      1.012 CV     1
 ASSI {  696}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 81   and name HB% )
      2.800     2.800     3.200 peak   696 spectrum    1 weight  0.10000E+01 volume  0.45874E-03 ppm1      7.900 ppm2      1.410 CV     1
 ASSI {  697}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 85   and name HB  ))
      2.500     0.800     0.800 peak   697 spectrum    1 weight  0.10000E+01 volume  0.29012E-02 ppm1      7.897 ppm2      1.970 CV     1
 ASSI {  698}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 80   and name HB1 ))
      4.100     2.100     1.900 peak   698 spectrum    1 weight  0.10000E+01 volume  0.29162E-03 ppm1      7.898 ppm2      1.811 CV     1
 ASSI {  699}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HB1 ))
      3.100     1.200     1.200 peak   699 spectrum    1 weight  0.10000E+01 volume  0.93676E-03 ppm1      7.900 ppm2      2.820 CV     1
 OR {  699}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI {  700}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      3.000     1.100     1.100 peak   700 spectrum    1 weight  0.10000E+01 volume  0.11685E-02 ppm1      7.895 ppm2      3.406 CV     1
 ASSI {  701}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      3.300     1.400     1.400 peak   701 spectrum    1 weight  0.10000E+01 volume  0.69733E-03 ppm1      7.892 ppm2      3.572 CV     1
 ASSI {  702}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      3.500     1.600     1.600 peak   702 spectrum    1 weight  0.10000E+01 volume  0.58693E-03 ppm1      7.898 ppm2      4.512 CV     1
 ASSI {  703}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HN  ))
      2.400     0.700     0.700 peak   703 spectrum    1 weight  0.10000E+01 volume  0.36362E-02 ppm1      7.896 ppm2      6.967 CV     1
 ASSI {  704}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      2.500     0.800     0.800 peak   704 spectrum    1 weight  0.10000E+01 volume  0.22147E-02 ppm1      7.897 ppm2      8.167 CV     1
 ASSI {  706}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 107  and name HD2%)
      2.600     2.600     3.400 peak   706 spectrum    1 weight  0.10000E+01 volume  0.73407E-03 ppm1      7.805 ppm2      0.727 CV     1
 ASSI {  707}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 107  and name HD1%)
      4.300     2.300     1.700 peak   707 spectrum    1 weight  0.10000E+01 volume  0.51519E-03 ppm1      7.806 ppm2      0.786 CV     1
 ASSI {  708}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
      2.800     1.000     1.000 peak   708 spectrum    1 weight  0.10000E+01 volume  0.34710E-02 ppm1      7.805 ppm2      1.481 CV     1
 OR {  708}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
 ASSI {  709}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HB2 ))
      2.800     1.000     1.000 peak   709 spectrum    1 weight  0.10000E+01 volume  0.25201E-02 ppm1      7.805 ppm2      1.756 CV     1
 OR {  709}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HB1 ))
 ASSI {  711}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HG1 ))
      3.300     1.400     1.400 peak   711 spectrum    1 weight  0.10000E+01 volume  0.12026E-02 ppm1      7.806 ppm2      2.045 CV     1
 OR {  711}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HG2 ))
 ASSI {  712}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HA  ))
      2.800     1.000     1.000 peak   712 spectrum    1 weight  0.10000E+01 volume  0.20403E-02 ppm1      7.807 ppm2      4.003 CV     1
 ASSI {  713}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HA  ))
      2.100     0.500     0.500 peak   713 spectrum    1 weight  0.10000E+01 volume  0.97440E-02 ppm1      7.805 ppm2      4.279 CV     1
 ASSI {  714}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HN  ))
      3.500     1.500     1.500 peak   714 spectrum    1 weight  0.10000E+01 volume  0.18255E-02 ppm1      7.805 ppm2      8.262 CV     1
 ASSI {  715}
   (( segid "    " and resid 88   and name HN  ))
   (  segid "    " and resid 88   and name HG1%)
      3.500     1.500     1.500 peak   715 spectrum    1 weight  0.10000E+01 volume  0.27205E-02 ppm1      7.788 ppm2      0.744 CV     1
 ASSI {  716}
   (( segid "    " and resid 88   and name HN  ))
   (  segid "    " and resid 88   and name HG2%)
      2.300     0.700     0.700 peak   716 spectrum    1 weight  0.10000E+01 volume  0.49562E-02 ppm1      7.788 ppm2      0.955 CV     1
 ASSI {  717}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 89   and name HB2 ))
      4.100     2.100     1.900 peak   717 spectrum    1 weight  0.10000E+01 volume  0.67011E-03 ppm1      7.786 ppm2      1.890 CV     1
 OR {  717}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 89   and name HB1 ))
 ASSI {  718}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HB2 ))
      2.700     0.900     0.900 peak   718 spectrum    1 weight  0.10000E+01 volume  0.23864E-02 ppm1      7.788 ppm2      2.057 CV     1
 OR {  718}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HB1 ))
 ASSI {  719}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HG2 ))
      3.700     1.700     1.700 peak   719 spectrum    1 weight  0.10000E+01 volume  0.11435E-02 ppm1      7.787 ppm2      2.276 CV     1
 OR {  719}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HG1 ))
 ASSI {  720}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HB  ))
      2.300     0.700     0.700 peak   720 spectrum    1 weight  0.10000E+01 volume  0.39007E-02 ppm1      7.788 ppm2      2.157 CV     1
 ASSI {  721}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      2.900     1.000     1.000 peak   721 spectrum    1 weight  0.10000E+01 volume  0.17256E-02 ppm1      7.788 ppm2      3.406 CV     1
 ASSI {  722}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      2.800     1.000     1.000 peak   722 spectrum    1 weight  0.10000E+01 volume  0.18530E-02 ppm1      7.788 ppm2      3.564 CV     1
 ASSI {  723}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      3.600     1.700     1.700 peak   723 spectrum    1 weight  0.10000E+01 volume  0.46269E-03 ppm1      7.784 ppm2      4.100 CV     1
 ASSI {  724}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HN  ))
      2.600     0.900     0.900 peak   724 spectrum    1 weight  0.10000E+01 volume  0.20426E-02 ppm1      7.787 ppm2      6.998 CV     1
 ASSI {  725}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 89   and name HN  ))
      2.800     0.900     0.900 peak   725 spectrum    1 weight  0.10000E+01 volume  0.17086E-02 ppm1      7.789 ppm2      8.200 CV     1
 ASSI {  726}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      3.700     1.700     1.700 peak   726 spectrum    1 weight  0.10000E+01 volume  0.45686E-03 ppm1      7.785 ppm2      7.951 CV     1
 ASSI {  727}
   (( segid "    " and resid 17   and name HN  ))
   (  segid "    " and resid 16   and name HG2%)
      4.100     2.100     1.900 peak   727 spectrum    1 weight  0.10000E+01 volume  0.12317E-02 ppm1      7.740 ppm2      0.746 CV     1
 ASSI {  728}
   (( segid "    " and resid 17   and name HN  ))
   (  segid "    " and resid 16   and name HG1%)
      2.900     1.100     1.100 peak   728 spectrum    1 weight  0.10000E+01 volume  0.13059E-02 ppm1      7.740 ppm2      0.849 CV     1
 ASSI {  729}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HB1 ))
      3.000     1.100     1.100 peak   729 spectrum    1 weight  0.10000E+01 volume  0.13745E-02 ppm1      7.740 ppm2      1.676 CV     1
 OR {  729}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HB2 ))
 ASSI {  730}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HG2 ))
      2.800     1.000     1.000 peak   730 spectrum    1 weight  0.10000E+01 volume  0.24345E-02 ppm1      7.740 ppm2      1.780 CV     1
 OR {  730}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HG1 ))
 ASSI {  732}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
      2.200     0.600     0.600 peak   732 spectrum    1 weight  0.10000E+01 volume  0.66447E-02 ppm1      7.740 ppm2      4.377 CV     1
 ASSI {  733}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
      3.000     1.200     1.200 peak   733 spectrum    1 weight  0.10000E+01 volume  0.96387E-03 ppm1      7.735 ppm2      5.068 CV     1
 ASSI {  734}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HN  ))
      4.200     2.200     1.800 peak   734 spectrum    1 weight  0.10000E+01 volume  0.42797E-03 ppm1      7.741 ppm2      8.591 CV     1
 ASSI {  736}
   (( segid "    " and resid 94   and name HD21))
   (( segid "    " and resid 94   and name HB1 ))
      3.000     1.100     1.100 peak   736 spectrum    1 weight  0.10000E+01 volume  0.14117E-02 ppm1      7.694 ppm2      2.806 CV     1
 OR {  736}
   (( segid "    " and resid 94   and name HD21))
   (( segid "    " and resid 94   and name HB2 ))
 ASSI {  737}
   (( segid "    " and resid 94   and name HD21))
   (( segid "    " and resid 94   and name HD22))
      2.000     0.500     0.500 peak   737 spectrum    1 weight  0.10000E+01 volume  0.62766E-02 ppm1      7.696 ppm2      7.092 CV     1
 ASSI {  738}
   (( segid "    " and resid 90   and name HE  ))
   (( segid "    " and resid 90   and name HG2 ))
      3.600     1.600     1.600 peak   738 spectrum    1 weight  0.10000E+01 volume  0.34405E-03 ppm1      7.667 ppm2      1.527 CV     1
 OR {  738}
   (( segid "    " and resid 90   and name HE  ))
   (( segid "    " and resid 90   and name HG1 ))
 ASSI {  740}
   (( segid "    " and resid 90   and name HE  ))
   (( segid "    " and resid 90   and name HB2 ))
      3.100     1.200     1.200 peak   740 spectrum    1 weight  0.10000E+01 volume  0.72665E-03 ppm1      7.665 ppm2      1.836 CV     1
 OR {  740}
   (( segid "    " and resid 90   and name HE  ))
   (( segid "    " and resid 90   and name HB1 ))
 ASSI {  741}
   (( segid "    " and resid 90   and name HE  ))
   (( segid "    " and resid 90   and name HD1 ))
      2.900     1.100     1.100 peak   741 spectrum    1 weight  0.10000E+01 volume  0.11993E-02 ppm1      7.666 ppm2      3.064 CV     1
 OR {  741}
   (( segid "    " and resid 90   and name HE  ))
   (( segid "    " and resid 90   and name HD2 ))
 ASSI {  743}
   (( segid "    " and resid 90   and name HE  ))
   (( segid "    " and resid 87   and name HA  ))
      3.900     1.900     1.900 peak   743 spectrum    1 weight  0.10000E+01 volume  0.15478E-03 ppm1      7.671 ppm2      4.108 CV     1
 ASSI {  744}
   (( segid "    " and resid 90   and name HE  ))
   (( segid "    " and resid 86   and name HN  ))
      3.600     3.600     2.400 peak   744 spectrum    1 weight  0.10000E+01 volume  0.10562E-03 ppm1      7.666 ppm2      8.157 CV     1
 ASSI {  745}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 51   and name HD2%)
      3.900     1.900     1.900 peak   745 spectrum    1 weight  0.10000E+01 volume  0.42419E-03 ppm1      7.654 ppm2      0.563 CV     1
 ASSI {  746}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 51   and name HD1%)
      3.900     1.900     1.900 peak   746 spectrum    1 weight  0.10000E+01 volume  0.56348E-03 ppm1      7.662 ppm2      0.641 CV     1
 ASSI {  747}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 18   and name HD1%)
      4.000     2.000     2.000 peak   747 spectrum    1 weight  0.10000E+01 volume  0.52425E-03 ppm1      7.661 ppm2      0.703 CV     1
 ASSI {  748}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 52   and name HG2%)
      3.200     3.200     2.800 peak   748 spectrum    1 weight  0.10000E+01 volume  0.21009E-03 ppm1      7.665 ppm2      0.892 CV     1
 ASSI {  749}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 57   and name HB% )
      2.700     0.900     0.900 peak   749 spectrum    1 weight  0.10000E+01 volume  0.23907E-02 ppm1      7.658 ppm2      1.191 CV     1
 ASSI {  750}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 58   and name HB% )
      2.300     0.700     0.700 peak   750 spectrum    1 weight  0.10000E+01 volume  0.55775E-02 ppm1      7.659 ppm2      1.362 CV     1
 ASSI {  751}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      3.700     1.700     1.700 peak   751 spectrum    1 weight  0.10000E+01 volume  0.38795E-03 ppm1      7.661 ppm2      3.709 CV     1
 OR {  751}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
 ASSI {  752}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      2.600     0.800     0.800 peak   752 spectrum    1 weight  0.10000E+01 volume  0.34379E-02 ppm1      7.658 ppm2      3.952 CV     1
 ASSI {  755}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      2.600     0.800     0.800 peak   755 spectrum    1 weight  0.10000E+01 volume  0.24492E-02 ppm1      7.658 ppm2      8.492 CV     1
 ASSI {  756}
   (( segid "    " and resid 91   and name HN  ))
   (  segid "    " and resid 88   and name HG1%)
      3.400     1.500     1.500 peak   756 spectrum    1 weight  0.10000E+01 volume  0.91374E-03 ppm1      7.645 ppm2      0.757 CV     1
 ASSI {  757}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 52   and name HG2%)
      3.200     1.300     1.300 peak   757 spectrum    1 weight  0.10000E+01 volume  0.92872E-03 ppm1      7.635 ppm2      0.881 CV     1
 ASSI {  758}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 58   and name HB% )
      2.500     0.800     0.800 peak   758 spectrum    1 weight  0.10000E+01 volume  0.36826E-02 ppm1      7.634 ppm2      1.363 CV     1
 ASSI {  759}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HG1 ))
      3.600     1.700     1.700 peak   759 spectrum    1 weight  0.10000E+01 volume  0.80888E-03 ppm1      7.645 ppm2      1.522 CV     1
 ASSI {  760}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 52   and name HB  ))
      3.100     1.200     1.200 peak   760 spectrum    1 weight  0.10000E+01 volume  0.10944E-02 ppm1      7.640 ppm2      1.612 CV     1
 ASSI {  761}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      2.600     0.800     0.800 peak   761 spectrum    1 weight  0.10000E+01 volume  0.37644E-02 ppm1      7.647 ppm2      1.835 CV     1
 OR {  761}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HB1 ))
 ASSI {  762}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HB1 ))
      2.500     0.800     0.800 peak   762 spectrum    1 weight  0.10000E+01 volume  0.34631E-02 ppm1      7.647 ppm2      2.537 CV     1
 OR {  762}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
 ASSI {  765}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      3.200     1.300     1.300 peak   765 spectrum    1 weight  0.10000E+01 volume  0.10290E-02 ppm1      7.646 ppm2      3.566 CV     1
 ASSI {  766}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      3.000     1.100     1.100 peak   766 spectrum    1 weight  0.10000E+01 volume  0.13131E-02 ppm1      7.630 ppm2      3.697 CV     1
 OR {  766}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
 ASSI {  767}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HA  ))
      2.700     0.900     0.900 peak   767 spectrum    1 weight  0.10000E+01 volume  0.31526E-02 ppm1      7.640 ppm2      3.962 CV     1
 ASSI {  768}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HA1 ))
      2.700     0.900     0.900 peak   768 spectrum    1 weight  0.10000E+01 volume  0.35637E-02 ppm1      7.637 ppm2      4.107 CV     1
 OR {  768}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HA2 ))
 ASSI {  769}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      2.900     1.100     1.100 peak   769 spectrum    1 weight  0.10000E+01 volume  0.15857E-02 ppm1      7.634 ppm2      4.391 CV     1
 ASSI {  770}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      2.800     1.000     1.000 peak   770 spectrum    1 weight  0.10000E+01 volume  0.20165E-02 ppm1      7.646 ppm2      4.652 CV     1
 ASSI {  772}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      2.400     0.700     0.700 peak   772 spectrum    1 weight  0.10000E+01 volume  0.32049E-02 ppm1      7.647 ppm2      6.975 CV     1
 ASSI {  773}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HD21))
      3.100     1.200     1.200 peak   773 spectrum    1 weight  0.10000E+01 volume  0.12130E-02 ppm1      7.644 ppm2      7.441 CV     1
 ASSI {  775}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 89   and name HN  ))
      4.000     2.000     2.000 peak   775 spectrum    1 weight  0.10000E+01 volume  0.31117E-03 ppm1      7.649 ppm2      8.204 CV     1
 ASSI {  776}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      4.600     2.600     1.400 peak   776 spectrum    1 weight  0.10000E+01 volume  0.17598E-03 ppm1      7.626 ppm2      8.487 CV     1
 ASSI {  777}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HN  ))
      2.700     0.900     0.900 peak   777 spectrum    1 weight  0.10000E+01 volume  0.15867E-02 ppm1      7.633 ppm2      9.011 CV     1
 ASSI {  778}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 56   and name HN  ))
      3.900     1.900     1.900 peak   778 spectrum    1 weight  0.10000E+01 volume  0.69672E-03 ppm1      7.630 ppm2      9.108 CV     1
 ASSI {  779}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 77   and name HG2%)
      3.900     1.900     1.900 peak   779 spectrum    1 weight  0.10000E+01 volume  0.37770E-03 ppm1      7.556 ppm2      0.407 CV     1
 ASSI {  780}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 69   and name HG2%)
      2.800     1.000     1.000 peak   780 spectrum    1 weight  0.10000E+01 volume  0.24825E-02 ppm1      7.557 ppm2      0.512 CV     1
 ASSI {  781}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 99   and name HD2%)
      3.500     1.500     1.500 peak   781 spectrum    1 weight  0.10000E+01 volume  0.10268E-02 ppm1      7.556 ppm2      0.676 CV     1
 ASSI {  782}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HG1 ))
      2.700     0.900     0.900 peak   782 spectrum    1 weight  0.10000E+01 volume  0.20393E-02 ppm1      7.558 ppm2      1.220 CV     1
 OR {  782}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HG2 ))
 ASSI {  783}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HB2 ))
      2.600     0.800     0.800 peak   783 spectrum    1 weight  0.10000E+01 volume  0.18259E-02 ppm1      7.552 ppm2      1.323 CV     1
 OR {  783}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HB1 ))
 ASSI {  784}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      3.100     1.200     1.200 peak   784 spectrum    1 weight  0.10000E+01 volume  0.10585E-02 ppm1      7.556 ppm2      1.567 CV     1
 OR {  784}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI {  785}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      5.300     3.500     0.700 peak   785 spectrum    1 weight  0.10000E+01 volume  0.20083E-03 ppm1      7.558 ppm2      3.871 CV     1
 ASSI {  786}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      3.000     1.100     1.100 peak   786 spectrum    1 weight  0.10000E+01 volume  0.63254E-03 ppm1      7.563 ppm2      5.134 CV     1
 ASSI {  788}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
      2.600     0.900     0.900 peak   788 spectrum    1 weight  0.10000E+01 volume  0.16557E-02 ppm1      7.556 ppm2      8.959 CV     1
 ASSI {  790}
   (( segid "    " and resid 66   and name HD21))
   (( segid "    " and resid 66   and name HB1 ))
      2.700     0.900     0.900 peak   790 spectrum    1 weight  0.10000E+01 volume  0.22973E-02 ppm1      7.535 ppm2      3.364 CV     1
 OR {  790}
   (( segid "    " and resid 66   and name HD21))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI {  792}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
      4.100     2.100     1.900 peak   792 spectrum    1 weight  0.10000E+01 volume  0.10211E-02 ppm1      7.528 ppm2      0.655 CV     1
 ASSI {  793}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 48   and name HG1%)
      2.500     0.800     0.800 peak   793 spectrum    1 weight  0.10000E+01 volume  0.33775E-02 ppm1      7.528 ppm2      0.556 CV     1
 ASSI {  794}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 24   and name HG2%)
      2.700     0.900     0.900 peak   794 spectrum    1 weight  0.10000E+01 volume  0.27638E-02 ppm1      7.512 ppm2      1.130 CV     1
 ASSI {  796}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HG2 ))
      3.300     1.400     1.400 peak   796 spectrum    1 weight  0.10000E+01 volume  0.15678E-02 ppm1      7.526 ppm2      1.307 CV     1
 OR {  796}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HG1 ))
 ASSI {  798}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
      2.900     1.000     1.000 peak   798 spectrum    1 weight  0.10000E+01 volume  0.22010E-02 ppm1      7.529 ppm2      1.482 CV     1
 OR {  798}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
 ASSI {  799}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 22   and name HB1 ))
      2.900     1.000     1.000 peak   799 spectrum    1 weight  0.10000E+01 volume  0.15168E-02 ppm1      7.514 ppm2      1.735 CV     1
 OR {  799}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 22   and name HB2 ))
 ASSI {  800}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HB2 ))
      3.500     1.600     1.600 peak   800 spectrum    1 weight  0.10000E+01 volume  0.10909E-02 ppm1      7.512 ppm2      2.685 CV     1
 OR {  800}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HB1 ))
 ASSI {  801}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
      2.600     0.900     0.900 peak   801 spectrum    1 weight  0.10000E+01 volume  0.32206E-02 ppm1      7.528 ppm2      3.675 CV     1
 OR {  801}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
 ASSI {  803}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      2.100     2.100     3.900 peak   803 spectrum    1 weight  0.10000E+01 volume  0.86345E-02 ppm1      7.521 ppm2      4.276 CV     1
 ASSI {  804}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
      2.700     0.900     0.900 peak   804 spectrum    1 weight  0.10000E+01 volume  0.17147E-02 ppm1      7.510 ppm2      8.011 CV     1
 ASSI {  808}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      2.400     0.700     0.700 peak   808 spectrum    1 weight  0.10000E+01 volume  0.28087E-02 ppm1      7.528 ppm2      9.430 CV     1
 ASSI {  809}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 77   and name HG2%)
      4.900     3.000     1.100 peak   809 spectrum    1 weight  0.10000E+01 volume  0.19137E-03 ppm1      7.529 ppm2      0.414 CV     1
 ASSI {  810}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 85   and name HG1%)
      4.500     2.500     1.500 peak   810 spectrum    1 weight  0.10000E+01 volume  0.38269E-03 ppm1      7.524 ppm2      0.744 CV     1
 ASSI {  811}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
      3.400     1.400     1.400 peak   811 spectrum    1 weight  0.10000E+01 volume  0.84647E-03 ppm1      7.521 ppm2      0.902 CV     1
 ASSI {  812}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 81   and name HB% )
      5.200     3.400     0.800 peak   812 spectrum    1 weight  0.10000E+01 volume  0.16152E-03 ppm1      7.523 ppm2      1.409 CV     1
 ASSI {  813}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HB1 ))
      2.400     0.700     0.700 peak   813 spectrum    1 weight  0.10000E+01 volume  0.34510E-02 ppm1      7.523 ppm2      1.821 CV     1
 OR {  813}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HB2 ))
 ASSI {  814}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 80   and name HE% )
      3.200     1.300     1.300 peak   814 spectrum    1 weight  0.10000E+01 volume  0.30349E-02 ppm1      7.525 ppm2      1.898 CV     1
 ASSI {  815}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HG2 ))
      2.700     0.900     0.900 peak   815 spectrum    1 weight  0.10000E+01 volume  0.28406E-02 ppm1      7.524 ppm2      2.386 CV     1
 OR {  815}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HG1 ))
 ASSI {  817}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HA2 ))
      3.200     1.300     1.300 peak   817 spectrum    1 weight  0.10000E+01 volume  0.15093E-02 ppm1      7.524 ppm2      3.795 CV     1
 OR {  817}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HA1 ))
 ASSI {  819}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 78   and name HA  ))
      3.800     1.800     1.800 peak   819 spectrum    1 weight  0.10000E+01 volume  0.14857E-02 ppm1      7.529 ppm2      4.029 CV     1
 ASSI {  820}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      2.600     0.800     0.800 peak   820 spectrum    1 weight  0.10000E+01 volume  0.25436E-02 ppm1      7.526 ppm2      4.191 CV     1
 ASSI {  821}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 77   and name HA  ))
      3.600     1.600     1.600 peak   821 spectrum    1 weight  0.10000E+01 volume  0.55323E-03 ppm1      7.525 ppm2      4.479 CV     1
 ASSI {  823}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
      3.700     1.700     1.700 peak   823 spectrum    1 weight  0.10000E+01 volume  0.92012E-03 ppm1      7.523 ppm2      8.787 CV     1
 ASSI {  824}
   (( segid "    " and resid 76   and name HD21))
   (( segid "    " and resid 76   and name HB2 ))
      2.900     1.100     1.100 peak   824 spectrum    1 weight  0.10000E+01 volume  0.14076E-02 ppm1      7.520 ppm2      2.672 CV     1
 OR {  824}
   (( segid "    " and resid 76   and name HD21))
   (( segid "    " and resid 76   and name HB1 ))
 ASSI {  827}
   (( segid "    " and resid 76   and name HD21))
   (( segid "    " and resid 76   and name HN  ))
      3.900     1.900     1.900 peak   827 spectrum    1 weight  0.10000E+01 volume  0.37014E-03 ppm1      7.524 ppm2      8.702 CV     1
 ASSI {  829}
   (( segid "    " and resid 78   and name HE21))
   (( segid "    " and resid 70   and name HB1 ))
      3.700     1.700     1.700 peak   829 spectrum    1 weight  0.10000E+01 volume  0.51555E-03 ppm1      7.502 ppm2      1.318 CV     1
 ASSI {  830}
   (( segid "    " and resid 78   and name HE21))
   (( segid "    " and resid 78   and name HB1 ))
      3.400     1.400     1.400 peak   830 spectrum    1 weight  0.10000E+01 volume  0.10257E-02 ppm1      7.502 ppm2      1.952 CV     1
 OR {  830}
   (( segid "    " and resid 78   and name HE21))
   (( segid "    " and resid 78   and name HB2 ))
 ASSI {  832}
   (( segid "    " and resid 37   and name HE21))
   (( segid "    " and resid 37   and name HG2 ))
      2.500     0.800     0.800 peak   832 spectrum    1 weight  0.10000E+01 volume  0.37306E-02 ppm1      7.493 ppm2      2.241 CV     1
 OR {  832}
   (( segid "    " and resid 37   and name HE21))
   (( segid "    " and resid 37   and name HG1 ))
 ASSI {  833}
   (( segid "    " and resid 78   and name HE21))
   (( segid "    " and resid 78   and name HG2 ))
      2.700     0.900     0.900 peak   833 spectrum    1 weight  0.10000E+01 volume  0.19672E-02 ppm1      7.503 ppm2      2.394 CV     1
 OR {  833}
   (( segid "    " and resid 78   and name HE21))
   (( segid "    " and resid 78   and name HG1 ))
 ASSI {  834}
   (( segid "    " and resid 78   and name HE21))
   (( segid "    " and resid 78   and name HE22))
      1.600     0.300     0.600 peak   834 spectrum    1 weight  0.10000E+01 volume  0.17178E-01 ppm1      7.503 ppm2      6.889 CV     1
 ASSI {  837}
   (( segid "    " and resid 77   and name HN  ))
   (  segid "    " and resid 77   and name HG2%)
      2.500     0.800     0.800 peak   837 spectrum    1 weight  0.10000E+01 volume  0.22455E-02 ppm1      7.478 ppm2      0.412 CV     1
 ASSI {  838}
   (( segid "    " and resid 77   and name HN  ))
   (  segid "    " and resid 72   and name HG2%)
      4.100     2.100     1.900 peak   838 spectrum    1 weight  0.10000E+01 volume  0.55240E-03 ppm1      7.479 ppm2      0.538 CV     1
 ASSI {  839}
   (( segid "    " and resid 77   and name HN  ))
   (  segid "    " and resid 75   and name HG1%)
      3.600     1.600     1.600 peak   839 spectrum    1 weight  0.10000E+01 volume  0.70083E-03 ppm1      7.475 ppm2      0.690 CV     1
 ASSI {  840}
   (( segid "    " and resid 77   and name HN  ))
   (  segid "    " and resid 77   and name HG1%)
      2.700     0.900     0.900 peak   840 spectrum    1 weight  0.10000E+01 volume  0.22347E-02 ppm1      7.477 ppm2      0.757 CV     1
 ASSI {  841}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HB  ))
      4.000     2.000     2.000 peak   841 spectrum    1 weight  0.10000E+01 volume  0.50183E-03 ppm1      7.480 ppm2      2.367 CV     1
 ASSI {  842}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
      4.400     2.400     1.600 peak   842 spectrum    1 weight  0.10000E+01 volume  0.24834E-03 ppm1      7.473 ppm2      2.670 CV     1
 OR {  842}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HB1 ))
 ASSI {  844}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HA  ))
      3.200     1.200     1.200 peak   844 spectrum    1 weight  0.10000E+01 volume  0.59846E-03 ppm1      7.473 ppm2      4.482 CV     1
 ASSI {  845}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      2.400     0.700     0.700 peak   845 spectrum    1 weight  0.10000E+01 volume  0.24159E-02 ppm1      7.476 ppm2      4.707 CV     1
 ASSI {  846}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      2.900     1.000     1.000 peak   846 spectrum    1 weight  0.10000E+01 volume  0.78888E-03 ppm1      7.476 ppm2      5.131 CV     1
 ASSI {  848}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      4.400     2.400     1.600 peak   848 spectrum    1 weight  0.10000E+01 volume  0.31409E-03 ppm1      7.469 ppm2      8.321 CV     1
 ASSI {  850}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 29   and name HG2%)
      3.500     1.500     1.500 peak   850 spectrum    1 weight  0.10000E+01 volume  0.20720E-02 ppm1      7.466 ppm2      0.585 CV     1
 ASSI {  852}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 57   and name HB% )
      3.500     1.500     1.500 peak   852 spectrum    1 weight  0.10000E+01 volume  0.81321E-03 ppm1      7.460 ppm2      1.183 CV     1
 ASSI {  853}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 29   and name HG12))
      2.700     0.900     0.900 peak   853 spectrum    1 weight  0.10000E+01 volume  0.21536E-02 ppm1      7.467 ppm2      1.301 CV     1
 OR {  853}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 29   and name HG11))
 ASSI {  854}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 27   and name HB1 ))
      3.200     1.300     1.300 peak   854 spectrum    1 weight  0.10000E+01 volume  0.94463E-03 ppm1      7.468 ppm2      1.446 CV     1
 OR {  854}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 27   and name HB2 ))
 ASSI {  855}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 29   and name HB  ))
      2.300     0.700     0.700 peak   855 spectrum    1 weight  0.10000E+01 volume  0.42880E-02 ppm1      7.466 ppm2      1.558 CV     1
 ASSI {  857}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HA2 ))
      3.300     1.400     1.400 peak   857 spectrum    1 weight  0.10000E+01 volume  0.73229E-03 ppm1      7.475 ppm2      3.450 CV     1
 OR {  857}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HA1 ))
 ASSI {  858}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
      3.000     1.100     1.100 peak   858 spectrum    1 weight  0.10000E+01 volume  0.10858E-02 ppm1      7.468 ppm2      4.214 CV     1
 ASSI {  859}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 27   and name HA  ))
      4.600     2.700     1.400 peak   859 spectrum    1 weight  0.10000E+01 volume  0.23845E-03 ppm1      7.465 ppm2      4.108 CV     1
 ASSI {  862}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 30   and name HN  ))
      3.900     1.900     1.900 peak   862 spectrum    1 weight  0.10000E+01 volume  0.71788E-03 ppm1      7.457 ppm2      8.384 CV     1
 ASSI {  863}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 27   and name HN  ))
      4.400     2.400     1.600 peak   863 spectrum    1 weight  0.10000E+01 volume  0.31317E-03 ppm1      7.470 ppm2      8.784 CV     1
 ASSI {  864}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 59   and name HD1%)
      2.400     2.400     3.600 peak   864 spectrum    1 weight  0.10000E+01 volume  0.11628E-02 ppm1      7.442 ppm2      0.719 CV     1
 ASSI {  866}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 56   and name HB% )
      2.900     2.900     3.100 peak   866 spectrum    1 weight  0.10000E+01 volume  0.40528E-03 ppm1      7.440 ppm2      1.489 CV     1
 ASSI {  867}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HG  ))
      4.200     2.200     1.800 peak   867 spectrum    1 weight  0.10000E+01 volume  0.67429E-03 ppm1      7.437 ppm2      1.582 CV     1
 ASSI {  868}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HB1 ))
      3.000     1.200     1.200 peak   868 spectrum    1 weight  0.10000E+01 volume  0.12129E-02 ppm1      7.441 ppm2      1.669 CV     1
 OR {  868}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI {  869}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HB2 ))
      2.500     0.800     0.800 peak   869 spectrum    1 weight  0.10000E+01 volume  0.34931E-02 ppm1      7.440 ppm2      2.523 CV     1
 OR {  869}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HB1 ))
 ASSI {  871}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 61   and name HA1 ))
      4.900     3.000     1.100 peak   871 spectrum    1 weight  0.10000E+01 volume  0.31790E-03 ppm1      7.439 ppm2      3.721 CV     1
 OR {  871}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 61   and name HA2 ))
 ASSI {  872}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      2.800     1.000     1.000 peak   872 spectrum    1 weight  0.10000E+01 volume  0.22965E-02 ppm1      7.438 ppm2      3.946 CV     1
 ASSI {  873}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
      3.700     1.700     1.700 peak   873 spectrum    1 weight  0.10000E+01 volume  0.54629E-03 ppm1      7.440 ppm2      4.091 CV     1
 ASSI {  874}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      2.800     1.000     1.000 peak   874 spectrum    1 weight  0.10000E+01 volume  0.23936E-02 ppm1      7.440 ppm2      4.253 CV     1
 ASSI {  875}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      2.800     1.000     1.000 peak   875 spectrum    1 weight  0.10000E+01 volume  0.19726E-02 ppm1      7.441 ppm2      7.101 CV     1
 ASSI {  876}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      3.700     1.800     1.800 peak   876 spectrum    1 weight  0.10000E+01 volume  0.52565E-03 ppm1      7.434 ppm2      7.652 CV     1
 ASSI {  877}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      2.700     0.900     0.900 peak   877 spectrum    1 weight  0.10000E+01 volume  0.18504E-02 ppm1      7.439 ppm2      8.493 CV     1
 ASSI {  878}
   (( segid "    " and resid 91   and name HD21))
   (( segid "    " and resid 87   and name HB2 ))
      4.600     2.700     1.400 peak   878 spectrum    1 weight  0.10000E+01 volume  0.32938E-03 ppm1      7.436 ppm2      2.047 CV     1
 ASSI {  879}
   (( segid "    " and resid 91   and name HD21))
   (( segid "    " and resid 87   and name HG1 ))
      2.700     2.700     3.300 peak   879 spectrum    1 weight  0.10000E+01 volume  0.58619E-03 ppm1      7.437 ppm2      2.281 CV     1
 OR {  879}
   (( segid "    " and resid 91   and name HD21))
   (( segid "    " and resid 87   and name HG2 ))
 ASSI {  880}
   (( segid "    " and resid 91   and name HD21))
   (( segid "    " and resid 91   and name HB1 ))
      2.900     1.000     1.000 peak   880 spectrum    1 weight  0.10000E+01 volume  0.14163E-02 ppm1      7.437 ppm2      2.536 CV     1
 OR {  880}
   (( segid "    " and resid 91   and name HD21))
   (( segid "    " and resid 91   and name HB2 ))
 ASSI {  882}
   (( segid "    " and resid 91   and name HD21))
   (( segid "    " and resid 91   and name HD22))
      1.800     0.400     0.400 peak   882 spectrum    1 weight  0.10000E+01 volume  0.10672E-01 ppm1      7.437 ppm2      6.826 CV     1
 ASSI {  885}
   (( segid "    " and resid 82   and name HE21))
   (  segid "    " and resid 31   and name HD1%)
      3.700     1.700     1.700 peak   885 spectrum    1 weight  0.10000E+01 volume  0.58027E-03 ppm1      7.344 ppm2      0.664 CV     1
 ASSI {  886}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 31   and name HG12))
      3.100     1.200     1.200 peak   886 spectrum    1 weight  0.10000E+01 volume  0.60529E-03 ppm1      7.343 ppm2      1.017 CV     1
 OR {  886}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 31   and name HG11))
 ASSI {  888}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 82   and name HB1 ))
      3.400     1.500     1.500 peak   888 spectrum    1 weight  0.10000E+01 volume  0.87629E-03 ppm1      7.342 ppm2      2.001 CV     1
 OR {  888}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 82   and name HB2 ))
 ASSI {  889}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 82   and name HG2 ))
      2.400     0.700     0.700 peak   889 spectrum    1 weight  0.10000E+01 volume  0.33250E-02 ppm1      7.343 ppm2      2.160 CV     1
 OR {  889}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 82   and name HG1 ))
 ASSI {  890}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 32   and name HA  ))
      3.700     1.700     1.700 peak   890 spectrum    1 weight  0.10000E+01 volume  0.49469E-03 ppm1      7.342 ppm2      4.514 CV     1
 ASSI {  891}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 82   and name HE22))
      1.600     0.300     0.600 peak   891 spectrum    1 weight  0.10000E+01 volume  0.17062E-01 ppm1      7.343 ppm2      6.787 CV     1
 ASSI {  892}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 33   and name HN  ))
      4.600     2.600     1.400 peak   892 spectrum    1 weight  0.10000E+01 volume  0.22773E-03 ppm1      7.343 ppm2      8.451 CV     1
 ASSI {  893}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 18   and name HD2%)
      4.000     2.000     2.000 peak   893 spectrum    1 weight  0.10000E+01 volume  0.68689E-03 ppm1      7.105 ppm2      0.757 CV     1
 ASSI {  894}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 62   and name HG2 ))
      4.800     2.900     1.200 peak   894 spectrum    1 weight  0.10000E+01 volume  0.21122E-03 ppm1      7.105 ppm2      1.578 CV     1
 OR {  894}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 62   and name HG1 ))
 ASSI {  895}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HB1 ))
      2.900     1.100     1.100 peak   895 spectrum    1 weight  0.10000E+01 volume  0.17018E-02 ppm1      7.101 ppm2      2.521 CV     1
 OR {  895}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HB2 ))
 ASSI {  897}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HA1 ))
      2.400     0.700     0.700 peak   897 spectrum    1 weight  0.10000E+01 volume  0.51804E-02 ppm1      7.102 ppm2      3.731 CV     1
 OR {  897}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HA2 ))
 ASSI {  899}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      3.400     1.400     1.400 peak   899 spectrum    1 weight  0.10000E+01 volume  0.10501E-02 ppm1      7.104 ppm2      4.256 CV     1
 ASSI {  902}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      4.500     2.600     1.500 peak   902 spectrum    1 weight  0.10000E+01 volume  0.20511E-03 ppm1      7.105 ppm2      8.494 CV     1
 ASSI {  904}
   (( segid "    " and resid 94   and name HD22))
   (( segid "    " and resid 94   and name HB1 ))
      3.800     1.900     1.900 peak   904 spectrum    1 weight  0.10000E+01 volume  0.91025E-03 ppm1      7.091 ppm2      2.811 CV     1
 OR {  904}
   (( segid "    " and resid 94   and name HD22))
   (( segid "    " and resid 94   and name HB2 ))
 ASSI {  906}
   (( segid "    " and resid 94   and name HD22))
   (( segid "    " and resid 20   and name HN  ))
      4.400     2.400     1.600 peak   906 spectrum    1 weight  0.10000E+01 volume  0.43767E-03 ppm1      7.096 ppm2      8.674 CV     1
 ASSI {  907}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 86   and name HG1%)
      3.300     1.400     1.400 peak   907 spectrum    1 weight  0.10000E+01 volume  0.17160E-02 ppm1      6.999 ppm2      0.877 CV     1
 ASSI {  908}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 88   and name HG2%)
      3.900     2.000     2.000 peak   908 spectrum    1 weight  0.10000E+01 volume  0.91662E-03 ppm1      7.001 ppm2      0.952 CV     1
 ASSI {  909}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 86   and name HG2%)
      3.800     1.800     1.800 peak   909 spectrum    1 weight  0.10000E+01 volume  0.13847E-02 ppm1      6.999 ppm2      1.017 CV     1
 ASSI {  910}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 87   and name HB2 ))
      2.200     0.600     0.600 peak   910 spectrum    1 weight  0.10000E+01 volume  0.99626E-02 ppm1      6.999 ppm2      2.059 CV     1
 OR {  910}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 87   and name HB1 ))
 ASSI {  911}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 87   and name HG2 ))
      2.500     0.800     0.800 peak   911 spectrum    1 weight  0.10000E+01 volume  0.38350E-02 ppm1      6.999 ppm2      2.281 CV     1
 OR {  911}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 87   and name HG1 ))
 ASSI {  912}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      3.200     1.300     1.300 peak   912 spectrum    1 weight  0.10000E+01 volume  0.97940E-03 ppm1      6.999 ppm2      3.409 CV     1
 ASSI {  913}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      2.700     0.900     0.900 peak   913 spectrum    1 weight  0.10000E+01 volume  0.19557E-02 ppm1      6.998 ppm2      4.115 CV     1
 ASSI {  914}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      3.300     1.300     1.300 peak   914 spectrum    1 weight  0.10000E+01 volume  0.85896E-03 ppm1      7.000 ppm2      4.525 CV     1
 ASSI {  916}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 85   and name HN  ))
      3.900     1.900     1.900 peak   916 spectrum    1 weight  0.10000E+01 volume  0.36205E-03 ppm1      7.001 ppm2      7.893 CV     1
 ASSI {  917}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 90   and name HN  ))
      4.200     2.200     1.800 peak   917 spectrum    1 weight  0.10000E+01 volume  0.24544E-03 ppm1      7.002 ppm2      7.951 CV     1
 ASSI {  918}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      2.600     0.800     0.800 peak   918 spectrum    1 weight  0.10000E+01 volume  0.21940E-02 ppm1      6.998 ppm2      8.169 CV     1
 ASSI {  919}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 72   and name HG1%)
      3.700     3.700     2.300 peak   919 spectrum    1 weight  0.10000E+01 volume  0.53312E-03 ppm1      6.976 ppm2      0.563 CV     1
 ASSI {  920}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 96   and name HG1%)
      3.900     1.900     1.900 peak   920 spectrum    1 weight  0.10000E+01 volume  0.80232E-03 ppm1      6.976 ppm2      0.741 CV     1
 ASSI {  921}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 96   and name HG2%)
      4.100     4.100     1.900 peak   921 spectrum    1 weight  0.10000E+01 volume  0.64837E-03 ppm1      6.978 ppm2      0.863 CV     1
 ASSI {  922}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      2.100     0.500     0.500 peak   922 spectrum    1 weight  0.10000E+01 volume  0.90150E-02 ppm1      6.975 ppm2      1.411 CV     1
 ASSI {  923}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      2.600     2.600     3.400 peak   923 spectrum    1 weight  0.10000E+01 volume  0.75978E-03 ppm1      6.976 ppm2      1.844 CV     1
 OR {  923}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 90   and name HB1 ))
 ASSI {  924}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HB1 ))
      3.400     1.500     1.500 peak   924 spectrum    1 weight  0.10000E+01 volume  0.96458E-03 ppm1      6.974 ppm2      2.540 CV     1
 OR {  924}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
 ASSI {  927}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      3.000     1.100     1.100 peak   927 spectrum    1 weight  0.10000E+01 volume  0.11012E-02 ppm1      6.978 ppm2      3.785 CV     1
 ASSI {  928}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 90   and name HA  ))
      3.300     1.300     1.300 peak   928 spectrum    1 weight  0.10000E+01 volume  0.89405E-03 ppm1      6.976 ppm2      3.953 CV     1
 ASSI {  929}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      2.600     0.800     0.800 peak   929 spectrum    1 weight  0.10000E+01 volume  0.33989E-02 ppm1      6.976 ppm2      4.167 CV     1
 ASSI {  930}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      3.100     1.200     1.200 peak   930 spectrum    1 weight  0.10000E+01 volume  0.15000E-02 ppm1      6.974 ppm2      4.648 CV     1
 ASSI {  932}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HD21))
      3.100     3.100     2.900 peak   932 spectrum    1 weight  0.10000E+01 volume  0.26116E-03 ppm1      6.970 ppm2      7.437 CV     1
 ASSI {  934}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 93   and name HN  ))
      3.400     1.400     1.400 peak   934 spectrum    1 weight  0.10000E+01 volume  0.93602E-03 ppm1      6.974 ppm2      8.547 CV     1
 ASSI {  935}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 31   and name HD1%)
      4.500     2.600     1.500 peak   935 spectrum    1 weight  0.10000E+01 volume  0.31240E-03 ppm1      6.963 ppm2      0.668 CV     1
 ASSI {  936}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
      3.900     1.900     1.900 peak   936 spectrum    1 weight  0.10000E+01 volume  0.10910E-02 ppm1      6.966 ppm2      0.899 CV     1
 ASSI {  937}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 86   and name HG2%)
      4.300     2.300     1.700 peak   937 spectrum    1 weight  0.10000E+01 volume  0.38514E-03 ppm1      6.966 ppm2      1.020 CV     1
 ASSI {  938}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 81   and name HB% )
      2.700     0.900     0.900 peak   938 spectrum    1 weight  0.10000E+01 volume  0.25966E-02 ppm1      6.967 ppm2      1.410 CV     1
 ASSI {  939}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 80   and name HE% )
      4.200     2.200     1.800 peak   939 spectrum    1 weight  0.10000E+01 volume  0.71769E-03 ppm1      6.966 ppm2      1.895 CV     1
 ASSI {  941}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 86   and name HB  ))
      4.200     2.200     1.800 peak   941 spectrum    1 weight  0.10000E+01 volume  0.33359E-03 ppm1      6.967 ppm2      2.125 CV     1
 ASSI {  943}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 84   and name HB2 ))
      2.600     0.800     0.800 peak   943 spectrum    1 weight  0.10000E+01 volume  0.33801E-02 ppm1      6.967 ppm2      2.809 CV     1
 OR {  943}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 84   and name HB1 ))
 ASSI {  944}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      3.700     1.700     1.700 peak   944 spectrum    1 weight  0.10000E+01 volume  0.52822E-03 ppm1      6.970 ppm2      3.568 CV     1
 ASSI {  945}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 83   and name HB2 ))
      3.400     1.500     1.500 peak   945 spectrum    1 weight  0.10000E+01 volume  0.70644E-03 ppm1      6.964 ppm2      3.816 CV     1
 OR {  945}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 83   and name HB1 ))
 ASSI {  946}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      3.400     1.500     1.500 peak   946 spectrum    1 weight  0.10000E+01 volume  0.77438E-03 ppm1      6.966 ppm2      3.936 CV     1
 ASSI {  947}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      2.800     0.900     0.900 peak   947 spectrum    1 weight  0.10000E+01 volume  0.23943E-02 ppm1      6.967 ppm2      4.520 CV     1
 ASSI {  949}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      3.700     1.700     1.700 peak   949 spectrum    1 weight  0.10000E+01 volume  0.53526E-03 ppm1      6.964 ppm2      8.168 CV     1
 ASSI {  953}
   (( segid "    " and resid 66   and name HD22))
   (( segid "    " and resid 66   and name HB1 ))
      3.900     1.900     1.900 peak   953 spectrum    1 weight  0.10000E+01 volume  0.10272E-02 ppm1      6.926 ppm2      3.362 CV     1
 OR {  953}
   (( segid "    " and resid 66   and name HD22))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI {  954}
   (( segid "    " and resid 66   and name HD22))
   (( segid "    " and resid 66   and name HD21))
      1.800     0.400     0.400 peak   954 spectrum    1 weight  0.10000E+01 volume  0.12344E-01 ppm1      6.925 ppm2      7.534 CV     1
 ASSI {  955}
   (( segid "    " and resid 78   and name HE22))
   (  segid "    " and resid 70   and name HD2%)
      3.800     1.800     1.800 peak   955 spectrum    1 weight  0.10000E+01 volume  0.29899E-03 ppm1      6.894 ppm2      0.578 CV     1
 ASSI {  956}
   (( segid "    " and resid 78   and name HE22))
   (( segid "    " and resid 78   and name HB1 ))
      4.400     2.400     1.600 peak   956 spectrum    1 weight  0.10000E+01 volume  0.45959E-03 ppm1      6.890 ppm2      1.958 CV     1
 OR {  956}
   (( segid "    " and resid 78   and name HE22))
   (( segid "    " and resid 78   and name HB2 ))
 ASSI {  958}
   (( segid "    " and resid 78   and name HE22))
   (( segid "    " and resid 78   and name HG2 ))
      4.000     2.000     2.000 peak   958 spectrum    1 weight  0.10000E+01 volume  0.74461E-03 ppm1      6.888 ppm2      2.399 CV     1
 OR {  958}
   (( segid "    " and resid 78   and name HE22))
   (( segid "    " and resid 78   and name HG1 ))
 ASSI {  960}
   (( segid "    " and resid 78   and name HE22))
   (( segid "    " and resid 46   and name HN  ))
      3.800     1.800     1.800 peak   960 spectrum    1 weight  0.10000E+01 volume  0.28901E-03 ppm1      6.886 ppm2      8.340 CV     1
 ASSI {  961}
   (( segid "    " and resid 76   and name HD22))
   (( segid "    " and resid 76   and name HB2 ))
      4.100     2.100     1.900 peak   961 spectrum    1 weight  0.10000E+01 volume  0.80134E-03 ppm1      6.844 ppm2      2.681 CV     1
 ASSI {  962}
   (( segid "    " and resid 76   and name HD22))
   (( segid "    " and resid 76   and name HB2 ))
      4.100     2.100     1.900 peak   962 spectrum    1 weight  0.10000E+01 volume  0.79808E-03 ppm1      6.847 ppm2      2.937 CV     1
 OR {  962}
   (( segid "    " and resid 76   and name HD22))
   (( segid "    " and resid 76   and name HB1 ))
 ASSI {  963}
   (( segid "    " and resid 76   and name HD22))
   (( segid "    " and resid 76   and name HD21))
      1.800     0.400     0.400 peak   963 spectrum    1 weight  0.10000E+01 volume  0.11734E-01 ppm1      6.845 ppm2      7.521 CV     1
 ASSI {  964}
   (( segid "    " and resid 91   and name HD22))
   (( segid "    " and resid 87   and name HB1 ))
      3.700     1.700     1.700 peak   964 spectrum    1 weight  0.10000E+01 volume  0.32522E-03 ppm1      6.832 ppm2      2.055 CV     1
 OR {  964}
   (( segid "    " and resid 91   and name HD22))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI {  965}
   (( segid "    " and resid 91   and name HD22))
   (( segid "    " and resid 87   and name HG1 ))
      2.800     2.800     3.200 peak   965 spectrum    1 weight  0.10000E+01 volume  0.54565E-03 ppm1      6.821 ppm2      2.274 CV     1
 OR {  965}
   (( segid "    " and resid 91   and name HD22))
   (( segid "    " and resid 87   and name HG2 ))
 ASSI {  966}
   (( segid "    " and resid 91   and name HD22))
   (( segid "    " and resid 91   and name HB1 ))
      3.800     1.800     1.800 peak   966 spectrum    1 weight  0.10000E+01 volume  0.11615E-02 ppm1      6.826 ppm2      2.542 CV     1
 OR {  966}
   (( segid "    " and resid 91   and name HD22))
   (( segid "    " and resid 91   and name HB2 ))
 ASSI {  969}
   (( segid "    " and resid 91   and name HD22))
   (( segid "    " and resid 91   and name HN  ))
      4.300     2.300     1.700 peak   969 spectrum    1 weight  0.10000E+01 volume  0.45676E-03 ppm1      6.826 ppm2      7.653 CV     1
 ASSI {  970}
   (( segid "    " and resid 37   and name HE22))
   (( segid "    " and resid 37   and name HG2 ))
      4.000     2.000     2.000 peak   970 spectrum    1 weight  0.10000E+01 volume  0.82041E-03 ppm1      6.794 ppm2      2.245 CV     1
 OR {  970}
   (( segid "    " and resid 37   and name HE22))
   (( segid "    " and resid 37   and name HG1 ))
 ASSI {  971}
   (( segid "    " and resid 37   and name HE22))
   (( segid "    " and resid 37   and name HE21))
      1.700     0.300     0.500 peak   971 spectrum    1 weight  0.10000E+01 volume  0.19803E-01 ppm1      6.794 ppm2      7.490 CV     1
 ASSI {  972}
   (( segid "    " and resid 82   and name HE22))
   (  segid "    " and resid 46   and name HD1%)
      3.000     3.000     3.000 peak   972 spectrum    1 weight  0.10000E+01 volume  0.33114E-03 ppm1      6.790 ppm2      0.595 CV     1
 ASSI {  973}
   (( segid "    " and resid 82   and name HE22))
   (  segid "    " and resid 31   and name HD1%)
      3.000     3.000     3.000 peak   973 spectrum    1 weight  0.10000E+01 volume  0.30846E-03 ppm1      6.788 ppm2      0.667 CV     1
 ASSI {  974}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 31   and name HG11))
      4.200     2.200     1.800 peak   974 spectrum    1 weight  0.10000E+01 volume  0.42136E-03 ppm1      6.788 ppm2      1.014 CV     1
 ASSI {  975}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 82   and name HB1 ))
      4.400     2.400     1.600 peak   975 spectrum    1 weight  0.10000E+01 volume  0.35830E-03 ppm1      6.787 ppm2      2.007 CV     1
 OR {  975}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 82   and name HB2 ))
 ASSI {  976}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 82   and name HG2 ))
      3.600     1.600     1.600 peak   976 spectrum    1 weight  0.10000E+01 volume  0.15471E-02 ppm1      6.788 ppm2      2.159 CV     1
 OR {  976}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 82   and name HG1 ))
 ASSI {  977}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 32   and name HA  ))
      3.400     1.400     1.400 peak   977 spectrum    1 weight  0.10000E+01 volume  0.58997E-03 ppm1      6.787 ppm2      4.527 CV     1
 ASSI {  980}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      3.600     1.600     1.600 peak   980 spectrum    1 weight  0.10000E+01 volume  0.60519E-03 ppm1      8.162 ppm2      3.565 CV     1
 ASSI {  981}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
      4.200     2.200     1.800 peak   981 spectrum    1 weight  0.10000E+01 volume  0.29925E-03 ppm1      8.148 ppm2      4.361 CV     1
 ASSI {  982}
   (( segid "    " and resid 35   and name HE  ))
   (( segid "    " and resid 35   and name HD1 ))
      3.100     1.200     1.200 peak   982 spectrum    1 weight  0.10000E+01 volume  0.10075E-02 ppm1      7.219 ppm2      3.033 CV     1
 OR {  982}
   (( segid "    " and resid 35   and name HE  ))
   (( segid "    " and resid 35   and name HD2 ))
 ASSI {  983}
   (( segid "    " and resid 103  and name HE  ))
   (( segid "    " and resid 103  and name HD2 ))
      2.600     0.800     0.800 peak   983 spectrum    1 weight  0.10000E+01 volume  0.30063E-02 ppm1      7.183 ppm2      3.003 CV     1
 OR {  983}
   (( segid "    " and resid 103  and name HE  ))
   (( segid "    " and resid 103  and name HD1 ))
 ASSI {  985}
   (( segid "    " and resid 97   and name HE  ))
   (( segid "    " and resid 97   and name HG2 ))
      2.700     0.900     0.900 peak   985 spectrum    1 weight  0.10000E+01 volume  0.20965E-02 ppm1      7.176 ppm2      1.435 CV     1
 OR {  985}
   (( segid "    " and resid 97   and name HE  ))
   (( segid "    " and resid 97   and name HG1 ))
 ASSI {  986}
   (( segid "    " and resid 103  and name HE  ))
   (( segid "    " and resid 103  and name HB2 ))
      3.000     1.200     1.200 peak   986 spectrum    1 weight  0.10000E+01 volume  0.14237E-02 ppm1      7.179 ppm2      1.669 CV     1
 OR {  986}
   (( segid "    " and resid 103  and name HE  ))
   (( segid "    " and resid 103  and name HB1 ))
 ASSI {  987}
   (( segid "    " and resid 97   and name HE  ))
   (( segid "    " and resid 99   and name HB1 ))
      3.900     1.900     1.900 peak   987 spectrum    1 weight  0.10000E+01 volume  0.29445E-03 ppm1      7.180 ppm2      1.558 CV     1
 OR {  987}
   (( segid "    " and resid 97   and name HE  ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI {  988}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
      3.800     1.800     1.800 peak   988 spectrum    1 weight  0.10000E+01 volume  0.12443E-03 ppm1      9.974 ppm2      2.868 CV     1
 OR {  988}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI {  989}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      5.200     3.400     0.800 peak   989 spectrum    1 weight  0.10000E+01 volume  0.11497E-03 ppm1      9.972 ppm2      8.078 CV     1
 ASSI {  991}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      5.700     4.100     0.300 peak   991 spectrum    1 weight  0.10000E+01 volume  0.11933E-03 ppm1      9.198 ppm2      4.704 CV     1
 ASSI {  992}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 12   and name HB2 ))
      4.500     2.600     1.500 peak   992 spectrum    1 weight  0.10000E+01 volume  0.16643E-03 ppm1      9.060 ppm2      3.656 CV     1
 OR {  992}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 12   and name HB1 ))
 ASSI {  993}
   (( segid "    " and resid 12   and name HN  ))
   (  segid "    " and resid 101  and name HD1%)
      5.000     3.100     1.000 peak   993 spectrum    1 weight  0.10000E+01 volume  0.11998E-03 ppm1      9.040 ppm2      0.427 CV     1
 ASSI {  995}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 77   and name HG2%)
      4.600     2.700     1.400 peak   995 spectrum    1 weight  0.10000E+01 volume  0.18854E-03 ppm1      8.950 ppm2      0.407 CV     1
 ASSI {  996}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 68   and name HB1 ))
      4.200     2.200     1.800 peak   996 spectrum    1 weight  0.10000E+01 volume  0.47973E-03 ppm1      8.954 ppm2      1.458 CV     1
 OR {  996}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
 ASSI {  997}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 99   and name HB2 ))
      4.700     2.800     1.300 peak   997 spectrum    1 weight  0.10000E+01 volume  0.21250E-03 ppm1      8.954 ppm2      1.567 CV     1
 OR {  997}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 99   and name HB1 ))
 ASSI {  998}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 17   and name HB2 ))
      2.700     2.700     3.300 peak   998 spectrum    1 weight  0.10000E+01 volume  0.59463E-03 ppm1      8.906 ppm2      1.646 CV     1
 OR {  998}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 17   and name HB1 ))
 ASSI {  999}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
      4.200     2.200     1.800 peak   999 spectrum    1 weight  0.10000E+01 volume  0.26099E-03 ppm1      8.912 ppm2      4.345 CV     1
 ASSI { 1000}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 16   and name HN  ))
      4.900     3.000     1.100 peak  1000 spectrum    1 weight  0.10000E+01 volume  0.17692E-03 ppm1      8.875 ppm2      8.590 CV     1
 ASSI { 1001}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      4.800     2.900     1.200 peak  1001 spectrum    1 weight  0.10000E+01 volume  0.15638E-03 ppm1      8.890 ppm2      8.085 CV     1
 ASSI { 1002}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 69   and name HG11))
      4.400     2.500     1.600 peak  1002 spectrum    1 weight  0.10000E+01 volume  0.10578E-03 ppm1      8.874 ppm2      1.407 CV     1
 OR { 1002}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 69   and name HG12))
 ASSI { 1005}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 49   and name HD1 ))
      5.300     3.500     0.700 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.11689E-03 ppm1      8.826 ppm2      1.581 CV     1
 OR { 1005}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 49   and name HD2 ))
 ASSI { 1007}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
      5.900     4.400     0.100 peak  1007 spectrum    1 weight  0.10000E+01 volume  0.12841E-03 ppm1      8.824 ppm2      7.534 CV     1
 ASSI { 1008}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HB1 ))
      2.700     0.900     0.900 peak  1008 spectrum    1 weight  0.10000E+01 volume  0.22047E-02 ppm1      8.825 ppm2      1.661 CV     1
 OR { 1008}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HB2 ))
 ASSI { 1010}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HE  ))
      4.800     2.800     1.200 peak  1010 spectrum    1 weight  0.10000E+01 volume  0.17531E-03 ppm1      8.824 ppm2      8.541 CV     1
 ASSI { 1012}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 85   and name HN  ))
      4.800     2.900     1.200 peak  1012 spectrum    1 weight  0.10000E+01 volume  0.13242E-03 ppm1      8.792 ppm2      7.890 CV     1
 ASSI { 1013}
   (( segid "    " and resid 62   and name HE  ))
   (( segid "    " and resid 16   and name HB  ))
      3.200     3.200     2.800 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.22055E-03 ppm1      8.784 ppm2      1.845 CV     1
 ASSI { 1014}
   (( segid "    " and resid 62   and name HE  ))
   (( segid "    " and resid 62   and name HA  ))
      4.800     2.800     1.200 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.27583E-03 ppm1      8.787 ppm2      4.023 CV     1
 ASSI { 1015}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 67   and name HB1 ))
      4.800     2.900     1.200 peak  1015 spectrum    1 weight  0.10000E+01 volume  0.13133E-03 ppm1      8.736 ppm2      2.490 CV     1
 OR { 1015}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 ASSI { 1016}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      4.100     2.200     1.900 peak  1016 spectrum    1 weight  0.10000E+01 volume  0.29395E-03 ppm1      8.742 ppm2      3.855 CV     1
 ASSI { 1017}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
      4.500     2.500     1.500 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.34424E-03 ppm1      8.742 ppm2      8.955 CV     1
 ASSI { 1018}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 102  and name HN  ))
      4.900     3.000     1.100 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.16958E-03 ppm1      8.739 ppm2      9.051 CV     1
 ASSI { 1019}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 32   and name HB1 ))
      4.600     2.600     1.400 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.19095E-03 ppm1      8.727 ppm2      3.430 CV     1
 OR { 1019}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
 ASSI { 1021}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      5.500     3.800     0.500 peak  1021 spectrum    1 weight  0.10000E+01 volume  0.13186E-03 ppm1      8.712 ppm2      4.519 CV     1
 ASSI { 1022}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      5.300     3.500     0.700 peak  1022 spectrum    1 weight  0.10000E+01 volume  0.77164E-04 ppm1      8.717 ppm2      8.187 CV     1
 ASSI { 1023}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HD22))
      5.200     3.400     0.800 peak  1023 spectrum    1 weight  0.10000E+01 volume  0.11366E-03 ppm1      8.698 ppm2      6.848 CV     1
 ASSI { 1024}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
      4.700     2.800     1.300 peak  1024 spectrum    1 weight  0.10000E+01 volume  0.16767E-03 ppm1      8.647 ppm2      1.480 CV     1
 OR { 1024}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
 ASSI { 1026}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HD1 ))
      4.700     2.800     1.300 peak  1026 spectrum    1 weight  0.10000E+01 volume  0.28456E-03 ppm1      8.640 ppm2      3.063 CV     1
 OR { 1026}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HD2 ))
 ASSI { 1027}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
      4.700     2.700     1.300 peak  1027 spectrum    1 weight  0.10000E+01 volume  0.19745E-03 ppm1      8.647 ppm2      5.077 CV     1
 ASSI { 1029}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 101  and name HD1%)
      5.600     3.900     0.400 peak  1029 spectrum    1 weight  0.10000E+01 volume  0.18931E-03 ppm1      8.565 ppm2      0.434 CV     1
 ASSI { 1030}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 47   and name HB1 ))
      4.600     2.600     1.400 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.25277E-03 ppm1      8.551 ppm2      2.609 CV     1
 OR { 1030}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI { 1032}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
      4.700     2.700     1.300 peak  1032 spectrum    1 weight  0.10000E+01 volume  0.20362E-03 ppm1      8.488 ppm2      2.136 CV     1
 OR { 1032}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
 ASSI { 1033}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 52   and name HN  ))
      4.700     2.800     1.300 peak  1033 spectrum    1 weight  0.10000E+01 volume  0.23587E-03 ppm1      8.498 ppm2      8.852 CV     1
 ASSI { 1034}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 57   and name HB% )
      5.000     3.100     1.000 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.21118E-03 ppm1      8.495 ppm2      1.188 CV     1
 ASSI { 1035}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      5.000     3.200     1.000 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.24131E-03 ppm1      8.494 ppm2      4.264 CV     1
 ASSI { 1038}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
      5.200     3.400     0.800 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.11214E-03 ppm1      8.363 ppm2      8.961 CV     1
 ASSI { 1039}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
      5.700     4.100     0.300 peak  1039 spectrum    1 weight  0.10000E+01 volume  0.16460E-03 ppm1      8.330 ppm2      0.904 CV     1
 ASSI { 1040}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 77   and name HG2%)
      5.100     3.200     0.900 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.10782E-03 ppm1      8.338 ppm2      0.404 CV     1
 ASSI { 1041}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HA1 ))
      2.600     0.900     0.900 peak  1041 spectrum    1 weight  0.10000E+01 volume  0.35958E-02 ppm1      8.330 ppm2      3.771 CV     1
 OR { 1041}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HA2 ))
 ASSI { 1043}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 90   and name HE  ))
      4.700     2.800     1.300 peak  1043 spectrum    1 weight  0.10000E+01 volume  0.17352E-03 ppm1      8.202 ppm2      7.678 CV     1
 ASSI { 1044}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      3.200     1.300     1.300 peak  1044 spectrum    1 weight  0.10000E+01 volume  0.10704E-02 ppm1      8.165 ppm2      3.942 CV     1
 ASSI { 1046}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
      3.500     3.500     2.500 peak  1046 spectrum    1 weight  0.10000E+01 volume  0.12961E-03 ppm1      8.105 ppm2      7.439 CV     1
 ASSI { 1048}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 98   and name HD1%)
      4.700     2.800     1.300 peak  1048 spectrum    1 weight  0.10000E+01 volume  0.58962E-03 ppm1      8.084 ppm2      0.559 CV     1
 ASSI { 1049}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      3.600     1.600     1.600 peak  1049 spectrum    1 weight  0.10000E+01 volume  0.34593E-03 ppm1      8.083 ppm2      4.852 CV     1
 ASSI { 1050}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      4.000     2.000     2.000 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.22682E-03 ppm1      8.078 ppm2      4.231 CV     1
 ASSI { 1051}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HG12))
      4.800     2.900     1.200 peak  1051 spectrum    1 weight  0.10000E+01 volume  0.20748E-03 ppm1      8.003 ppm2      1.758 CV     1
 ASSI { 1052}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HG1 ))
      4.600     2.600     1.400 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.29055E-03 ppm1      8.001 ppm2      2.056 CV     1
 OR { 1052}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 64   and name HG2 ))
 ASSI { 1054}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      5.200     3.400     0.800 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.16297E-03 ppm1      8.007 ppm2      8.275 CV     1
 ASSI { 1055}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 23   and name HN  ))
      3.600     1.600     1.600 peak  1055 spectrum    1 weight  0.10000E+01 volume  0.10486E-03 ppm1      8.012 ppm2      8.627 CV     1
 ASSI { 1056}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 88   and name HG2%)
      3.300     3.300     2.700 peak  1056 spectrum    1 weight  0.10000E+01 volume  0.17062E-03 ppm1      7.963 ppm2      0.957 CV     1
 ASSI { 1057}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 91   and name HB1 ))
      5.500     3.700     0.500 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.17951E-03 ppm1      7.962 ppm2      2.555 CV     1
 OR { 1057}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
 ASSI { 1059}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      4.500     2.500     1.500 peak  1059 spectrum    1 weight  0.10000E+01 volume  0.16604E-03 ppm1      7.972 ppm2      3.562 CV     1
 ASSI { 1060}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 56   and name HN  ))
      4.200     2.200     1.800 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.23603E-03 ppm1      7.653 ppm2      9.115 CV     1
 ASSI { 1061}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      4.500     2.500     1.500 peak  1061 spectrum    1 weight  0.10000E+01 volume  0.28254E-03 ppm1      7.529 ppm2      0.677 CV     1
 ASSI { 1062}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 46   and name HD1%)
      4.100     2.100     1.900 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.25220E-03 ppm1      7.521 ppm2      0.594 CV     1
 ASSI { 1063}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 78   and name HB2 ))
      3.100     3.100     2.900 peak  1063 spectrum    1 weight  0.10000E+01 volume  0.25438E-03 ppm1      7.526 ppm2      2.095 CV     1
 OR { 1063}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 78   and name HB1 ))
 ASSI { 1064}
   (( segid "    " and resid 78   and name HE21))
   (( segid "    " and resid 78   and name HN  ))
      4.800     2.900     1.200 peak  1064 spectrum    1 weight  0.10000E+01 volume  0.13715E-03 ppm1      7.499 ppm2      8.079 CV     1
 ASSI { 1065}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 70   and name HB1 ))
      3.900     1.900     1.900 peak  1065 spectrum    1 weight  0.10000E+01 volume  0.27184E-03 ppm1      7.485 ppm2      1.252 CV     1
 ASSI { 1067}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 29   and name HD1%)
      3.500     1.500     1.500 peak  1067 spectrum    1 weight  0.10000E+01 volume  0.16624E-02 ppm1      7.466 ppm2      0.540 CV     1
 ASSI { 1068}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 57   and name HB% )
      4.900     3.100     1.100 peak  1068 spectrum    1 weight  0.10000E+01 volume  0.16963E-03 ppm1      7.439 ppm2      1.187 CV     1
 ASSI { 1069}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 32   and name HB2 ))
      3.400     3.400     2.600 peak  1069 spectrum    1 weight  0.10000E+01 volume  0.15130E-03 ppm1      7.342 ppm2      3.671 CV     1
 OR { 1069}
   (( segid "    " and resid 82   and name HE21))
   (( segid "    " and resid 32   and name HB1 ))
 ASSI { 1070}
   (( segid "    " and resid 97   and name HE  ))
   (( segid "    " and resid 17   and name HG1 ))
      2.900     2.900     3.100 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.40628E-03 ppm1      7.173 ppm2      1.772 CV     1
 OR { 1070}
   (( segid "    " and resid 97   and name HE  ))
   (( segid "    " and resid 17   and name HG2 ))
 ASSI { 1071}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      4.100     2.100     1.900 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.21426E-03 ppm1      7.102 ppm2      8.280 CV     1
 ASSI { 1072}
   (( segid "    " and resid 92   and name HN  ))
   (  segid "    " and resid 88   and name HG2%)
      3.600     3.600     2.400 peak  1072 spectrum    1 weight  0.10000E+01 volume  0.10721E-03 ppm1      6.973 ppm2      0.966 CV     1
 ASSI { 1073}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      4.700     2.700     1.300 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.36098E-03 ppm1      6.968 ppm2      3.399 CV     1
 ASSI { 1075}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 32   and name HB2 ))
      3.500     1.500     1.500 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.13234E-03 ppm1      6.786 ppm2      3.650 CV     1
 OR { 1075}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 32   and name HB1 ))
 ASSI { 1076}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 33   and name HA1 ))
      5.000     3.200     1.000 peak  1076 spectrum    1 weight  0.10000E+01 volume  0.13985E-03 ppm1      6.785 ppm2      3.718 CV     1
 OR { 1076}
   (( segid "    " and resid 82   and name HE22))
   (( segid "    " and resid 33   and name HA2 ))
 ASSI { 1077}
   (( segid "    " and resid 71   and name HE  ))
   (  segid "    " and resid 99   and name HD2%)
      4.400     2.400     1.600 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.29730E-03 ppm1      7.067 ppm2      0.658 CV     1
 ASSI { 1078}
   (( segid "    " and resid 71   and name HE  ))
   (( segid "    " and resid 71   and name HG2 ))
      4.200     2.200     1.800 peak  1078 spectrum    1 weight  0.10000E+01 volume  0.19641E-03 ppm1      7.072 ppm2      1.225 CV     1
 OR { 1078}
   (( segid "    " and resid 71   and name HE  ))
   (( segid "    " and resid 71   and name HG1 ))
 ASSI { 1079}
   (( segid "    " and resid 71   and name HE  ))
   (( segid "    " and resid 71   and name HD2 ))
      3.000     1.200     1.200 peak  1079 spectrum    1 weight  0.10000E+01 volume  0.10677E-02 ppm1      7.071 ppm2      2.921 CV     1
 OR { 1079}
   (( segid "    " and resid 71   and name HE  ))
   (( segid "    " and resid 71   and name HD1 ))
 ASSI { 1081}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      3.300     1.400     1.400 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.86576E-03 ppm1      8.611 ppm2      1.493 CV     1
 OR { 1081}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI { 1082}
   (( segid "    " and resid 20   and name HE  ))
   (( segid "    " and resid 20   and name HA  ))
      4.600     2.700     1.400 peak  1082 spectrum    1 weight  0.10000E+01 volume  0.25750E-03 ppm1      7.156 ppm2      4.264 CV     1
 ASSI { 1083}
   (( segid "    " and resid 20   and name HE  ))
   (( segid "    " and resid 20   and name HB1 ))
      3.100     1.200     1.200 peak  1083 spectrum    1 weight  0.10000E+01 volume  0.84769E-03 ppm1      7.161 ppm2      1.624 CV     1
 OR { 1083}
   (( segid "    " and resid 20   and name HE  ))
   (( segid "    " and resid 20   and name HB2 ))
 ASSI { 1084}
   (( segid "    " and resid 20   and name HE  ))
   (( segid "    " and resid 20   and name HG2 ))
      2.700     0.900     0.900 peak  1084 spectrum    1 weight  0.10000E+01 volume  0.28565E-02 ppm1      7.164 ppm2      1.398 CV     1
 OR { 1084}
   (( segid "    " and resid 20   and name HE  ))
   (( segid "    " and resid 20   and name HG1 ))
 ASSI { 1085}
   (( segid "    " and resid 20   and name HE  ))
   (( segid "    " and resid 20   and name HD1 ))
      2.700     0.900     0.900 peak  1085 spectrum    1 weight  0.10000E+01 volume  0.19725E-02 ppm1      7.161 ppm2      2.868 CV     1
 OR { 1085}
   (( segid "    " and resid 20   and name HE  ))
   (( segid "    " and resid 20   and name HD2 ))
 ASSI { 1086}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HB2 ))
      2.800     1.000     1.000 peak  1086 spectrum    1 weight  0.10000E+01 volume  0.25855E-02 ppm1      8.392 ppm2      1.530 CV     1
 OR { 1086}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HB1 ))
 ASSI { 1088}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
      2.400     0.700     0.700 peak  1088 spectrum    1 weight  0.10000E+01 volume  0.47505E-02 ppm1      8.190 ppm2      4.399 CV     1
 ASSI { 1089}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      2.800     1.000     1.000 peak  1089 spectrum    1 weight  0.10000E+01 volume  0.20102E-02 ppm1      8.189 ppm2      4.344 CV     1
 ASSI { 1091}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      2.700     0.900     0.900 peak  1091 spectrum    1 weight  0.10000E+01 volume  0.26623E-02 ppm1      8.050 ppm2      4.277 CV     1
 ASSI { 1092}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      2.300     0.600     0.600 peak  1092 spectrum    1 weight  0.10000E+01 volume  0.54251E-02 ppm1      8.051 ppm2      8.212 CV     1
 ASSI { 1094}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 51   and name HB1 ))
      3.300     1.400     1.400 peak  1094 spectrum    1 weight  0.10000E+01 volume  0.10940E-02 ppm1      7.656 ppm2      1.594 CV     1
 OR { 1094}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 51   and name HB2 ))
 ASSI { 1095}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
      4.800     2.800     1.200 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.27229E-03 ppm1      9.704 ppm2      0.658 CV     1
 ASSI { 1096}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 6    and name HB1 ))
      2.900     1.000     1.000 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.21293E-02 ppm1      8.241 ppm2      3.759 CV     1
 OR { 1096}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 6    and name HB2 ))
 ASSI { 1097}
   (( segid "    " and resid 20   and name HE  ))
   (  segid "    " and resid 27   and name HD2%)
      4.000     2.000     2.000 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.46107E-03 ppm1      7.163 ppm2      0.727 CV     1
 ASSI { 1098}
   (( segid "    " and resid 20   and name HE  ))
   (  segid "    " and resid 96   and name HG2%)
      4.500     2.600     1.500 peak  1098 spectrum    1 weight  0.10000E+01 volume  0.26485E-03 ppm1      7.159 ppm2      0.865 CV     1
 ASSI { 1099}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 88   and name HG1%)
      3.800     1.800     1.800 peak  1099 spectrum    1 weight  0.10000E+01 volume  0.58610E-03 ppm1      8.615 ppm2      0.737 CV     1
 ASSI { 1100}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      3.600     1.600     1.600 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.44923E-03 ppm1      8.618 ppm2      3.826 CV     1
 ASSI { 1101}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
      2.500     0.800     0.800 peak  1101 spectrum    1 weight  0.10000E+01 volume  0.36778E-02 ppm1      8.391 ppm2      4.484 CV     1
 ASSI { 1102}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 44   and name HG2%)
      4.100     2.100     1.900 peak  1102 spectrum    1 weight  0.10000E+01 volume  0.40961E-03 ppm1      8.404 ppm2      1.115 CV     1
 ASSI { 1103}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 46   and name HD1%)
      3.900     1.900     1.900 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.37501E-03 ppm1      8.395 ppm2      0.597 CV     1
 ASSI { 1104}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      2.800     1.000     1.000 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.40486E-02 ppm1      8.350 ppm2      2.583 CV     1
 OR { 1104}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
 ASSI { 1106}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 39   and name HG2%)
      4.200     2.200     1.800 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.33105E-03 ppm1      8.310 ppm2      1.119 CV     1
 ASSI { 1107}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 57   and name HB% )
      3.600     1.600     1.600 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.15218E-02 ppm1      8.287 ppm2      1.176 CV     1
 ASSI { 1108}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 44   and name HG2%)
      2.800     2.800     3.200 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.51780E-03 ppm1      8.287 ppm2      1.122 CV     1
 ASSI { 1109}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HB2 ))
      3.300     1.400     1.400 peak  1109 spectrum    1 weight  0.10000E+01 volume  0.16753E-02 ppm1      8.284 ppm2      1.530 CV     1
 OR { 1109}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HB1 ))
 ASSI { 1111}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
      2.400     0.700     0.700 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.61611E-02 ppm1      8.283 ppm2      2.581 CV     1
 OR { 1111}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
 ASSI { 1112}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 39   and name HG2%)
      2.900     1.100     1.100 peak  1112 spectrum    1 weight  0.10000E+01 volume  0.18840E-02 ppm1      8.189 ppm2      1.121 CV     1
 ASSI { 1113}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 40   and name HG2%)
      2.800     2.800     3.200 peak  1113 spectrum    1 weight  0.10000E+01 volume  0.53288E-03 ppm1      8.098 ppm2      1.108 CV     1
 ASSI { 1114}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
      4.900     3.000     1.100 peak  1114 spectrum    1 weight  0.10000E+01 volume  0.14814E-03 ppm1      9.706 ppm2      8.913 CV     1
 ASSI { 1116}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 24   and name HG2%)
      5.700     4.100     0.300 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.16475E-03 ppm1      8.613 ppm2      1.132 CV     1
 ASSI { 1117}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      4.100     2.100     1.900 peak  1117 spectrum    1 weight  0.10000E+01 volume  0.55602E-03 ppm1      7.835 ppm2      4.258 CV     1
 ASSI { 1118}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      4.400     2.500     1.600 peak  1118 spectrum    1 weight  0.10000E+01 volume  0.10684E-03 ppm1      7.836 ppm2      3.989 CV     1
 ASSI { 1119}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HB2 ))
      4.900     3.000     1.100 peak  1119 spectrum    1 weight  0.10000E+01 volume  0.70896E-04 ppm1      7.833 ppm2      1.743 CV     1
 ASSI { 1120}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      4.700     2.700     1.300 peak  1120 spectrum    1 weight  0.10000E+01 volume  0.12783E-03 ppm1      7.833 ppm2      1.490 CV     1
 OR { 1120}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI {    1}
   (  segid "    " and resid 46   and name HD1%)
   (( segid "    " and resid 81   and name HA  ))
      4.000     2.000     2.000 peak     1 spectrum    2 weight  0.10000E+01 volume  0.28356E-03 ppm1      0.599 ppm2      4.254 CV     1
 ASSI {    2}
   (  segid "    " and resid 46   and name HD1%)
   (( segid "    " and resid 45   and name HA2 ))
      4.400     2.500     1.600 peak     2 spectrum    2 weight  0.10000E+01 volume  0.26516E-03 ppm1      0.606 ppm2      4.023 CV     1
 ASSI {    4}
   (  segid "    " and resid 46   and name HD1%)
   (( segid "    " and resid 82   and name HA  ))
      2.500     0.800     0.800 peak     4 spectrum    2 weight  0.10000E+01 volume  0.30006E-02 ppm1      0.604 ppm2      3.576 CV     1
 ASSI {    5}
   (  segid "    " and resid 46   and name HD1%)
   (( segid "    " and resid 82   and name HG2 ))
      3.100     3.100     2.900 peak     5 spectrum    2 weight  0.10000E+01 volume  0.19810E-02 ppm1      0.605 ppm2      2.158 CV     1
 OR {    5}
   (  segid "    " and resid 46   and name HD1%)
   (( segid "    " and resid 82   and name HG1 ))
 ASSI {    6}
   (  segid "    " and resid 46   and name HD1%)
   (( segid "    " and resid 46   and name HB  ))
      2.800     1.000     1.000 peak     6 spectrum    2 weight  0.10000E+01 volume  0.63953E-02 ppm1      0.604 ppm2      1.990 CV     1
 ASSI {    7}
   (  segid "    " and resid 46   and name HD1%)
   (( segid "    " and resid 46   and name HG12))
      2.500     0.800     0.800 peak     7 spectrum    2 weight  0.10000E+01 volume  0.33178E-02 ppm1      0.606 ppm2      1.549 CV     1
 OR {    7}
   (  segid "    " and resid 46   and name HD1%)
   (( segid "    " and resid 46   and name HG11))
 ASSI {    9}
   (  segid "    " and resid 46   and name HD1%)
   (  segid "    " and resid 85   and name HG2%)
      2.700     0.900     0.900 peak     9 spectrum    2 weight  0.10000E+01 volume  0.32815E-02 ppm1      0.603 ppm2      0.907 CV     1
 ASSI {   10}
   (  segid "    " and resid 46   and name HD1%)
   (( segid "    " and resid 45   and name HA1 ))
      4.600     2.600     1.400 peak    10 spectrum    2 weight  0.10000E+01 volume  0.26958E-03 ppm1      0.604 ppm2      3.760 CV     1
 OR {   10}
   (  segid "    " and resid 46   and name HD1%)
   (( segid "    " and resid 45   and name HA2 ))
 ASSI {   11}
   (  segid "    " and resid 46   and name HD1%)
   (  segid "    " and resid 77   and name HG2%)
      3.900     3.900     2.100 peak    11 spectrum    2 weight  0.10000E+01 volume  0.99112E-03 ppm1      0.613 ppm2      0.417 CV     1
 ASSI {   12}
   (  segid "    " and resid 52   and name HD1%)
   (( segid "    " and resid 26   and name HB1 ))
      3.200     3.200     2.800 peak    12 spectrum    2 weight  0.10000E+01 volume  0.21650E-03 ppm1      0.671 ppm2      3.877 CV     1
 OR {   12}
   (  segid "    " and resid 52   and name HD1%)
   (( segid "    " and resid 26   and name HB2 ))
 ASSI {   14}
   (  segid "    " and resid 52   and name HD1%)
   (( segid "    " and resid 30   and name HB2 ))
      3.000     3.000     3.000 peak    14 spectrum    2 weight  0.10000E+01 volume  0.81085E-03 ppm1      0.671 ppm2      3.767 CV     1
 ASSI {   16}
   (  segid "    " and resid 52   and name HD1%)
   (( segid "    " and resid 53   and name HD2 ))
      4.300     2.300     1.700 peak    16 spectrum    2 weight  0.10000E+01 volume  0.64421E-03 ppm1      0.674 ppm2      3.565 CV     1
 OR {   16}
   (  segid "    " and resid 52   and name HD1%)
   (( segid "    " and resid 53   and name HD1 ))
 ASSI {   17}
   (  segid "    " and resid 52   and name HD1%)
   (( segid "    " and resid 52   and name HB  ))
      2.800     1.000     1.000 peak    17 spectrum    2 weight  0.10000E+01 volume  0.37975E-02 ppm1      0.674 ppm2      1.602 CV     1
 ASSI {   18}
   (  segid "    " and resid 52   and name HD1%)
   (( segid "    " and resid 52   and name HG12))
      2.200     0.600     0.600 peak    18 spectrum    2 weight  0.10000E+01 volume  0.66473E-02 ppm1      0.674 ppm2      1.397 CV     1
 OR {   18}
   (  segid "    " and resid 52   and name HD1%)
   (( segid "    " and resid 52   and name HG11))
 ASSI {   20}
   (  segid "    " and resid 52   and name HD1%)
   (  segid "    " and resid 52   and name HG2%)
      2.100     0.600     0.600 peak    20 spectrum    2 weight  0.10000E+01 volume  0.10832E-01 ppm1      0.673 ppm2      0.883 CV     1
 ASSI {   21}
   (  segid "    " and resid 52   and name HD1%)
   (( segid "    " and resid 28   and name HA2 ))
      3.500     1.500     1.500 peak    21 spectrum    2 weight  0.10000E+01 volume  0.13708E-02 ppm1      0.679 ppm2      3.438 CV     1
 OR {   21}
   (  segid "    " and resid 52   and name HD1%)
   (( segid "    " and resid 28   and name HA1 ))
 ASSI {   23}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 69   and name HG11))
      2.000     0.500     0.500 peak    23 spectrum    2 weight  0.10000E+01 volume  0.77935E-02 ppm1      0.482 ppm2      1.434 CV     1
 OR {   23}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 69   and name HG12))
 ASSI {   24}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 69   and name HB  ))
      2.600     2.600     3.400 peak    24 spectrum    2 weight  0.10000E+01 volume  0.88697E-02 ppm1      0.482 ppm2      1.318 CV     1
 ASSI {   27}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 101  and name HA  ))
      3.600     1.600     1.600 peak    27 spectrum    2 weight  0.10000E+01 volume  0.21082E-02 ppm1      0.432 ppm2      5.217 CV     1
 ASSI {   28}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 11   and name HB1 ))
      2.900     1.100     1.100 peak    28 spectrum    2 weight  0.10000E+01 volume  0.13692E-02 ppm1      0.430 ppm2      2.877 CV     1
 OR {   28}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 11   and name HB2 ))
 ASSI {   30}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 101  and name HG11))
      2.200     0.600     0.600 peak    30 spectrum    2 weight  0.10000E+01 volume  0.65960E-02 ppm1      0.432 ppm2      0.846 CV     1
 OR {   30}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 101  and name HG12))
 ASSI {   31}
   (  segid "    " and resid 29   and name HD1%)
   (( segid "    " and resid 29   and name HA  ))
      3.700     1.700     1.700 peak    31 spectrum    2 weight  0.10000E+01 volume  0.12115E-02 ppm1      0.539 ppm2      4.220 CV     1
 ASSI {   33}
   (  segid "    " and resid 29   and name HD1%)
   (  segid "    " and resid 57   and name HB% )
      2.700     2.700     3.300 peak    33 spectrum    2 weight  0.10000E+01 volume  0.35409E-02 ppm1      0.541 ppm2      1.198 CV     1
 ASSI {   34}
   (  segid "    " and resid 29   and name HD1%)
   (( segid "    " and resid 29   and name HG11))
      2.200     0.600     0.600 peak    34 spectrum    2 weight  0.10000E+01 volume  0.60222E-02 ppm1      0.537 ppm2      1.309 CV     1
 OR {   34}
   (  segid "    " and resid 29   and name HD1%)
   (( segid "    " and resid 29   and name HG12))
 ASSI {   35}
   (  segid "    " and resid 29   and name HD1%)
   (( segid "    " and resid 29   and name HB  ))
      2.400     0.700     0.700 peak    35 spectrum    2 weight  0.10000E+01 volume  0.51205E-02 ppm1      0.540 ppm2      1.564 CV     1
 ASSI {   36}
   (  segid "    " and resid 29   and name HD1%)
   (( segid "    " and resid 27   and name HB1 ))
      2.500     0.800     0.800 peak    36 spectrum    2 weight  0.10000E+01 volume  0.39373E-02 ppm1      0.547 ppm2      1.455 CV     1
 OR {   36}
   (  segid "    " and resid 29   and name HD1%)
   (( segid "    " and resid 27   and name HB2 ))
 ASSI {   37}
   (  segid "    " and resid 29   and name HD1%)
   (  segid "    " and resid 27   and name HD1%)
      2.600     0.900     0.900 peak    37 spectrum    2 weight  0.10000E+01 volume  0.32334E-02 ppm1      0.541 ppm2      0.812 CV     1
 ASSI {   38}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 48   and name HA  ))
      5.100     3.200     0.900 peak    38 spectrum    2 weight  0.10000E+01 volume  0.47422E-03 ppm1      0.663 ppm2      3.677 CV     1
 ASSI {   40}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 86   and name HA  ))
      3.300     3.300     2.700 peak    40 spectrum    2 weight  0.10000E+01 volume  0.10897E-02 ppm1      0.669 ppm2      3.416 CV     1
 ASSI {   42}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 82   and name HG2 ))
      2.500     2.500     3.500 peak    42 spectrum    2 weight  0.10000E+01 volume  0.26803E-02 ppm1      0.667 ppm2      2.158 CV     1
 OR {   42}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 82   and name HG1 ))
 ASSI {   43}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 85   and name HB  ))
      2.300     0.700     0.700 peak    43 spectrum    2 weight  0.10000E+01 volume  0.40105E-02 ppm1      0.669 ppm2      1.983 CV     1
 ASSI {   44}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 31   and name HB  ))
      2.300     0.700     0.700 peak    44 spectrum    2 weight  0.10000E+01 volume  0.46031E-02 ppm1      0.681 ppm2      1.761 CV     1
 ASSI {   45}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 31   and name HG11))
      1.900     0.500     0.500 peak    45 spectrum    2 weight  0.10000E+01 volume  0.10956E-01 ppm1      0.680 ppm2      1.204 CV     1
 OR {   45}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 31   and name HG12))
 ASSI {   48}
   (  segid "    " and resid 63   and name HD1%)
   (( segid "    " and resid 63   and name HB  ))
      2.500     2.500     3.500 peak    48 spectrum    2 weight  0.10000E+01 volume  0.42471E-02 ppm1      0.725 ppm2      1.401 CV     1
 ASSI {   49}
   (  segid "    " and resid 63   and name HD1%)
   (( segid "    " and resid 57   and name HA  ))
      3.300     1.300     1.300 peak    49 spectrum    2 weight  0.10000E+01 volume  0.58588E-03 ppm1      0.721 ppm2      3.962 CV     1
 ASSI {   50}
   (  segid "    " and resid 63   and name HD1%)
   (( segid "    " and resid 63   and name HA  ))
      3.600     1.600     1.600 peak    50 spectrum    2 weight  0.10000E+01 volume  0.10935E-02 ppm1      0.725 ppm2      4.269 CV     1
 ASSI {   55}
   (  segid "    " and resid 52   and name HG2%)
   (( segid "    " and resid 52   and name HB  ))
      2.200     0.600     0.600 peak    55 spectrum    2 weight  0.10000E+01 volume  0.49671E-02 ppm1      0.882 ppm2      1.600 CV     1
 ASSI {   57}
   (  segid "    " and resid 52   and name HG2%)
   (( segid "    " and resid 52   and name HG11))
      2.700     0.900     0.900 peak    57 spectrum    2 weight  0.10000E+01 volume  0.44547E-02 ppm1      0.883 ppm2      1.125 CV     1
 OR {   57}
   (  segid "    " and resid 52   and name HG2%)
   (( segid "    " and resid 52   and name HG12))
 ASSI {   59}
   (  segid "    " and resid 52   and name HG2%)
   (( segid "    " and resid 53   and name HB1 ))
      4.100     4.100     1.900 peak    59 spectrum    2 weight  0.10000E+01 volume  0.49809E-03 ppm1      0.872 ppm2      1.783 CV     1
 OR {   59}
   (  segid "    " and resid 52   and name HG2%)
   (( segid "    " and resid 53   and name HB2 ))
 ASSI {   60}
   (  segid "    " and resid 52   and name HG2%)
   (( segid "    " and resid 26   and name HB2 ))
      2.300     2.300     3.700 peak    60 spectrum    2 weight  0.10000E+01 volume  0.17458E-02 ppm1      0.883 ppm2      3.700 CV     1
 OR {   60}
   (  segid "    " and resid 52   and name HG2%)
   (( segid "    " and resid 26   and name HB1 ))
 ASSI {   63}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 80   and name HA  ))
      4.000     2.000     2.000 peak    63 spectrum    2 weight  0.10000E+01 volume  0.16868E-02 ppm1      1.888 ppm2      4.194 CV     1
 ASSI {   65}
   (  segid "    " and resid 80   and name HE% )
   (  segid "    " and resid 88   and name HG2%)
      2.200     0.600     0.600 peak    65 spectrum    2 weight  0.10000E+01 volume  0.71695E-02 ppm1      1.893 ppm2      0.959 CV     1
 ASSI {   66}
   (  segid "    " and resid 80   and name HE% )
   (  segid "    " and resid 75   and name HG1%)
      2.100     0.600     0.600 peak    66 spectrum    2 weight  0.10000E+01 volume  0.94278E-02 ppm1      1.893 ppm2      0.680 CV     1
 ASSI {   67}
   (  segid "    " and resid 80   and name HE% )
   (  segid "    " and resid 77   and name HG2%)
      4.600     2.600     1.400 peak    67 spectrum    2 weight  0.10000E+01 volume  0.64992E-03 ppm1      1.898 ppm2      0.416 CV     1
 ASSI {   68}
   (  segid "    " and resid 80   and name HE% )
   (  segid "    " and resid 75   and name HG2%)
      3.500     1.500     1.500 peak    68 spectrum    2 weight  0.10000E+01 volume  0.22528E-02 ppm1      1.892 ppm2      0.850 CV     1
 ASSI {   69}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 34   and name HG1 ))
      2.700     0.900     0.900 peak    69 spectrum    2 weight  0.10000E+01 volume  0.32874E-02 ppm1      1.855 ppm2      2.342 CV     1
 OR {   69}
   (  segid "    " and resid 34   and name HE% )
   (( segid "    " and resid 34   and name HG2 ))
 ASSI {   70}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 84   and name HB1 ))
      3.100     1.200     1.200 peak    70 spectrum    2 weight  0.10000E+01 volume  0.19729E-02 ppm1      1.892 ppm2      2.809 CV     1
 OR {   70}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 84   and name HB2 ))
 ASSI {   71}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 78   and name HG2 ))
      2.600     2.600     3.400 peak    71 spectrum    2 weight  0.10000E+01 volume  0.73307E-03 ppm1      1.896 ppm2      2.220 CV     1
 OR {   71}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 78   and name HG1 ))
 ASSI {   73}
   (  segid "    " and resid 80   and name HE% )
   (  segid "    " and resid 85   and name HG2%)
      2.600     0.800     0.800 peak    73 spectrum    2 weight  0.10000E+01 volume  0.32268E-02 ppm1      1.894 ppm2      0.908 CV     1
 ASSI {   74}
   (  segid "    " and resid 80   and name HE% )
   (  segid "    " and resid 77   and name HG1%)
      2.200     0.600     0.600 peak    74 spectrum    2 weight  0.10000E+01 volume  0.60947E-02 ppm1      1.894 ppm2      0.759 CV     1
 ASSI {   77}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 102  and name HD1 ))
      3.700     1.700     1.700 peak    77 spectrum    2 weight  0.10000E+01 volume  0.78657E-03 ppm1      0.768 ppm2      2.878 CV     1
 OR {   77}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 102  and name HD2 ))
 ASSI {   78}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 11   and name HB1 ))
      4.900     3.000     1.100 peak    78 spectrum    2 weight  0.10000E+01 volume  0.75699E-03 ppm1      0.767 ppm2      2.798 CV     1
 OR {   78}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 11   and name HB2 ))
 ASSI {   79}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 101  and name HB  ))
      2.100     0.600     0.600 peak    79 spectrum    2 weight  0.10000E+01 volume  0.60862E-02 ppm1      0.769 ppm2      1.477 CV     1
 ASSI {   80}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 68   and name HE2 ))
      3.300     1.400     1.400 peak    80 spectrum    2 weight  0.10000E+01 volume  0.10898E-02 ppm1      0.765 ppm2      2.645 CV     1
 ASSI {   81}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 101  and name HA  ))
      3.000     1.100     1.100 peak    81 spectrum    2 weight  0.10000E+01 volume  0.23798E-02 ppm1      0.768 ppm2      5.232 CV     1
 ASSI {   82}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 101  and name HG11))
      2.300     0.700     0.700 peak    82 spectrum    2 weight  0.10000E+01 volume  0.63282E-02 ppm1      0.765 ppm2      1.391 CV     1
 OR {   82}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 101  and name HG12))
 ASSI {   83}
   (  segid "    " and resid 101  and name HG2%)
   (  segid "    " and resid 70   and name HD2%)
      2.400     0.700     0.700 peak    83 spectrum    2 weight  0.10000E+01 volume  0.44359E-02 ppm1      0.768 ppm2      0.565 CV     1
 ASSI {   85}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 68   and name HB1 ))
      2.400     0.700     0.700 peak    85 spectrum    2 weight  0.10000E+01 volume  0.31609E-02 ppm1      0.768 ppm2      1.694 CV     1
 OR {   85}
   (  segid "    " and resid 101  and name HG2%)
   (( segid "    " and resid 68   and name HB2 ))
 ASSI {   86}
   (  segid "    " and resid 101  and name HG2%)
   (  segid "    " and resid 101  and name HD1%)
      2.200     0.600     0.600 peak    86 spectrum    2 weight  0.10000E+01 volume  0.65991E-02 ppm1      0.768 ppm2      0.428 CV     1
 ASSI {   90}
   (  segid "    " and resid 69   and name HG2%)
   (( segid "    " and resid 100  and name HA  ))
      4.700     2.800     1.300 peak    90 spectrum    2 weight  0.10000E+01 volume  0.29400E-03 ppm1      0.519 ppm2      5.333 CV     1
 ASSI {   91}
   (  segid "    " and resid 56   and name HB% )
   (  segid "    " and resid 27   and name HD1%)
      3.900     1.900     1.900 peak    91 spectrum    2 weight  0.10000E+01 volume  0.82410E-03 ppm1      1.511 ppm2      0.812 CV     1
 ASSI {   92}
   (  segid "    " and resid 56   and name HB% )
   (  segid "    " and resid 63   and name HD1%)
      4.100     2.100     1.900 peak    92 spectrum    2 weight  0.10000E+01 volume  0.10140E-02 ppm1      1.511 ppm2      0.723 CV     1
 ASSI {   93}
   (  segid "    " and resid 31   and name HG2%)
   (( segid "    " and resid 31   and name HA  ))
      2.300     0.700     0.700 peak    93 spectrum    2 weight  0.10000E+01 volume  0.44271E-02 ppm1      0.588 ppm2      5.201 CV     1
 ASSI {   94}
   (  segid "    " and resid 29   and name HG2%)
   (( segid "    " and resid 29   and name HA  ))
      2.400     0.700     0.700 peak    94 spectrum    2 weight  0.10000E+01 volume  0.34332E-02 ppm1      0.601 ppm2      4.217 CV     1
 ASSI {   96}
   (  segid "    " and resid 31   and name HG2%)
   (( segid "    " and resid 48   and name HA  ))
      2.400     0.700     0.700 peak    96 spectrum    2 weight  0.10000E+01 volume  0.37625E-02 ppm1      0.590 ppm2      3.678 CV     1
 ASSI {   97}
   (  segid "    " and resid 31   and name HG2%)
   (( segid "    " and resid 82   and name HG2 ))
      4.400     2.400     1.600 peak    97 spectrum    2 weight  0.10000E+01 volume  0.10183E-02 ppm1      0.585 ppm2      2.158 CV     1
 OR {   97}
   (  segid "    " and resid 31   and name HG2%)
   (( segid "    " and resid 82   and name HG1 ))
 ASSI {   99}
   (  segid "    " and resid 31   and name HG2%)
   (( segid "    " and resid 31   and name HB  ))
      2.200     0.600     0.600 peak    99 spectrum    2 weight  0.10000E+01 volume  0.48411E-02 ppm1      0.587 ppm2      1.759 CV     1
 ASSI {  100}
   (  segid "    " and resid 29   and name HG2%)
   (( segid "    " and resid 29   and name HB  ))
      2.000     0.500     0.500 peak   100 spectrum    2 weight  0.10000E+01 volume  0.87054E-02 ppm1      0.603 ppm2      1.561 CV     1
 ASSI {  101}
   (  segid "    " and resid 29   and name HG2%)
   (( segid "    " and resid 29   and name HG11))
      2.500     0.800     0.800 peak   101 spectrum    2 weight  0.10000E+01 volume  0.44875E-02 ppm1      0.604 ppm2      1.315 CV     1
 OR {  101}
   (  segid "    " and resid 29   and name HG2%)
   (( segid "    " and resid 29   and name HG12))
 ASSI {  102}
   (  segid "    " and resid 31   and name HG2%)
   (( segid "    " and resid 31   and name HG11))
      2.400     0.700     0.700 peak   102 spectrum    2 weight  0.10000E+01 volume  0.51590E-02 ppm1      0.594 ppm2      1.202 CV     1
 OR {  102}
   (  segid "    " and resid 31   and name HG2%)
   (( segid "    " and resid 31   and name HG12))
 ASSI {  104}
   (  segid "    " and resid 56   and name HB% )
   (( segid "    " and resid 56   and name HA  ))
      2.000     0.500     0.500 peak   104 spectrum    2 weight  0.10000E+01 volume  0.13292E-01 ppm1      1.510 ppm2      4.093 CV     1
 ASSI {  108}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 31   and name HA  ))
      4.800     2.900     1.200 peak   108 spectrum    2 weight  0.10000E+01 volume  0.31550E-03 ppm1      0.682 ppm2      5.206 CV     1
 ASSI {  109}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 48   and name HA  ))
      4.400     2.400     1.600 peak   109 spectrum    2 weight  0.10000E+01 volume  0.51902E-03 ppm1      0.677 ppm2      3.669 CV     1
 ASSI {  110}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 82   and name HA  ))
      4.600     2.600     1.400 peak   110 spectrum    2 weight  0.10000E+01 volume  0.24865E-03 ppm1      0.681 ppm2      3.576 CV     1
 ASSI {  111}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 46   and name HB  ))
      2.200     0.600     0.600 peak   111 spectrum    2 weight  0.10000E+01 volume  0.53098E-02 ppm1      0.682 ppm2      1.979 CV     1
 ASSI {  112}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 82   and name HG2 ))
      4.500     2.600     1.500 peak   112 spectrum    2 weight  0.10000E+01 volume  0.47845E-03 ppm1      0.682 ppm2      2.154 CV     1
 OR {  112}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 82   and name HG1 ))
 ASSI {  113}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 31   and name HB  ))
      2.600     0.900     0.900 peak   113 spectrum    2 weight  0.10000E+01 volume  0.21406E-02 ppm1      0.682 ppm2      1.764 CV     1
 ASSI {  117}
   (  segid "    " and resid 58   and name HB% )
   (( segid "    " and resid 58   and name HA  ))
      2.100     0.500     0.500 peak   117 spectrum    2 weight  0.10000E+01 volume  0.11511E-01 ppm1      1.365 ppm2      3.952 CV     1
 ASSI {  118}
   (  segid "    " and resid 58   and name HB% )
   (  segid "    " and resid 51   and name HD1%)
      2.800     1.000     1.000 peak   118 spectrum    2 weight  0.10000E+01 volume  0.40062E-02 ppm1      1.370 ppm2      0.646 CV     1
 ASSI {  119}
   (  segid "    " and resid 81   and name HB% )
   (( segid "    " and resid 81   and name HA  ))
      2.100     0.500     0.500 peak   119 spectrum    2 weight  0.10000E+01 volume  0.12884E-01 ppm1      1.409 ppm2      4.258 CV     1
 ASSI {  120}
   (  segid "    " and resid 8    and name HB% )
   (  segid "    " and resid 101  and name HD1%)
      4.200     2.200     1.800 peak   120 spectrum    2 weight  0.10000E+01 volume  0.53431E-03 ppm1      1.285 ppm2      0.433 CV     1
 ASSI {  122}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 63   and name HB  ))
      2.300     0.700     0.700 peak   122 spectrum    2 weight  0.10000E+01 volume  0.46737E-02 ppm1      0.767 ppm2      1.396 CV     1
 ASSI {  123}
   (  segid "    " and resid 63   and name HG2%)
   (  segid "    " and resid 57   and name HB% )
      2.800     1.000     1.000 peak   123 spectrum    2 weight  0.10000E+01 volume  0.20902E-02 ppm1      0.768 ppm2      1.198 CV     1
 ASSI {  125}
   (  segid "    " and resid 8    and name HB% )
   (( segid "    " and resid 9    and name HB1 ))
      3.000     3.000     3.000 peak   125 spectrum    2 weight  0.10000E+01 volume  0.19878E-02 ppm1      1.297 ppm2      3.768 CV     1
 OR {  125}
   (  segid "    " and resid 8    and name HB% )
   (( segid "    " and resid 9    and name HB2 ))
 ASSI {  126}
   (  segid "    " and resid 8    and name HB% )
   (( segid "    " and resid 5    and name HB1 ))
      3.600     1.600     1.600 peak   126 spectrum    2 weight  0.10000E+01 volume  0.58486E-03 ppm1      1.285 ppm2      2.926 CV     1
 OR {  126}
   (  segid "    " and resid 8    and name HB% )
   (( segid "    " and resid 5    and name HB2 ))
 ASSI {  127}
   (  segid "    " and resid 57   and name HB% )
   (( segid "    " and resid 63   and name HA  ))
      4.800     2.800     1.200 peak   127 spectrum    2 weight  0.10000E+01 volume  0.40146E-03 ppm1      1.183 ppm2      4.272 CV     1
 ASSI {  128}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 77   and name HB  ))
      2.300     0.700     0.700 peak   128 spectrum    2 weight  0.10000E+01 volume  0.38762E-02 ppm1      0.418 ppm2      2.371 CV     1
 ASSI {  129}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 69   and name HB  ))
      3.300     1.300     1.300 peak   129 spectrum    2 weight  0.10000E+01 volume  0.81064E-03 ppm1      0.418 ppm2      1.326 CV     1
 ASSI {  130}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 46   and name HG11))
      4.300     2.300     1.700 peak   130 spectrum    2 weight  0.10000E+01 volume  0.25488E-03 ppm1      0.420 ppm2      1.160 CV     1
 OR {  130}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 46   and name HG12))
 ASSI {  131}
   (  segid "    " and resid 92   and name HB% )
   (  segid "    " and resid 72   and name HG1%)
      2.400     2.400     3.600 peak   131 spectrum    2 weight  0.10000E+01 volume  0.64200E-02 ppm1      1.407 ppm2      0.567 CV     1
 ASSI {  133}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 46   and name HB  ))
      3.100     1.200     1.200 peak   133 spectrum    2 weight  0.10000E+01 volume  0.10279E-02 ppm1      0.420 ppm2      1.973 CV     1
 ASSI {  135}
   (  segid "    " and resid 77   and name HG2%)
   (  segid "    " and resid 85   and name HG2%)
      3.500     1.500     1.500 peak   135 spectrum    2 weight  0.10000E+01 volume  0.17288E-02 ppm1      0.419 ppm2      0.908 CV     1
 ASSI {  136}
   (  segid "    " and resid 77   and name HG2%)
   (  segid "    " and resid 77   and name HG1%)
      2.100     0.500     0.500 peak   136 spectrum    2 weight  0.10000E+01 volume  0.10314E-01 ppm1      0.418 ppm2      0.765 CV     1
 ASSI {  137}
   (  segid "    " and resid 77   and name HG2%)
   (  segid "    " and resid 46   and name HG2%)
      2.300     2.300     3.700 peak   137 spectrum    2 weight  0.10000E+01 volume  0.74679E-02 ppm1      0.417 ppm2      0.680 CV     1
 ASSI {  138}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 71   and name HA  ))
      3.400     1.500     1.500 peak   138 spectrum    2 weight  0.10000E+01 volume  0.46219E-03 ppm1      0.418 ppm2      5.139 CV     1
 ASSI {  141}
   (  segid "    " and resid 77   and name HG2%)
   (( segid "    " and resid 78   and name HA  ))
      3.600     1.600     1.600 peak   141 spectrum    2 weight  0.10000E+01 volume  0.51721E-03 ppm1      0.415 ppm2      4.029 CV     1
 ASSI {  142}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 92   and name HA  ))
      2.100     0.500     0.500 peak   142 spectrum    2 weight  0.10000E+01 volume  0.10345E-01 ppm1      1.412 ppm2      4.173 CV     1
 ASSI {  144}
   (  segid "    " and resid 43   and name HB% )
   (( segid "    " and resid 43   and name HA  ))
      2.200     0.600     0.600 peak   144 spectrum    2 weight  0.10000E+01 volume  0.94137E-02 ppm1      1.320 ppm2      4.363 CV     1
 ASSI {  145}
   (  segid "    " and resid 8    and name HB% )
   (( segid "    " and resid 8    and name HA  ))
      2.100     0.500     0.500 peak   145 spectrum    2 weight  0.10000E+01 volume  0.12192E-01 ppm1      1.286 ppm2      4.264 CV     1
 ASSI {  146}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 89   and name HA  ))
      2.400     0.700     0.700 peak   146 spectrum    2 weight  0.10000E+01 volume  0.30929E-02 ppm1      1.413 ppm2      3.792 CV     1
 ASSI {  147}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 96   and name HB  ))
      3.500     1.500     1.500 peak   147 spectrum    2 weight  0.10000E+01 volume  0.18966E-02 ppm1      1.414 ppm2      1.977 CV     1
 ASSI {  148}
   (  segid "    " and resid 92   and name HB% )
   (  segid "    " and resid 96   and name HG2%)
      2.300     2.300     3.700 peak   148 spectrum    2 weight  0.10000E+01 volume  0.70138E-02 ppm1      1.412 ppm2      0.872 CV     1
 ASSI {  149}
   (  segid "    " and resid 57   and name HB% )
   (( segid "    " and resid 29   and name HA  ))
      3.100     1.200     1.200 peak   149 spectrum    2 weight  0.10000E+01 volume  0.13141E-02 ppm1      1.207 ppm2      4.211 CV     1
 ASSI {  150}
   (  segid "    " and resid 57   and name HB% )
   (( segid "    " and resid 29   and name HG12))
      2.900     1.100     1.100 peak   150 spectrum    2 weight  0.10000E+01 volume  0.14422E-02 ppm1      1.201 ppm2      0.423 CV     1
 OR {  150}
   (  segid "    " and resid 57   and name HB% )
   (( segid "    " and resid 29   and name HG11))
 ASSI {  151}
   (  segid "    " and resid 57   and name HB% )
   (  segid "    " and resid 63   and name HD1%)
      2.700     0.900     0.900 peak   151 spectrum    2 weight  0.10000E+01 volume  0.24999E-02 ppm1      1.200 ppm2      0.726 CV     1
 ASSI {  152}
   (  segid "    " and resid 57   and name HB% )
   (  segid "    " and resid 51   and name HD1%)
      2.900     1.000     1.000 peak   152 spectrum    2 weight  0.10000E+01 volume  0.27707E-02 ppm1      1.199 ppm2      0.646 CV     1
 ASSI {  153}
   (  segid "    " and resid 57   and name HB% )
   (  segid "    " and resid 51   and name HD2%)
      2.200     0.600     0.600 peak   153 spectrum    2 weight  0.10000E+01 volume  0.68542E-02 ppm1      1.201 ppm2      0.569 CV     1
 ASSI {  154}
   (  segid "    " and resid 57   and name HB% )
   (  segid "    " and resid 52   and name HG2%)
      2.900     2.900     3.100 peak   154 spectrum    2 weight  0.10000E+01 volume  0.36869E-03 ppm1      1.203 ppm2      0.868 CV     1
 ASSI {  157}
   (  segid "    " and resid 57   and name HB% )
   (  segid "    " and resid 18   and name HD1%)
      3.200     3.200     2.800 peak   157 spectrum    2 weight  0.10000E+01 volume  0.25912E-02 ppm1      1.200 ppm2      0.690 CV     1
 ASSI {  158}
   (  segid "    " and resid 57   and name HB% )
   (( segid "    " and resid 57   and name HA  ))
      2.200     0.600     0.600 peak   158 spectrum    2 weight  0.10000E+01 volume  0.63394E-02 ppm1      1.201 ppm2      3.966 CV     1
 ASSI {  159}
   (  segid "    " and resid 57   and name HB% )
   (( segid "    " and resid 27   and name HA  ))
      2.600     2.600     3.400 peak   159 spectrum    2 weight  0.10000E+01 volume  0.72784E-03 ppm1      1.198 ppm2      4.102 CV     1
 ASSI {  160}
   (  segid "    " and resid 72   and name HG2%)
   (  segid "    " and resid 77   and name HG1%)
      2.000     2.000     4.000 peak   160 spectrum    2 weight  0.10000E+01 volume  0.10338E-01 ppm1      0.569 ppm2      0.756 CV     1
 ASSI {  161}
   (  segid "    " and resid 72   and name HG2%)
   (  segid "    " and resid 77   and name HG2%)
      2.400     0.700     0.700 peak   161 spectrum    2 weight  0.10000E+01 volume  0.71797E-02 ppm1      0.569 ppm2      0.418 CV     1
 ASSI {  162}
   (  segid "    " and resid 72   and name HG2%)
   (( segid "    " and resid 71   and name HA  ))
      4.500     2.500     1.500 peak   162 spectrum    2 weight  0.10000E+01 volume  0.29643E-03 ppm1      0.565 ppm2      5.141 CV     1
 ASSI {  163}
   (  segid "    " and resid 72   and name HG2%)
   (( segid "    " and resid 72   and name HA  ))
      2.700     0.900     0.900 peak   163 spectrum    2 weight  0.10000E+01 volume  0.23134E-02 ppm1      0.558 ppm2      4.252 CV     1
 ASSI {  164}
   (  segid "    " and resid 72   and name HG2%)
   (( segid "    " and resid 88   and name HB  ))
      3.700     3.700     2.300 peak   164 spectrum    2 weight  0.10000E+01 volume  0.47643E-03 ppm1      0.561 ppm2      2.170 CV     1
 ASSI {  165}
   (  segid "    " and resid 72   and name HG2%)
   (( segid "    " and resid 72   and name HB  ))
      2.300     0.700     0.700 peak   165 spectrum    2 weight  0.10000E+01 volume  0.41827E-02 ppm1      0.561 ppm2      1.657 CV     1
 ASSI {  167}
   (  segid "    " and resid 72   and name HG2%)
   (  segid "    " and resid 88   and name HG2%)
      4.300     2.300     1.700 peak   167 spectrum    2 weight  0.10000E+01 volume  0.39268E-03 ppm1      0.563 ppm2      0.958 CV     1
 ASSI {  170}
   (  segid "    " and resid 86   and name HG1%)
   (( segid "    " and resid 83   and name HA  ))
      3.400     1.500     1.500 peak   170 spectrum    2 weight  0.10000E+01 volume  0.19931E-02 ppm1      0.873 ppm2      3.940 CV     1
 ASSI {  171}
   (  segid "    " and resid 86   and name HG1%)
   (( segid "    " and resid 87   and name HA  ))
      3.900     1.900     1.900 peak   171 spectrum    2 weight  0.10000E+01 volume  0.60678E-03 ppm1      0.880 ppm2      4.120 CV     1
 ASSI {  173}
   (  segid "    " and resid 86   and name HG1%)
   (( segid "    " and resid 86   and name HB  ))
      2.100     0.500     0.500 peak   173 spectrum    2 weight  0.10000E+01 volume  0.95607E-02 ppm1      0.874 ppm2      2.115 CV     1
 ASSI {  174}
   (  segid "    " and resid 96   and name HG1%)
   (( segid "    " and resid 92   and name HA  ))
      3.600     1.600     1.600 peak   174 spectrum    2 weight  0.10000E+01 volume  0.81104E-03 ppm1      0.756 ppm2      4.176 CV     1
 ASSI {  175}
   (  segid "    " and resid 88   and name HG1%)
   (( segid "    " and resid 88   and name HA  ))
      2.400     0.700     0.700 peak   175 spectrum    2 weight  0.10000E+01 volume  0.44385E-02 ppm1      0.746 ppm2      3.573 CV     1
 ASSI {  176}
   (  segid "    " and resid 96   and name HG1%)
   (( segid "    " and resid 96   and name HA  ))
      2.500     0.800     0.800 peak   176 spectrum    2 weight  0.10000E+01 volume  0.33994E-02 ppm1      0.759 ppm2      4.301 CV     1
 ASSI {  177}
   (  segid "    " and resid 88   and name HG1%)
   (( segid "    " and resid 88   and name HB  ))
      2.000     0.500     0.500 peak   177 spectrum    2 weight  0.10000E+01 volume  0.11089E-01 ppm1      0.749 ppm2      2.172 CV     1
 ASSI {  179}
   (  segid "    " and resid 96   and name HG1%)
   (  segid "    " and resid 92   and name HB% )
      2.000     0.500     0.500 peak   179 spectrum    2 weight  0.10000E+01 volume  0.11303E-01 ppm1      0.750 ppm2      1.416 CV     1
 ASSI {  180}
   (  segid "    " and resid 88   and name HG1%)
   (( segid "    " and resid 89   and name HA  ))
      2.300     0.700     0.700 peak   180 spectrum    2 weight  0.10000E+01 volume  0.59896E-02 ppm1      0.739 ppm2      3.805 CV     1
 ASSI {  181}
   (  segid "    " and resid 75   and name HG2%)
   (( segid "    " and resid 75   and name HB  ))
      2.000     0.500     0.500 peak   181 spectrum    2 weight  0.10000E+01 volume  0.10824E-01 ppm1      0.853 ppm2      2.181 CV     1
 ASSI {  182}
   (  segid "    " and resid 86   and name HG1%)
   (  segid "    " and resid 86   and name HG2%)
      2.000     0.500     0.500 peak   182 spectrum    2 weight  0.10000E+01 volume  0.15261E-01 ppm1      0.878 ppm2      1.022 CV     1
 ASSI {  184}
   (  segid "    " and resid 88   and name HG1%)
   (  segid "    " and resid 88   and name HG2%)
      2.000     0.500     0.500 peak   184 spectrum    2 weight  0.10000E+01 volume  0.15952E-01 ppm1      0.748 ppm2      0.958 CV     1
 ASSI {  187}
   (  segid "    " and resid 72   and name HG1%)
   (( segid "    " and resid 72   and name HB  ))
      2.200     0.600     0.600 peak   187 spectrum    2 weight  0.10000E+01 volume  0.51638E-02 ppm1      0.565 ppm2      1.660 CV     1
 ASSI {  189}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 47   and name HA  ))
      5.700     4.100     0.300 peak   189 spectrum    2 weight  0.10000E+01 volume  0.19979E-03 ppm1      0.570 ppm2      5.122 CV     1
 ASSI {  191}
   (  segid "    " and resid 75   and name HG2%)
   (( segid "    " and resid 72   and name HB  ))
      4.000     2.000     2.000 peak   191 spectrum    2 weight  0.10000E+01 volume  0.98594E-03 ppm1      0.849 ppm2      1.656 CV     1
 ASSI {  193}
   (  segid "    " and resid 72   and name HG1%)
   (  segid "    " and resid 96   and name HG2%)
      2.500     2.500     3.500 peak   193 spectrum    2 weight  0.10000E+01 volume  0.61076E-02 ppm1      0.568 ppm2      0.869 CV     1
 ASSI {  194}
   (  segid "    " and resid 77   and name HG1%)
   (( segid "    " and resid 71   and name HA  ))
      3.600     1.600     1.600 peak   194 spectrum    2 weight  0.10000E+01 volume  0.66095E-03 ppm1      0.762 ppm2      5.139 CV     1
 ASSI {  196}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 31   and name HA  ))
      4.700     2.800     1.300 peak   196 spectrum    2 weight  0.10000E+01 volume  0.25786E-03 ppm1      0.568 ppm2      5.204 CV     1
 ASSI {  197}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 48   and name HB  ))
      2.100     0.600     0.600 peak   197 spectrum    2 weight  0.10000E+01 volume  0.75500E-02 ppm1      0.562 ppm2      2.127 CV     1
 ASSI {  198}
   (  segid "    " and resid 77   and name HG1%)
   (( segid "    " and resid 78   and name HA  ))
      5.000     3.100     1.000 peak   198 spectrum    2 weight  0.10000E+01 volume  0.20059E-03 ppm1      0.765 ppm2      4.024 CV     1
 ASSI {  204}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 51   and name HG  ))
      3.200     1.300     1.300 peak   204 spectrum    2 weight  0.10000E+01 volume  0.98677E-03 ppm1      0.557 ppm2      1.338 CV     1
 ASSI {  205}
   (  segid "    " and resid 77   and name HG1%)
   (( segid "    " and resid 77   and name HB  ))
      2.400     0.700     0.700 peak   205 spectrum    2 weight  0.10000E+01 volume  0.33124E-02 ppm1      0.759 ppm2      2.373 CV     1
 ASSI {  207}
   (  segid "    " and resid 48   and name HG1%)
   (  segid "    " and resid 57   and name HB% )
      5.100     3.200     0.900 peak   207 spectrum    2 weight  0.10000E+01 volume  0.20739E-03 ppm1      0.549 ppm2      1.199 CV     1
 ASSI {  211}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 39   and name HB  ))
      1.800     0.400     0.400 peak   211 spectrum    2 weight  0.10000E+01 volume  0.26104E-01 ppm1      1.118 ppm2      4.216 CV     1
 ASSI {  213}
   (  segid "    " and resid 75   and name HG1%)
   (( segid "    " and resid 75   and name HB  ))
      2.000     0.500     0.500 peak   213 spectrum    2 weight  0.10000E+01 volume  0.10333E-01 ppm1      0.687 ppm2      2.181 CV     1
 ASSI {  216}
   (  segid "    " and resid 16   and name HG1%)
   (( segid "    " and resid 63   and name HA  ))
      4.800     2.900     1.200 peak   216 spectrum    2 weight  0.10000E+01 volume  0.19186E-03 ppm1      0.852 ppm2      4.279 CV     1
 ASSI {  219}
   (  segid "    " and resid 16   and name HG1%)
   (( segid "    " and resid 62   and name HD2 ))
      3.900     1.900     1.900 peak   219 spectrum    2 weight  0.10000E+01 volume  0.35171E-03 ppm1      0.855 ppm2      3.032 CV     1
 OR {  219}
   (  segid "    " and resid 16   and name HG1%)
   (( segid "    " and resid 62   and name HD1 ))
 ASSI {  220}
   (  segid "    " and resid 16   and name HG1%)
   (( segid "    " and resid 16   and name HB  ))
      2.300     0.700     0.700 peak   220 spectrum    2 weight  0.10000E+01 volume  0.41972E-02 ppm1      0.856 ppm2      1.836 CV     1
 ASSI {  223}
   (  segid "    " and resid 59   and name HD2%)
   (( segid "    " and resid 59   and name HA  ))
      2.100     0.500     0.500 peak   223 spectrum    2 weight  0.10000E+01 volume  0.10471E-01 ppm1      0.784 ppm2      3.937 CV     1
 ASSI {  224}
   (  segid "    " and resid 59   and name HD2%)
   (( segid "    " and resid 59   and name HG  ))
      2.000     0.500     0.500 peak   224 spectrum    2 weight  0.10000E+01 volume  0.10686E-01 ppm1      0.781 ppm2      1.586 CV     1
 ASSI {  225}
   (  segid "    " and resid 59   and name HD2%)
   (( segid "    " and resid 59   and name HB2 ))
      2.500     0.800     0.800 peak   225 spectrum    2 weight  0.10000E+01 volume  0.50399E-02 ppm1      0.782 ppm2      1.673 CV     1
 OR {  225}
   (  segid "    " and resid 59   and name HD2%)
   (( segid "    " and resid 59   and name HB1 ))
 ASSI {  226}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 70   and name HA  ))
      2.400     0.700     0.700 peak   226 spectrum    2 weight  0.10000E+01 volume  0.33685E-02 ppm1      0.567 ppm2      4.375 CV     1
 ASSI {  227}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 78   and name HA  ))
      4.500     2.500     1.500 peak   227 spectrum    2 weight  0.10000E+01 volume  0.38671E-03 ppm1      0.569 ppm2      4.028 CV     1
 ASSI {  232}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 105  and name HD1 ))
      2.800     1.000     1.000 peak   232 spectrum    2 weight  0.10000E+01 volume  0.47897E-02 ppm1      0.740 ppm2      3.668 CV     1
 OR {  232}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 105  and name HD2 ))
 ASSI {  234}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 102  and name HD1 ))
      3.100     3.100     2.900 peak   234 spectrum    2 weight  0.10000E+01 volume  0.28734E-03 ppm1      0.739 ppm2      3.207 CV     1
 OR {  234}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 102  and name HD2 ))
 ASSI {  237}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 104  and name HB1 ))
      2.100     2.100     3.900 peak   237 spectrum    2 weight  0.10000E+01 volume  0.13622E-01 ppm1      0.747 ppm2      1.346 CV     1
 OR {  237}
   (  segid "    " and resid 104  and name HD2%)
   (( segid "    " and resid 104  and name HB2 ))
 ASSI {  240}
   (  segid "    " and resid 70   and name HD2%)
   (  segid "    " and resid 101  and name HD1%)
      2.900     1.100     1.100 peak   240 spectrum    2 weight  0.10000E+01 volume  0.37898E-02 ppm1      0.561 ppm2      0.425 CV     1
 ASSI {  241}
   (  segid "    " and resid 86   and name HG2%)
   (( segid "    " and resid 83   and name HA  ))
      2.700     0.900     0.900 peak   241 spectrum    2 weight  0.10000E+01 volume  0.28727E-02 ppm1      1.023 ppm2      3.941 CV     1
 ASSI {  243}
   (  segid "    " and resid 86   and name HG2%)
   (( segid "    " and resid 86   and name HB  ))
      2.100     0.500     0.500 peak   243 spectrum    2 weight  0.10000E+01 volume  0.10617E-01 ppm1      1.021 ppm2      2.115 CV     1
 ASSI {  247}
   (  segid "    " and resid 99   and name HD1%)
   (( segid "    " and resid 99   and name HB1 ))
      2.300     0.600     0.600 peak   247 spectrum    2 weight  0.10000E+01 volume  0.86269E-02 ppm1      0.687 ppm2      1.213 CV     1
 OR {  247}
   (  segid "    " and resid 99   and name HD1%)
   (( segid "    " and resid 99   and name HB2 ))
 ASSI {  256}
   (  segid "    " and resid 86   and name HG2%)
   (( segid "    " and resid 31   and name HG11))
      2.800     1.000     1.000 peak   256 spectrum    2 weight  0.10000E+01 volume  0.21686E-02 ppm1      1.014 ppm2      1.198 CV     1
 OR {  256}
   (  segid "    " and resid 86   and name HG2%)
   (( segid "    " and resid 31   and name HG12))
 ASSI {  257}
   (  segid "    " and resid 86   and name HG2%)
   (  segid "    " and resid 31   and name HD1%)
      2.000     2.000     4.000 peak   257 spectrum    2 weight  0.10000E+01 volume  0.11679E-01 ppm1      1.001 ppm2      0.672 CV     1
 ASSI {  258}
   (  segid "    " and resid 88   and name HG2%)
   (( segid "    " and resid 88   and name HA  ))
      2.300     0.600     0.600 peak   258 spectrum    2 weight  0.10000E+01 volume  0.67158E-02 ppm1      0.959 ppm2      3.566 CV     1
 ASSI {  259}
   (  segid "    " and resid 86   and name HG2%)
   (( segid "    " and resid 86   and name HA  ))
      2.200     0.600     0.600 peak   259 spectrum    2 weight  0.10000E+01 volume  0.90245E-02 ppm1      1.014 ppm2      3.413 CV     1
 ASSI {  260}
   (  segid "    " and resid 88   and name HG2%)
   (( segid "    " and resid 88   and name HB  ))
      2.100     0.500     0.500 peak   260 spectrum    2 weight  0.10000E+01 volume  0.87546E-02 ppm1      0.973 ppm2      2.166 CV     1
 ASSI {  262}
   (  segid "    " and resid 107  and name HD2%)
   (( segid "    " and resid 107  and name HA  ))
      2.300     0.600     0.600 peak   262 spectrum    2 weight  0.10000E+01 volume  0.71132E-02 ppm1      0.728 ppm2      4.281 CV     1
 ASSI {  263}
   (  segid "    " and resid 106  and name HD2%)
   (( segid "    " and resid 106  and name HA  ))
      2.200     0.600     0.600 peak   263 spectrum    2 weight  0.10000E+01 volume  0.67986E-02 ppm1      0.727 ppm2      4.199 CV     1
 ASSI {  264}
   (  segid "    " and resid 106  and name HD2%)
   (( segid "    " and resid 106  and name HG  ))
      1.800     0.400     0.400 peak   264 spectrum    2 weight  0.10000E+01 volume  0.28668E-01 ppm1      0.727 ppm2      1.467 CV     1
 ASSI {  265}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 89   and name HA  ))
      2.200     0.600     0.600 peak   265 spectrum    2 weight  0.10000E+01 volume  0.57544E-02 ppm1      0.641 ppm2      3.792 CV     1
 ASSI {  267}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 89   and name HG  ))
      2.000     0.500     0.500 peak   267 spectrum    2 weight  0.10000E+01 volume  0.10664E-01 ppm1      0.641 ppm2      1.580 CV     1
 ASSI {  268}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 89   and name HB1 ))
      2.200     0.600     0.600 peak   268 spectrum    2 weight  0.10000E+01 volume  0.92775E-02 ppm1      0.641 ppm2      1.416 CV     1
 OR {  268}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 89   and name HB2 ))
 ASSI {  269}
   (  segid "    " and resid 18   and name HD2%)
   (  segid "    " and resid 57   and name HB% )
      3.400     1.400     1.400 peak   269 spectrum    2 weight  0.10000E+01 volume  0.21985E-02 ppm1      0.752 ppm2      1.198 CV     1
 ASSI {  270}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 18   and name HB2 ))
      2.800     1.000     1.000 peak   270 spectrum    2 weight  0.10000E+01 volume  0.23583E-02 ppm1      0.750 ppm2      1.121 CV     1
 OR {  270}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 18   and name HB1 ))
 ASSI {  271}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 20   and name HB2 ))
      2.000     0.500     0.500 peak   271 spectrum    2 weight  0.10000E+01 volume  0.78317E-02 ppm1      0.732 ppm2      1.623 CV     1
 OR {  271}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 20   and name HB1 ))
 ASSI {  272}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 27   and name HB2 ))
      2.500     0.800     0.800 peak   272 spectrum    2 weight  0.10000E+01 volume  0.38055E-02 ppm1      0.732 ppm2      1.717 CV     1
 OR {  272}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 27   and name HB1 ))
 ASSI {  273}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 96   and name HB  ))
      3.900     3.900     2.100 peak   273 spectrum    2 weight  0.10000E+01 volume  0.73585E-03 ppm1      0.730 ppm2      1.960 CV     1
 ASSI {  274}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 16   and name HB  ))
      3.300     1.300     1.300 peak   274 spectrum    2 weight  0.10000E+01 volume  0.82462E-03 ppm1      0.752 ppm2      1.839 CV     1
 ASSI {  275}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 20   and name HD1 ))
      3.000     1.100     1.100 peak   275 spectrum    2 weight  0.10000E+01 volume  0.16320E-02 ppm1      0.730 ppm2      2.869 CV     1
 OR {  275}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 20   and name HD2 ))
 ASSI {  277}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 27   and name HA  ))
      2.300     0.600     0.600 peak   277 spectrum    2 weight  0.10000E+01 volume  0.46402E-02 ppm1      0.731 ppm2      4.111 CV     1
 ASSI {  278}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 60   and name HB2 ))
      3.000     1.100     1.100 peak   278 spectrum    2 weight  0.10000E+01 volume  0.13219E-02 ppm1      0.757 ppm2      2.677 CV     1
 OR {  278}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 60   and name HB1 ))
 ASSI {  282}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 82   and name HA  ))
      3.100     1.200     1.200 peak   282 spectrum    2 weight  0.10000E+01 volume  0.97060E-03 ppm1      0.907 ppm2      3.577 CV     1
 ASSI {  284}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 77   and name HB  ))
      2.500     0.800     0.800 peak   284 spectrum    2 weight  0.10000E+01 volume  0.23519E-02 ppm1      0.908 ppm2      2.375 CV     1
 ASSI {  286}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 85   and name HB  ))
      2.200     0.600     0.600 peak   286 spectrum    2 weight  0.10000E+01 volume  0.55219E-02 ppm1      0.907 ppm2      1.973 CV     1
 ASSI {  288}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 80   and name HB1 ))
      2.600     0.900     0.900 peak   288 spectrum    2 weight  0.10000E+01 volume  0.21226E-02 ppm1      0.907 ppm2      1.829 CV     1
 OR {  288}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 80   and name HB2 ))
 ASSI {  290}
   (( segid "    " and resid 22   and name HG1 ))
   (( segid "    " and resid 22   and name HD1 ))
      1.800     0.400     0.400 peak   290 spectrum    2 weight  0.10000E+01 volume  0.27051E-01 ppm1      1.324 ppm2      1.569 CV     1
 OR {  290}
   (( segid "    " and resid 22   and name HG2 ))
   (( segid "    " and resid 22   and name HD2 ))
 OR {  290}
   (( segid "    " and resid 22   and name HG1 ))
   (( segid "    " and resid 22   and name HD2 ))
 OR {  290}
   (( segid "    " and resid 22   and name HG2 ))
   (( segid "    " and resid 22   and name HD1 ))
 ASSI {  291}
   (( segid "    " and resid 22   and name HG2 ))
   (( segid "    " and resid 22   and name HB2 ))
      2.000     0.500     0.500 peak   291 spectrum    2 weight  0.10000E+01 volume  0.12375E-01 ppm1      1.322 ppm2      1.732 CV     1
 OR {  291}
   (( segid "    " and resid 22   and name HG1 ))
   (( segid "    " and resid 22   and name HB1 ))
 OR {  291}
   (( segid "    " and resid 22   and name HG2 ))
   (( segid "    " and resid 22   and name HB1 ))
 OR {  291}
   (( segid "    " and resid 22   and name HG1 ))
   (( segid "    " and resid 22   and name HB2 ))
 ASSI {  293}
   (( segid "    " and resid 95   and name HG1 ))
   (( segid "    " and resid 95   and name HD1 ))
      3.000     1.100     1.100 peak   293 spectrum    2 weight  0.10000E+01 volume  0.10727E-02 ppm1      1.236 ppm2      3.665 CV     1
 OR {  293}
   (( segid "    " and resid 95   and name HG2 ))
   (( segid "    " and resid 95   and name HD2 ))
 OR {  293}
   (( segid "    " and resid 95   and name HG2 ))
   (( segid "    " and resid 95   and name HD1 ))
 OR {  293}
   (( segid "    " and resid 95   and name HG1 ))
   (( segid "    " and resid 95   and name HD2 ))
 ASSI {  296}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 50   and name HB2 ))
      3.600     1.600     1.600 peak   296 spectrum    2 weight  0.10000E+01 volume  0.54453E-03 ppm1      1.223 ppm2      3.776 CV     1
 OR {  296}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 50   and name HB1 ))
 OR {  296}
   (( segid "    " and resid 49   and name HG1 ))
   (( segid "    " and resid 50   and name HB1 ))
 ASSI {  298}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 51   and name HA  ))
      2.300     0.600     0.600 peak   298 spectrum    2 weight  0.10000E+01 volume  0.46561E-02 ppm1      0.571 ppm2      5.260 CV     1
 ASSI {  299}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 29   and name HA  ))
      2.300     0.700     0.700 peak   299 spectrum    2 weight  0.10000E+01 volume  0.46782E-02 ppm1      0.570 ppm2      4.220 CV     1
 ASSI {  300}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 58   and name HA  ))
      3.200     1.300     1.300 peak   300 spectrum    2 weight  0.10000E+01 volume  0.18072E-02 ppm1      0.573 ppm2      3.954 CV     1
 ASSI {  301}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 30   and name HB1 ))
      3.800     1.800     1.800 peak   301 spectrum    2 weight  0.10000E+01 volume  0.87805E-03 ppm1      0.572 ppm2      3.791 CV     1
 OR {  301}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 30   and name HB2 ))
 ASSI {  304}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 51   and name HB1 ))
      2.200     0.600     0.600 peak   304 spectrum    2 weight  0.10000E+01 volume  0.95348E-02 ppm1      0.572 ppm2      1.581 CV     1
 OR {  304}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 51   and name HB2 ))
 ASSI {  305}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 51   and name HG  ))
      1.800     0.400     0.400 peak   305 spectrum    2 weight  0.10000E+01 volume  0.22308E-01 ppm1      0.572 ppm2      1.353 CV     1
 ASSI {  307}
   (  segid "    " and resid 107  and name HD1%)
   (( segid "    " and resid 107  and name HA  ))
      2.800     1.000     1.000 peak   307 spectrum    2 weight  0.10000E+01 volume  0.26026E-02 ppm1      0.784 ppm2      4.279 CV     1
 ASSI {  308}
   (  segid "    " and resid 106  and name HD1%)
   (( segid "    " and resid 106  and name HA  ))
      3.400     1.400     1.400 peak   308 spectrum    2 weight  0.10000E+01 volume  0.32225E-02 ppm1      0.776 ppm2      4.198 CV     1
 ASSI {  311}
   (  segid "    " and resid 107  and name HD1%)
   (( segid "    " and resid 107  and name HB1 ))
      1.800     0.400     0.400 peak   311 spectrum    2 weight  0.10000E+01 volume  0.38227E-01 ppm1      0.783 ppm2      1.479 CV     1
 OR {  311}
   (  segid "    " and resid 107  and name HD1%)
   (( segid "    " and resid 107  and name HB2 ))
 ASSI {  312}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 56   and name HA  ))
      2.600     0.800     0.800 peak   312 spectrum    2 weight  0.10000E+01 volume  0.37473E-02 ppm1      0.714 ppm2      4.089 CV     1
 ASSI {  313}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 59   and name HB1 ))
      2.100     0.500     0.500 peak   313 spectrum    2 weight  0.10000E+01 volume  0.12391E-01 ppm1      0.711 ppm2      1.675 CV     1
 OR {  313}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 59   and name HB2 ))
 ASSI {  314}
   (  segid "    " and resid 59   and name HD1%)
   (( segid "    " and resid 59   and name HG  ))
      1.900     0.400     0.400 peak   314 spectrum    2 weight  0.10000E+01 volume  0.19479E-01 ppm1      0.707 ppm2      1.581 CV     1
 ASSI {  315}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 105  and name HD1 ))
      4.700     2.700     1.300 peak   315 spectrum    2 weight  0.10000E+01 volume  0.59791E-03 ppm1      0.714 ppm2      3.505 CV     1
 OR {  315}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 105  and name HD2 ))
 ASSI {  316}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 58   and name HA  ))
      2.300     0.700     0.700 peak   316 spectrum    2 weight  0.10000E+01 volume  0.61408E-02 ppm1      0.657 ppm2      3.955 CV     1
 ASSI {  320}
   (( segid "    " and resid 31   and name HG12))
   (( segid "    " and resid 31   and name HB  ))
      2.900     1.100     1.100 peak   320 spectrum    2 weight  0.10000E+01 volume  0.10462E-02 ppm1      1.210 ppm2      1.754 CV     1
 OR {  320}
   (( segid "    " and resid 31   and name HG11))
   (( segid "    " and resid 31   and name HB  ))
 ASSI {  326}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 70   and name HB2 ))
      1.900     0.400     0.400 peak   326 spectrum    2 weight  0.10000E+01 volume  0.16741E-01 ppm1      0.520 ppm2      1.328 CV     1
 OR {  326}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 70   and name HB1 ))
 ASSI {  328}
   (  segid "    " and resid 70   and name HD1%)
   (  segid "    " and resid 101  and name HG2%)
      2.600     0.800     0.800 peak   328 spectrum    2 weight  0.10000E+01 volume  0.55409E-02 ppm1      0.520 ppm2      0.768 CV     1
 ASSI {  329}
   (  segid "    " and resid 70   and name HD1%)
   (  segid "    " and resid 101  and name HD1%)
      2.800     1.000     1.000 peak   329 spectrum    2 weight  0.10000E+01 volume  0.53490E-02 ppm1      0.510 ppm2      0.428 CV     1
 ASSI {  330}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 71   and name HD1 ))
      5.400     3.700     0.600 peak   330 spectrum    2 weight  0.10000E+01 volume  0.85097E-04 ppm1      0.512 ppm2      2.933 CV     1
 OR {  330}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 71   and name HD2 ))
 ASSI {  331}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 29   and name HA  ))
      4.000     2.000     2.000 peak   331 spectrum    2 weight  0.10000E+01 volume  0.13365E-02 ppm1      0.649 ppm2      4.218 CV     1
 ASSI {  332}
   (  segid "    " and resid 13   and name HD2%)
   (( segid "    " and resid 13   and name HA  ))
      2.400     0.700     0.700 peak   332 spectrum    2 weight  0.10000E+01 volume  0.31205E-02 ppm1      0.685 ppm2      5.188 CV     1
 ASSI {  333}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 51   and name HA  ))
      3.300     1.400     1.400 peak   333 spectrum    2 weight  0.10000E+01 volume  0.38153E-02 ppm1      0.658 ppm2      5.257 CV     1
 ASSI {  334}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 104  and name HA  ))
      4.800     2.900     1.200 peak   334 spectrum    2 weight  0.10000E+01 volume  0.46459E-03 ppm1      0.719 ppm2      4.470 CV     1
 ASSI {  336}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 89   and name HA  ))
      3.200     1.300     1.300 peak   336 spectrum    2 weight  0.10000E+01 volume  0.48157E-02 ppm1      0.699 ppm2      3.792 CV     1
 ASSI {  337}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 12   and name HB1 ))
      2.400     0.700     0.700 peak   337 spectrum    2 weight  0.10000E+01 volume  0.49812E-02 ppm1      0.710 ppm2      3.654 CV     1
 OR {  337}
   (  segid "    " and resid 104  and name HD1%)
   (( segid "    " and resid 12   and name HB2 ))
 ASSI {  338}
   (  segid "    " and resid 70   and name HD1%)
   (( segid "    " and resid 70   and name HA  ))
      4.400     2.400     1.600 peak   338 spectrum    2 weight  0.10000E+01 volume  0.74836E-03 ppm1      0.517 ppm2      4.371 CV     1
 ASSI {  340}
   (  segid "    " and resid 99   and name HD2%)
   (( segid "    " and resid 99   and name HB2 ))
      1.900     0.500     0.500 peak   340 spectrum    2 weight  0.10000E+01 volume  0.19778E-01 ppm1      0.655 ppm2      1.205 CV     1
 OR {  340}
   (  segid "    " and resid 99   and name HD2%)
   (( segid "    " and resid 99   and name HB1 ))
 ASSI {  341}
   (  segid "    " and resid 13   and name HD2%)
   (( segid "    " and resid 13   and name HB1 ))
      1.800     0.400     0.400 peak   341 spectrum    2 weight  0.10000E+01 volume  0.38317E-01 ppm1      0.676 ppm2      1.564 CV     1
 OR {  341}
   (  segid "    " and resid 13   and name HD2%)
   (( segid "    " and resid 13   and name HB2 ))
 ASSI {  343}
   (  segid "    " and resid 99   and name HD2%)
   (( segid "    " and resid 71   and name HD2 ))
      2.700     0.900     0.900 peak   343 spectrum    2 weight  0.10000E+01 volume  0.24288E-02 ppm1      0.663 ppm2      2.922 CV     1
 OR {  343}
   (  segid "    " and resid 99   and name HD2%)
   (( segid "    " and resid 71   and name HD1 ))
 ASSI {  344}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 27   and name HA  ))
      3.800     1.800     1.800 peak   344 spectrum    2 weight  0.10000E+01 volume  0.18725E-02 ppm1      0.815 ppm2      4.115 CV     1
 ASSI {  345}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 89   and name HA  ))
      3.800     1.800     1.800 peak   345 spectrum    2 weight  0.10000E+01 volume  0.41418E-03 ppm1      0.806 ppm2      3.791 CV     1
 ASSI {  346}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 27   and name HB1 ))
      2.500     0.800     0.800 peak   346 spectrum    2 weight  0.10000E+01 volume  0.35399E-02 ppm1      0.813 ppm2      1.712 CV     1
 OR {  346}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 27   and name HB2 ))
 ASSI {  347}
   (( segid "    " and resid 102  and name HG2 ))
   (( segid "    " and resid 102  and name HD2 ))
      3.200     1.200     1.200 peak   347 spectrum    2 weight  0.10000E+01 volume  0.77894E-03 ppm1      1.525 ppm2      3.212 CV     1
 OR {  347}
   (( segid "    " and resid 102  and name HG1 ))
   (( segid "    " and resid 102  and name HD1 ))
 OR {  347}
   (( segid "    " and resid 102  and name HG2 ))
   (( segid "    " and resid 102  and name HD1 ))
 OR {  347}
   (( segid "    " and resid 102  and name HG1 ))
   (( segid "    " and resid 102  and name HD2 ))
 ASSI {  349}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 89   and name HB2 ))
      2.500     0.800     0.800 peak   349 spectrum    2 weight  0.10000E+01 volume  0.31749E-02 ppm1      0.692 ppm2      1.892 CV     1
 OR {  349}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 89   and name HB1 ))
 ASSI {  350}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 20   and name HD1 ))
      4.800     2.900     1.200 peak   350 spectrum    2 weight  0.10000E+01 volume  0.18381E-03 ppm1      0.811 ppm2      2.866 CV     1
 OR {  350}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 20   and name HD2 ))
 ASSI {  352}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 89   and name HB1 ))
      3.900     1.900     1.900 peak   352 spectrum    2 weight  0.10000E+01 volume  0.21077E-03 ppm1      0.809 ppm2      1.901 CV     1
 OR {  352}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 89   and name HB2 ))
 ASSI {  353}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 20   and name HB2 ))
      2.700     0.900     0.900 peak   353 spectrum    2 weight  0.10000E+01 volume  0.56560E-02 ppm1      0.811 ppm2      1.620 CV     1
 OR {  353}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 20   and name HB1 ))
 ASSI {  355}
   (  segid "    " and resid 27   and name HD1%)
   (  segid "    " and resid 57   and name HB% )
      3.700     1.800     1.800 peak   355 spectrum    2 weight  0.10000E+01 volume  0.87130E-03 ppm1      0.807 ppm2      1.201 CV     1
 ASSI {  359}
   (( segid "    " and resid 46   and name HG11))
   (  segid "    " and resid 85   and name HG2%)
      3.700     1.700     1.700 peak   359 spectrum    2 weight  0.10000E+01 volume  0.30227E-03 ppm1      1.164 ppm2      0.907 CV     1
 OR {  359}
   (( segid "    " and resid 46   and name HG12))
   (  segid "    " and resid 85   and name HG2%)
 ASSI {  361}
   (( segid "    " and resid 46   and name HG11))
   (  segid "    " and resid 46   and name HG2%)
      2.700     0.900     0.900 peak   361 spectrum    2 weight  0.10000E+01 volume  0.28534E-02 ppm1      1.165 ppm2      0.676 CV     1
 OR {  361}
   (( segid "    " and resid 46   and name HG12))
   (  segid "    " and resid 46   and name HG2%)
 ASSI {  366}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 72   and name HA  ))
      3.000     1.100     1.100 peak   366 spectrum    2 weight  0.10000E+01 volume  0.23526E-02 ppm1      0.684 ppm2      4.256 CV     1
 ASSI {  367}
   (  segid "    " and resid 98   and name HD2%)
   (( segid "    " and resid 57   and name HA  ))
      2.300     2.300     3.700 peak   367 spectrum    2 weight  0.10000E+01 volume  0.17677E-02 ppm1      0.685 ppm2      3.961 CV     1
 ASSI {  369}
   (  segid "    " and resid 98   and name HD1%)
   (( segid "    " and resid 72   and name HA  ))
      4.800     2.900     1.200 peak   369 spectrum    2 weight  0.10000E+01 volume  0.39639E-03 ppm1      0.575 ppm2      4.251 CV     1
 ASSI {  373}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 100  and name HG  ))
      2.300     0.700     0.700 peak   373 spectrum    2 weight  0.10000E+01 volume  0.50813E-02 ppm1      0.526 ppm2      1.313 CV     1
 ASSI {  374}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 98   and name HB2 ))
      3.100     1.200     1.200 peak   374 spectrum    2 weight  0.10000E+01 volume  0.22930E-02 ppm1      0.525 ppm2      1.520 CV     1
 OR {  374}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 98   and name HB1 ))
 ASSI {  375}
   (( segid "    " and resid 106  and name HG  ))
   (  segid "    " and resid 106  and name HD1%)
      2.100     0.500     0.500 peak   375 spectrum    2 weight  0.10000E+01 volume  0.11268E-01 ppm1      1.471 ppm2      0.780 CV     1
 ASSI {  377}
   (( segid "    " and resid 107  and name HG  ))
   (( segid "    " and resid 107  and name HA  ))
      3.000     1.100     1.100 peak   377 spectrum    2 weight  0.10000E+01 volume  0.29588E-02 ppm1      1.479 ppm2      4.279 CV     1
 ASSI {  378}
   (( segid "    " and resid 106  and name HG  ))
   (( segid "    " and resid 106  and name HA  ))
      2.700     0.900     0.900 peak   378 spectrum    2 weight  0.10000E+01 volume  0.33057E-02 ppm1      1.460 ppm2      4.199 CV     1
 ASSI {  379}
   (  segid "    " and resid 100  and name HD1%)
   (  segid "    " and resid 16   and name HG1%)
      2.000     2.000     4.000 peak   379 spectrum    2 weight  0.10000E+01 volume  0.33007E-02 ppm1      0.532 ppm2      0.855 CV     1
 ASSI {  382}
   (( segid "    " and resid 104  and name HG  ))
   (( segid "    " and resid 104  and name HA  ))
      4.200     2.200     1.800 peak   382 spectrum    2 weight  0.10000E+01 volume  0.19583E-03 ppm1      1.342 ppm2      4.463 CV     1
 ASSI {  383}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 70   and name HA  ))
      3.900     1.900     1.900 peak   383 spectrum    2 weight  0.10000E+01 volume  0.50901E-03 ppm1      1.333 ppm2      4.372 CV     1
 OR {  383}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 70   and name HA  ))
 ASSI {  385}
   (( segid "    " and resid 51   and name HG  ))
   (( segid "    " and resid 51   and name HA  ))
      2.800     1.000     1.000 peak   385 spectrum    2 weight  0.10000E+01 volume  0.20730E-02 ppm1      1.339 ppm2      5.271 CV     1
 ASSI {  387}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 35   and name HA  ))
      2.700     0.900     0.900 peak   387 spectrum    2 weight  0.10000E+01 volume  0.49426E-02 ppm1      1.377 ppm2      4.085 CV     1
 OR {  387}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HA  ))
 ASSI {  388}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HD2 ))
      2.000     0.500     0.500 peak   388 spectrum    2 weight  0.10000E+01 volume  0.14594E-01 ppm1      1.376 ppm2      3.028 CV     1
 OR {  388}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 35   and name HD1 ))
 OR {  388}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HD1 ))
 OR {  388}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 35   and name HD2 ))
 ASSI {  390}
   (( segid "    " and resid 52   and name HG12))
   (( segid "    " and resid 52   and name HA  ))
      3.100     1.200     1.200 peak   390 spectrum    2 weight  0.10000E+01 volume  0.10543E-02 ppm1      1.122 ppm2      4.133 CV     1
 OR {  390}
   (( segid "    " and resid 52   and name HG11))
   (( segid "    " and resid 52   and name HA  ))
 ASSI {  393}
   (( segid "    " and resid 90   and name HG2 ))
   (( segid "    " and resid 87   and name HA  ))
      3.300     1.400     1.400 peak   393 spectrum    2 weight  0.10000E+01 volume  0.19136E-02 ppm1      1.636 ppm2      4.120 CV     1
 OR {  393}
   (( segid "    " and resid 90   and name HG1 ))
   (( segid "    " and resid 87   and name HA  ))
 ASSI {  400}
   (( segid "    " and resid 90   and name HG2 ))
   (  segid "    " and resid 86   and name HG1%)
      3.300     1.300     1.300 peak   400 spectrum    2 weight  0.10000E+01 volume  0.93776E-03 ppm1      1.514 ppm2      0.872 CV     1
 OR {  400}
   (( segid "    " and resid 90   and name HG1 ))
   (  segid "    " and resid 86   and name HG1%)
 ASSI {  405}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 105  and name HD1 ))
      2.300     0.600     0.600 peak   405 spectrum    2 weight  0.10000E+01 volume  0.60162E-02 ppm1      1.893 ppm2      3.514 CV     1
 OR {  405}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 105  and name HD2 ))
 OR {  405}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 105  and name HD1 ))
 OR {  405}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 105  and name HD2 ))
 ASSI {  406}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 105  and name HB1 ))
      2.100     0.500     0.500 peak   406 spectrum    2 weight  0.10000E+01 volume  0.11714E-01 ppm1      1.893 ppm2      2.124 CV     1
 OR {  406}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 105  and name HB2 ))
 OR {  406}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 105  and name HB1 ))
 OR {  406}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 105  and name HB2 ))
 ASSI {  407}
   (( segid "    " and resid 105  and name HG2 ))
   (  segid "    " and resid 107  and name HD2%)
      3.200     1.300     1.300 peak   407 spectrum    2 weight  0.10000E+01 volume  0.15484E-02 ppm1      1.888 ppm2      0.729 CV     1
 OR {  407}
   (( segid "    " and resid 105  and name HG1 ))
   (  segid "    " and resid 107  and name HD2%)
 ASSI {  411}
   (( segid "    " and resid 51   and name HG  ))
   (( segid "    " and resid 65   and name HA  ))
      3.500     1.500     1.500 peak   411 spectrum    2 weight  0.10000E+01 volume  0.47003E-03 ppm1      1.350 ppm2      3.783 CV     1
 ASSI {  414}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HA  ))
      3.000     1.200     1.200 peak   414 spectrum    2 weight  0.10000E+01 volume  0.13905E-02 ppm1      1.578 ppm2      4.019 CV     1
 OR {  414}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI {  415}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 71   and name HD1 ))
      2.200     0.600     0.600 peak   415 spectrum    2 weight  0.10000E+01 volume  0.59951E-02 ppm1      1.360 ppm2      2.918 CV     1
 OR {  415}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 71   and name HD2 ))
 OR {  415}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 71   and name HD1 ))
 OR {  415}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 71   and name HD2 ))
 ASSI {  416}
   (( segid "    " and resid 52   and name HG11))
   (  segid "    " and resid 52   and name HG2%)
      2.700     0.900     0.900 peak   416 spectrum    2 weight  0.10000E+01 volume  0.41285E-02 ppm1      1.396 ppm2      0.882 CV     1
 ASSI {  421}
   (( segid "    " and resid 53   and name HG1 ))
   (( segid "    " and resid 53   and name HA  ))
      3.000     1.100     1.100 peak   421 spectrum    2 weight  0.10000E+01 volume  0.29245E-02 ppm1      2.052 ppm2      4.123 CV     1
 OR {  421}
   (( segid "    " and resid 53   and name HG2 ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI {  422}
   (( segid "    " and resid 53   and name HG2 ))
   (  segid "    " and resid 52   and name HG2%)
      4.800     2.900     1.200 peak   422 spectrum    2 weight  0.10000E+01 volume  0.31397E-03 ppm1      2.054 ppm2      0.879 CV     1
 OR {  422}
   (( segid "    " and resid 53   and name HG1 ))
   (  segid "    " and resid 52   and name HG2%)
 ASSI {  424}
   (( segid "    " and resid 63   and name HG11))
   (  segid "    " and resid 57   and name HB% )
      4.100     2.100     1.900 peak   424 spectrum    2 weight  0.10000E+01 volume  0.51169E-03 ppm1      1.768 ppm2      1.191 CV     1
 OR {  424}
   (( segid "    " and resid 63   and name HG12))
   (  segid "    " and resid 57   and name HB% )
 ASSI {  425}
   (( segid "    " and resid 63   and name HG11))
   (  segid "    " and resid 16   and name HG1%)
      3.900     1.900     1.900 peak   425 spectrum    2 weight  0.10000E+01 volume  0.28437E-03 ppm1      1.762 ppm2      0.855 CV     1
 OR {  425}
   (( segid "    " and resid 63   and name HG12))
   (  segid "    " and resid 16   and name HG1%)
 ASSI {  426}
   (( segid "    " and resid 63   and name HG12))
   (  segid "    " and resid 63   and name HD1%)
      2.600     0.800     0.800 peak   426 spectrum    2 weight  0.10000E+01 volume  0.25557E-02 ppm1      1.759 ppm2      0.725 CV     1
 OR {  426}
   (( segid "    " and resid 63   and name HG11))
   (  segid "    " and resid 63   and name HD1%)
 ASSI {  429}
   (( segid "    " and resid 63   and name HG12))
   (  segid "    " and resid 100  and name HD1%)
      4.200     2.200     1.800 peak   429 spectrum    2 weight  0.10000E+01 volume  0.26454E-03 ppm1      1.758 ppm2      0.527 CV     1
 OR {  429}
   (( segid "    " and resid 63   and name HG11))
   (  segid "    " and resid 100  and name HD1%)
 ASSI {  430}
   (( segid "    " and resid 63   and name HG12))
   (  segid "    " and resid 63   and name HG2%)
      2.800     1.000     1.000 peak   430 spectrum    2 weight  0.10000E+01 volume  0.20941E-02 ppm1      1.763 ppm2      0.755 CV     1
 OR {  430}
   (( segid "    " and resid 63   and name HG11))
   (  segid "    " and resid 63   and name HG2%)
 ASSI {  432}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 69   and name HA  ))
      4.200     2.200     1.800 peak   432 spectrum    2 weight  0.10000E+01 volume  0.77768E-03 ppm1      0.675 ppm2      3.858 CV     1
 ASSI {  435}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 100  and name HG  ))
      2.200     0.600     0.600 peak   435 spectrum    2 weight  0.10000E+01 volume  0.53550E-02 ppm1      0.676 ppm2      1.315 CV     1
 ASSI {  436}
   (( segid "    " and resid 97   and name HG1 ))
   (( segid "    " and resid 97   and name HD2 ))
      2.700     0.900     0.900 peak   436 spectrum    2 weight  0.10000E+01 volume  0.21455E-02 ppm1      1.437 ppm2      3.078 CV     1
 OR {  436}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 97   and name HD1 ))
 OR {  436}
   (( segid "    " and resid 97   and name HG2 ))
   (( segid "    " and resid 97   and name HD2 ))
 OR {  436}
   (( segid "    " and resid 97   and name HG1 ))
   (( segid "    " and resid 97   and name HD1 ))
 ASSI {  440}
   (( segid "    " and resid 82   and name HB1 ))
   (  segid "    " and resid 46   and name HD1%)
      3.000     1.100     1.100 peak   440 spectrum    2 weight  0.10000E+01 volume  0.19472E-02 ppm1      2.006 ppm2      0.597 CV     1
 OR {  440}
   (( segid "    " and resid 82   and name HB2 ))
   (  segid "    " and resid 46   and name HD1%)
 ASSI {  441}
   (( segid "    " and resid 82   and name HB1 ))
   (  segid "    " and resid 31   and name HD1%)
      3.400     1.500     1.500 peak   441 spectrum    2 weight  0.10000E+01 volume  0.19791E-02 ppm1      2.010 ppm2      0.669 CV     1
 OR {  441}
   (( segid "    " and resid 82   and name HB2 ))
   (  segid "    " and resid 31   and name HD1%)
 ASSI {  442}
   (( segid "    " and resid 82   and name HB2 ))
   (  segid "    " and resid 86   and name HG2%)
      4.600     2.700     1.400 peak   442 spectrum    2 weight  0.10000E+01 volume  0.29538E-03 ppm1      2.007 ppm2      1.022 CV     1
 OR {  442}
   (( segid "    " and resid 82   and name HB1 ))
   (  segid "    " and resid 86   and name HG2%)
 ASSI {  444}
   (( segid "    " and resid 82   and name HB2 ))
   (  segid "    " and resid 81   and name HB% )
      5.200     3.300     0.800 peak   444 spectrum    2 weight  0.10000E+01 volume  0.20748E-03 ppm1      2.003 ppm2      1.407 CV     1
 OR {  444}
   (( segid "    " and resid 82   and name HB1 ))
   (  segid "    " and resid 81   and name HB% )
 ASSI {  447}
   (( segid "    " and resid 101  and name HG12))
   (  segid "    " and resid 13   and name HD2%)
      2.700     0.900     0.900 peak   447 spectrum    2 weight  0.10000E+01 volume  0.30979E-02 ppm1      0.836 ppm2      0.680 CV     1
 OR {  447}
   (( segid "    " and resid 101  and name HG11))
   (  segid "    " and resid 13   and name HD2%)
 ASSI {  448}
   (( segid "    " and resid 101  and name HG11))
   (  segid "    " and resid 70   and name HD2%)
      4.100     2.100     1.900 peak   448 spectrum    2 weight  0.10000E+01 volume  0.89218E-03 ppm1      0.845 ppm2      0.563 CV     1
 OR {  448}
   (( segid "    " and resid 101  and name HG12))
   (  segid "    " and resid 70   and name HD2%)
 ASSI {  449}
   (( segid "    " and resid 101  and name HG12))
   (  segid "    " and resid 70   and name HD1%)
      4.100     2.100     1.900 peak   449 spectrum    2 weight  0.10000E+01 volume  0.10498E-02 ppm1      0.852 ppm2      0.519 CV     1
 OR {  449}
   (( segid "    " and resid 101  and name HG11))
   (  segid "    " and resid 70   and name HD1%)
 ASSI {  452}
   (( segid "    " and resid 101  and name HG12))
   (( segid "    " and resid 101  and name HB  ))
      2.900     1.000     1.000 peak   452 spectrum    2 weight  0.10000E+01 volume  0.11738E-02 ppm1      0.839 ppm2      1.490 CV     1
 OR {  452}
   (( segid "    " and resid 101  and name HG11))
   (( segid "    " and resid 101  and name HB  ))
 ASSI {  454}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HG2 ))
      2.000     0.500     0.500 peak   454 spectrum    2 weight  0.10000E+01 volume  0.16418E-01 ppm1      1.915 ppm2      2.239 CV     1
 OR {  454}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 37   and name HG1 ))
 OR {  454}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 37   and name HG2 ))
 OR {  454}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HG1 ))
 ASSI {  457}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 37   and name HA  ))
      2.400     0.700     0.700 peak   457 spectrum    2 weight  0.10000E+01 volume  0.51074E-02 ppm1      2.088 ppm2      4.189 CV     1
 OR {  457}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HA  ))
 ASSI {  462}
   (( segid "    " and resid 78   and name HB1 ))
   (  segid "    " and resid 70   and name HD2%)
      3.800     1.800     1.800 peak   462 spectrum    2 weight  0.10000E+01 volume  0.95493E-03 ppm1      2.111 ppm2      0.567 CV     1
 OR {  462}
   (( segid "    " and resid 78   and name HB2 ))
   (  segid "    " and resid 70   and name HD2%)
 ASSI {  463}
   (( segid "    " and resid 49   and name HD2 ))
   (( segid "    " and resid 49   and name HE2 ))
      2.100     0.500     0.500 peak   463 spectrum    2 weight  0.10000E+01 volume  0.10856E-01 ppm1      1.571 ppm2      2.868 CV     1
 OR {  463}
   (( segid "    " and resid 49   and name HD1 ))
   (( segid "    " and resid 49   and name HE1 ))
 OR {  463}
   (( segid "    " and resid 49   and name HD2 ))
   (( segid "    " and resid 49   and name HE1 ))
 OR {  463}
   (( segid "    " and resid 49   and name HD1 ))
   (( segid "    " and resid 49   and name HE2 ))
 ASSI {  465}
   (( segid "    " and resid 65   and name HG2 ))
   (( segid "    " and resid 65   and name HD2 ))
      2.800     1.000     1.000 peak   465 spectrum    2 weight  0.10000E+01 volume  0.16448E-02 ppm1      1.580 ppm2      3.667 CV     1
 OR {  465}
   (( segid "    " and resid 65   and name HG1 ))
   (( segid "    " and resid 65   and name HD1 ))
 OR {  465}
   (( segid "    " and resid 65   and name HG1 ))
   (( segid "    " and resid 65   and name HD2 ))
 OR {  465}
   (( segid "    " and resid 65   and name HG2 ))
   (( segid "    " and resid 65   and name HD1 ))
 ASSI {  469}
   (( segid "    " and resid 65   and name HG1 ))
   (  segid "    " and resid 51   and name HD2%)
      2.800     2.800     3.200 peak   469 spectrum    2 weight  0.10000E+01 volume  0.46535E-03 ppm1      1.579 ppm2      0.572 CV     1
 OR {  469}
   (( segid "    " and resid 65   and name HG2 ))
   (  segid "    " and resid 51   and name HD2%)
 ASSI {  471}
   (( segid "    " and resid 49   and name HD2 ))
   (( segid "    " and resid 50   and name HB1 ))
      2.800     2.800     3.200 peak   471 spectrum    2 weight  0.10000E+01 volume  0.44970E-03 ppm1      1.495 ppm2      3.771 CV     1
 ASSI {  478}
   (( segid "    " and resid 87   and name HB2 ))
   (  segid "    " and resid 88   and name HG2%)
      4.600     2.600     1.400 peak   478 spectrum    2 weight  0.10000E+01 volume  0.20108E-03 ppm1      2.032 ppm2      0.961 CV     1
 OR {  478}
   (( segid "    " and resid 87   and name HB1 ))
   (  segid "    " and resid 88   and name HG2%)
 ASSI {  479}
   (( segid "    " and resid 68   and name HD2 ))
   (( segid "    " and resid 68   and name HE2 ))
      2.300     0.700     0.700 peak   479 spectrum    2 weight  0.10000E+01 volume  0.51555E-02 ppm1      1.354 ppm2      2.646 CV     1
 OR {  479}
   (( segid "    " and resid 68   and name HD1 ))
   (( segid "    " and resid 68   and name HE1 ))
 OR {  479}
   (( segid "    " and resid 68   and name HD1 ))
   (( segid "    " and resid 68   and name HE2 ))
 OR {  479}
   (( segid "    " and resid 68   and name HD2 ))
   (( segid "    " and resid 68   and name HE1 ))
 ASSI {  481}
   (( segid "    " and resid 68   and name HD1 ))
   (( segid "    " and resid 68   and name HG1 ))
      2.200     0.600     0.600 peak   481 spectrum    2 weight  0.10000E+01 volume  0.75847E-02 ppm1      1.352 ppm2      0.766 CV     1
 OR {  481}
   (( segid "    " and resid 68   and name HD2 ))
   (( segid "    " and resid 68   and name HG2 ))
 OR {  481}
   (( segid "    " and resid 68   and name HD1 ))
   (( segid "    " and resid 68   and name HG2 ))
 OR {  481}
   (( segid "    " and resid 68   and name HD2 ))
   (( segid "    " and resid 68   and name HG1 ))
 ASSI {  482}
   (( segid "    " and resid 68   and name HD2 ))
   (  segid "    " and resid 70   and name HD2%)
      3.000     1.200     1.200 peak   482 spectrum    2 weight  0.10000E+01 volume  0.17520E-02 ppm1      1.330 ppm2      0.564 CV     1
 OR {  482}
   (( segid "    " and resid 68   and name HD1 ))
   (  segid "    " and resid 70   and name HD2%)
 ASSI {  483}
   (( segid "    " and resid 68   and name HD2 ))
   (  segid "    " and resid 101  and name HD1%)
      3.600     1.600     1.600 peak   483 spectrum    2 weight  0.10000E+01 volume  0.89168E-03 ppm1      1.331 ppm2      0.426 CV     1
 OR {  483}
   (( segid "    " and resid 68   and name HD1 ))
   (  segid "    " and resid 101  and name HD1%)
 ASSI {  484}
   (( segid "    " and resid 68   and name HD2 ))
   (  segid "    " and resid 70   and name HD1%)
      4.200     2.200     1.800 peak   484 spectrum    2 weight  0.10000E+01 volume  0.60051E-03 ppm1      1.325 ppm2      0.514 CV     1
 OR {  484}
   (( segid "    " and resid 68   and name HD1 ))
   (  segid "    " and resid 70   and name HD1%)
 ASSI {  488}
   (( segid "    " and resid 3    and name HB1 ))
   (  segid "    " and resid 99   and name HD2%)
      3.500     1.600     1.600 peak   488 spectrum    2 weight  0.10000E+01 volume  0.26499E-03 ppm1      3.061 ppm2      0.672 CV     1
 OR {  488}
   (( segid "    " and resid 3    and name HB1 ))
   (  segid "    " and resid 99   and name HD1%)
 ASSI {  493}
   (( segid "    " and resid 21   and name HB1 ))
   (( segid "    " and resid 22   and name HG1 ))
      3.700     1.700     1.700 peak   493 spectrum    2 weight  0.10000E+01 volume  0.69094E-03 ppm1      1.925 ppm2      1.320 CV     1
 OR {  493}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 22   and name HG2 ))
 OR {  493}
   (( segid "    " and resid 21   and name HB1 ))
   (( segid "    " and resid 22   and name HG2 ))
 ASSI {  494}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HA  ))
      2.400     0.700     0.700 peak   494 spectrum    2 weight  0.10000E+01 volume  0.49500E-02 ppm1      1.948 ppm2      4.214 CV     1
 OR {  494}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 42   and name HA  ))
 ASSI {  496}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 87   and name HA  ))
      2.400     0.700     0.700 peak   496 spectrum    2 weight  0.10000E+01 volume  0.41591E-02 ppm1      1.843 ppm2      4.122 CV     1
 OR {  496}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 87   and name HA  ))
 ASSI {  500}
   (( segid "    " and resid 90   and name HB2 ))
   (  segid "    " and resid 86   and name HG1%)
      4.700     2.800     1.300 peak   500 spectrum    2 weight  0.10000E+01 volume  0.38224E-03 ppm1      1.840 ppm2      0.876 CV     1
 OR {  500}
   (( segid "    " and resid 90   and name HB1 ))
   (  segid "    " and resid 86   and name HG1%)
 ASSI {  501}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 42   and name HG1 ))
      2.100     0.500     0.500 peak   501 spectrum    2 weight  0.10000E+01 volume  0.13712E-01 ppm1      1.820 ppm2      2.142 CV     1
 OR {  501}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HG2 ))
 OR {  501}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HG1 ))
 OR {  501}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 42   and name HG2 ))
 ASSI {  502}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 90   and name HG2 ))
      2.000     0.500     0.500 peak   502 spectrum    2 weight  0.10000E+01 volume  0.14065E-01 ppm1      1.835 ppm2      1.651 CV     1
 OR {  502}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 90   and name HG1 ))
 OR {  502}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 90   and name HG1 ))
 OR {  502}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 90   and name HG2 ))
 ASSI {  504}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 82   and name HA  ))
      3.100     1.200     1.200 peak   504 spectrum    2 weight  0.10000E+01 volume  0.77228E-03 ppm1      1.980 ppm2      3.575 CV     1
 ASSI {  507}
   (( segid "    " and resid 85   and name HB  ))
   (  segid "    " and resid 85   and name HG1%)
      2.400     0.700     0.700 peak   507 spectrum    2 weight  0.10000E+01 volume  0.36805E-02 ppm1      1.982 ppm2      0.731 CV     1
 ASSI {  510}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 35   and name HA  ))
      2.400     0.700     0.700 peak   510 spectrum    2 weight  0.10000E+01 volume  0.48368E-02 ppm1      1.542 ppm2      4.081 CV     1
 OR {  510}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HA  ))
 ASSI {  511}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 35   and name HD1 ))
      2.600     0.800     0.800 peak   511 spectrum    2 weight  0.10000E+01 volume  0.52104E-02 ppm1      1.551 ppm2      3.035 CV     1
 OR {  511}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 35   and name HD2 ))
 OR {  511}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HD1 ))
 OR {  511}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HD2 ))
 ASSI {  512}
   (( segid "    " and resid 103  and name HB1 ))
   (( segid "    " and resid 103  and name HD2 ))
      2.600     0.800     0.800 peak   512 spectrum    2 weight  0.10000E+01 volume  0.38816E-02 ppm1      1.669 ppm2      2.997 CV     1
 OR {  512}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 103  and name HD2 ))
 OR {  512}
   (( segid "    " and resid 103  and name HB1 ))
   (( segid "    " and resid 103  and name HD1 ))
 OR {  512}
   (( segid "    " and resid 103  and name HB2 ))
   (( segid "    " and resid 103  and name HD1 ))
 ASSI {  513}
   (( segid "    " and resid 85   and name HB  ))
   (  segid "    " and resid 86   and name HG2%)
      4.600     2.700     1.400 peak   513 spectrum    2 weight  0.10000E+01 volume  0.13843E-03 ppm1      1.987 ppm2      1.014 CV     1
 ASSI {  517}
   (( segid "    " and resid 77   and name HB  ))
   (  segid "    " and resid 72   and name HG2%)
      5.000     3.100     1.000 peak   517 spectrum    2 weight  0.10000E+01 volume  0.33050E-03 ppm1      2.345 ppm2      0.559 CV     1
 ASSI {  518}
   (( segid "    " and resid 77   and name HB  ))
   (  segid "    " and resid 69   and name HG2%)
      5.900     4.400     0.100 peak   518 spectrum    2 weight  0.10000E+01 volume  0.91771E-04 ppm1      2.353 ppm2      0.511 CV     1
 ASSI {  519}
   (( segid "    " and resid 77   and name HB  ))
   (  segid "    " and resid 75   and name HG1%)
      4.600     2.600     1.400 peak   519 spectrum    2 weight  0.10000E+01 volume  0.42395E-03 ppm1      2.353 ppm2      0.675 CV     1
 ASSI {  520}
   (( segid "    " and resid 77   and name HB  ))
   (  segid "    " and resid 88   and name HG2%)
      6.000     5.000     0.000 peak   520 spectrum    2 weight  0.10000E+01 volume  0.82346E-04 ppm1      2.362 ppm2      0.960 CV     1
 ASSI {  523}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 97   and name HD1 ))
      2.900     1.100     1.100 peak   523 spectrum    2 weight  0.10000E+01 volume  0.15998E-02 ppm1      1.690 ppm2      3.074 CV     1
 OR {  523}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 97   and name HD1 ))
 OR {  523}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 97   and name HD2 ))
 OR {  523}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 97   and name HD2 ))
 ASSI {  525}
   (( segid "    " and resid 108  and name HB1 ))
   (( segid "    " and resid 108  and name HA  ))
      2.900     1.000     1.000 peak   525 spectrum    2 weight  0.10000E+01 volume  0.22360E-02 ppm1      1.751 ppm2      3.994 CV     1
 OR {  525}
   (( segid "    " and resid 108  and name HB2 ))
   (( segid "    " and resid 108  and name HA  ))
 ASSI {  527}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HA  ))
      2.500     0.800     0.800 peak   527 spectrum    2 weight  0.10000E+01 volume  0.34106E-02 ppm1      2.226 ppm2      4.126 CV     1
 OR {  527}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI {  528}
   (( segid "    " and resid 86   and name HB  ))
   (( segid "    " and resid 83   and name HA  ))
      2.700     0.900     0.900 peak   528 spectrum    2 weight  0.10000E+01 volume  0.19997E-02 ppm1      2.112 ppm2      3.942 CV     1
 ASSI {  529}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 65   and name HA  ))
      2.400     0.700     0.700 peak   529 spectrum    2 weight  0.10000E+01 volume  0.40726E-02 ppm1      2.143 ppm2      3.790 CV     1
 OR {  529}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 65   and name HA  ))
 ASSI {  530}
   (( segid "    " and resid 86   and name HB  ))
   (( segid "    " and resid 86   and name HA  ))
      2.700     0.900     0.900 peak   530 spectrum    2 weight  0.10000E+01 volume  0.29555E-02 ppm1      2.145 ppm2      3.412 CV     1
 ASSI {  531}
   (( segid "    " and resid 88   and name HB  ))
   (( segid "    " and resid 88   and name HA  ))
      2.700     0.900     0.900 peak   531 spectrum    2 weight  0.10000E+01 volume  0.27502E-02 ppm1      2.169 ppm2      3.568 CV     1
 ASSI {  536}
   (( segid "    " and resid 48   and name HB  ))
   (  segid "    " and resid 48   and name HG2%)
      2.000     0.500     0.500 peak   536 spectrum    2 weight  0.10000E+01 volume  0.82816E-02 ppm1      2.129 ppm2      0.683 CV     1
 ASSI {  539}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 65   and name HG1 ))
      2.700     0.900     0.900 peak   539 spectrum    2 weight  0.10000E+01 volume  0.19703E-02 ppm1      2.147 ppm2      1.577 CV     1
 OR {  539}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 65   and name HG2 ))
 OR {  539}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 65   and name HG1 ))
 OR {  539}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 65   and name HG2 ))
 ASSI {  541}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HB2 ))
      2.200     0.600     0.600 peak   541 spectrum    2 weight  0.10000E+01 volume  0.87567E-02 ppm1      2.339 ppm2      1.937 CV     1
 OR {  541}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 34   and name HB1 ))
 OR {  541}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HB1 ))
 OR {  541}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 34   and name HB2 ))
 ASSI {  542}
   (( segid "    " and resid 34   and name HG2 ))
   (( segid "    " and resid 34   and name HB2 ))
      2.300     0.600     0.600 peak   542 spectrum    2 weight  0.10000E+01 volume  0.73498E-02 ppm1      2.338 ppm2      1.792 CV     1
 OR {  542}
   (( segid "    " and resid 34   and name HG1 ))
   (( segid "    " and resid 34   and name HB2 ))
 ASSI {  543}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 105  and name HD2 ))
      3.200     1.300     1.300 peak   543 spectrum    2 weight  0.10000E+01 volume  0.19026E-02 ppm1      2.129 ppm2      3.672 CV     1
 OR {  543}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 105  and name HD1 ))
 OR {  543}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 105  and name HD2 ))
 OR {  543}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 105  and name HD1 ))
 ASSI {  544}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 105  and name HA  ))
      2.400     0.700     0.700 peak   544 spectrum    2 weight  0.10000E+01 volume  0.45807E-02 ppm1      2.126 ppm2      4.274 CV     1
 OR {  544}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 105  and name HA  ))
 ASSI {  549}
   (( segid "    " and resid 105  and name HB1 ))
   (  segid "    " and resid 107  and name HD2%)
      3.600     1.600     1.600 peak   549 spectrum    2 weight  0.10000E+01 volume  0.49441E-03 ppm1      1.727 ppm2      0.731 CV     1
 OR {  549}
   (( segid "    " and resid 105  and name HB2 ))
   (  segid "    " and resid 107  and name HD2%)
 ASSI {  555}
   (( segid "    " and resid 75   and name HB  ))
   (( segid "    " and resid 75   and name HA  ))
      2.900     1.000     1.000 peak   555 spectrum    2 weight  0.10000E+01 volume  0.17205E-02 ppm1      2.184 ppm2      3.824 CV     1
 ASSI {  557}
   (( segid "    " and resid 75   and name HB  ))
   (  segid "    " and resid 77   and name HG1%)
      2.800     2.800     3.200 peak   557 spectrum    2 weight  0.10000E+01 volume  0.39211E-02 ppm1      2.182 ppm2      0.754 CV     1
 ASSI {  559}
   (( segid "    " and resid 96   and name HB  ))
   (( segid "    " and resid 96   and name HA  ))
      2.800     1.000     1.000 peak   559 spectrum    2 weight  0.10000E+01 volume  0.13323E-02 ppm1      1.970 ppm2      4.310 CV     1
 ASSI {  561}
   (( segid "    " and resid 96   and name HB  ))
   (  segid "    " and resid 96   and name HG2%)
      2.200     0.600     0.600 peak   561 spectrum    2 weight  0.10000E+01 volume  0.53081E-02 ppm1      1.967 ppm2      0.871 CV     1
 ASSI {  562}
   (( segid "    " and resid 96   and name HB  ))
   (  segid "    " and resid 27   and name HD1%)
      3.400     1.500     1.500 peak   562 spectrum    2 weight  0.10000E+01 volume  0.12872E-02 ppm1      1.967 ppm2      0.814 CV     1
 ASSI {  563}
   (( segid "    " and resid 96   and name HB  ))
   (  segid "    " and resid 96   and name HG1%)
      2.200     0.600     0.600 peak   563 spectrum    2 weight  0.10000E+01 volume  0.57678E-02 ppm1      1.967 ppm2      0.751 CV     1
 ASSI {  564}
   (( segid "    " and resid 96   and name HB  ))
   (  segid "    " and resid 98   and name HD2%)
      3.000     1.100     1.100 peak   564 spectrum    2 weight  0.10000E+01 volume  0.14098E-02 ppm1      1.961 ppm2      0.685 CV     1
 ASSI {  565}
   (( segid "    " and resid 96   and name HB  ))
   (  segid "    " and resid 98   and name HD1%)
      3.700     3.700     2.300 peak   565 spectrum    2 weight  0.10000E+01 volume  0.97787E-03 ppm1      1.963 ppm2      0.582 CV     1
 ASSI {  566}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 83   and name HA  ))
      3.900     1.900     1.900 peak   566 spectrum    2 weight  0.10000E+01 volume  0.32163E-03 ppm1      2.166 ppm2      3.948 CV     1
 OR {  566}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 83   and name HA  ))
 ASSI {  567}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HA  ))
      2.500     0.800     0.800 peak   567 spectrum    2 weight  0.10000E+01 volume  0.36210E-02 ppm1      2.159 ppm2      3.577 CV     1
 OR {  567}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 82   and name HA  ))
 ASSI {  568}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 31   and name HG12))
      3.500     1.500     1.500 peak   568 spectrum    2 weight  0.10000E+01 volume  0.53314E-03 ppm1      2.161 ppm2      1.216 CV     1
 OR {  568}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 31   and name HG11))
 OR {  568}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 31   and name HG11))
 ASSI {  569}
   (( segid "    " and resid 82   and name HG1 ))
   (  segid "    " and resid 86   and name HG2%)
      2.700     0.900     0.900 peak   569 spectrum    2 weight  0.10000E+01 volume  0.21594E-02 ppm1      2.161 ppm2      1.022 CV     1
 OR {  569}
   (( segid "    " and resid 82   and name HG2 ))
   (  segid "    " and resid 86   and name HG2%)
 ASSI {  574}
   (( segid "    " and resid 80   and name HG2 ))
   (  segid "    " and resid 80   and name HE% )
      2.500     0.800     0.800 peak   574 spectrum    2 weight  0.10000E+01 volume  0.51895E-02 ppm1      2.473 ppm2      1.893 CV     1
 OR {  574}
   (( segid "    " and resid 80   and name HG1 ))
   (  segid "    " and resid 80   and name HE% )
 ASSI {  576}
   (( segid "    " and resid 80   and name HG2 ))
   (  segid "    " and resid 85   and name HG2%)
      4.800     2.800     1.200 peak   576 spectrum    2 weight  0.10000E+01 volume  0.34546E-03 ppm1      2.398 ppm2      0.902 CV     1
 OR {  576}
   (( segid "    " and resid 80   and name HG1 ))
   (  segid "    " and resid 85   and name HG2%)
 ASSI {  578}
   (( segid "    " and resid 72   and name HB  ))
   (  segid "    " and resid 75   and name HG1%)
      3.500     1.500     1.500 peak   578 spectrum    2 weight  0.10000E+01 volume  0.13642E-02 ppm1      1.664 ppm2      0.683 CV     1
 ASSI {  581}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 82   and name HB2 ))
      1.800     0.400     0.400 peak   581 spectrum    2 weight  0.10000E+01 volume  0.20566E-01 ppm1      2.156 ppm2      2.013 CV     1
 OR {  581}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HB1 ))
 OR {  581}
   (( segid "    " and resid 82   and name HG1 ))
   (( segid "    " and resid 82   and name HB1 ))
 OR {  581}
   (( segid "    " and resid 82   and name HG2 ))
   (( segid "    " and resid 82   and name HB2 ))
 ASSI {  584}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HD2 ))
      2.200     0.600     0.600 peak   584 spectrum    2 weight  0.10000E+01 volume  0.10547E-01 ppm1      1.734 ppm2      1.570 CV     1
 OR {  584}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HD1 ))
 OR {  584}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 22   and name HD2 ))
 OR {  584}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 22   and name HD1 ))
 ASSI {  589}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HE2 ))
      3.900     1.900     1.900 peak   589 spectrum    2 weight  0.10000E+01 volume  0.31647E-03 ppm1      1.492 ppm2      2.847 CV     1
 OR {  589}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HE1 ))
 OR {  589}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HE1 ))
 OR {  589}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HE2 ))
 ASSI {  590}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 30   and name HB1 ))
      4.300     2.300     1.700 peak   590 spectrum    2 weight  0.10000E+01 volume  0.29433E-03 ppm1      1.501 ppm2      3.757 CV     1
 OR {  590}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 30   and name HB1 ))
 OR {  590}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 30   and name HB2 ))
 ASSI {  594}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HG1 ))
      2.800     1.000     1.000 peak   594 spectrum    2 weight  0.10000E+01 volume  0.15795E-02 ppm1      1.404 ppm2      1.214 CV     1
 OR {  594}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HG2 ))
 OR {  594}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HG1 ))
 OR {  594}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HG2 ))
 ASSI {  595}
   (( segid "    " and resid 37   and name HG1 ))
   (( segid "    " and resid 37   and name HA  ))
      2.600     0.900     0.900 peak   595 spectrum    2 weight  0.10000E+01 volume  0.46185E-02 ppm1      2.241 ppm2      4.189 CV     1
 OR {  595}
   (( segid "    " and resid 37   and name HG2 ))
   (( segid "    " and resid 37   and name HA  ))
 ASSI {  600}
   (( segid "    " and resid 78   and name HG1 ))
   (  segid "    " and resid 70   and name HD2%)
      3.200     1.300     1.300 peak   600 spectrum    2 weight  0.10000E+01 volume  0.18682E-02 ppm1      2.230 ppm2      0.564 CV     1
 OR {  600}
   (( segid "    " and resid 78   and name HG2 ))
   (  segid "    " and resid 70   and name HD2%)
 ASSI {  602}
   (( segid "    " and resid 78   and name HG1 ))
   (( segid "    " and resid 78   and name HB2 ))
      1.800     0.400     0.400 peak   602 spectrum    2 weight  0.10000E+01 volume  0.33079E-01 ppm1      2.236 ppm2      2.097 CV     1
 OR {  602}
   (( segid "    " and resid 78   and name HG1 ))
   (( segid "    " and resid 78   and name HB1 ))
 OR {  602}
   (( segid "    " and resid 78   and name HG2 ))
   (( segid "    " and resid 78   and name HB2 ))
 OR {  602}
   (( segid "    " and resid 78   and name HG2 ))
   (( segid "    " and resid 78   and name HB1 ))
 ASSI {  605}
   (( segid "    " and resid 37   and name HG1 ))
   (( segid "    " and resid 37   and name HB1 ))
      2.200     0.600     0.600 peak   605 spectrum    2 weight  0.10000E+01 volume  0.11814E-01 ppm1      2.237 ppm2      1.914 CV     1
 OR {  605}
   (( segid "    " and resid 37   and name HG2 ))
   (( segid "    " and resid 37   and name HB1 ))
 ASSI {  606}
   (( segid "    " and resid 78   and name HG2 ))
   (  segid "    " and resid 77   and name HG2%)
      4.300     2.300     1.700 peak   606 spectrum    2 weight  0.10000E+01 volume  0.21523E-03 ppm1      2.397 ppm2      0.425 CV     1
 OR {  606}
   (( segid "    " and resid 78   and name HG1 ))
   (  segid "    " and resid 77   and name HG2%)
 ASSI {  613}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 80   and name HG2 ))
      3.400     1.400     1.400 peak   613 spectrum    2 weight  0.10000E+01 volume  0.55823E-03 ppm1      1.831 ppm2      2.481 CV     1
 OR {  613}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 80   and name HG1 ))
 OR {  613}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 80   and name HG2 ))
 OR {  613}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 80   and name HG1 ))
 ASSI {  614}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 34   and name HG1 ))
      2.400     0.700     0.700 peak   614 spectrum    2 weight  0.10000E+01 volume  0.42547E-02 ppm1      1.934 ppm2      2.340 CV     1
 OR {  614}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 34   and name HG2 ))
 ASSI {  618}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HD1 ))
      2.400     0.700     0.700 peak   618 spectrum    2 weight  0.10000E+01 volume  0.36310E-02 ppm1      1.686 ppm2      1.426 CV     1
 OR {  618}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 68   and name HD2 ))
 OR {  618}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HD2 ))
 OR {  618}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 68   and name HD1 ))
 ASSI {  619}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 68   and name HG2 ))
      2.600     0.900     0.900 peak   619 spectrum    2 weight  0.10000E+01 volume  0.22512E-02 ppm1      1.691 ppm2      0.768 CV     1
 OR {  619}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HG1 ))
 OR {  619}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HG2 ))
 OR {  619}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 68   and name HG1 ))
 ASSI {  621}
   (( segid "    " and resid 87   and name HG1 ))
   (( segid "    " and resid 87   and name HA  ))
      2.700     0.900     0.900 peak   621 spectrum    2 weight  0.10000E+01 volume  0.28727E-02 ppm1      2.279 ppm2      4.127 CV     1
 OR {  621}
   (( segid "    " and resid 87   and name HG2 ))
   (( segid "    " and resid 87   and name HA  ))
 ASSI {  622}
   (( segid "    " and resid 87   and name HG2 ))
   (( segid "    " and resid 87   and name HB2 ))
      1.800     0.400     0.400 peak   622 spectrum    2 weight  0.10000E+01 volume  0.34408E-01 ppm1      2.277 ppm2      2.056 CV     1
 OR {  622}
   (( segid "    " and resid 87   and name HG1 ))
   (( segid "    " and resid 87   and name HB1 ))
 OR {  622}
   (( segid "    " and resid 87   and name HG2 ))
   (( segid "    " and resid 87   and name HB1 ))
 OR {  622}
   (( segid "    " and resid 87   and name HG1 ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI {  623}
   (( segid "    " and resid 87   and name HG1 ))
   (( segid "    " and resid 90   and name HB2 ))
      3.800     1.800     1.800 peak   623 spectrum    2 weight  0.10000E+01 volume  0.12232E-02 ppm1      2.275 ppm2      1.836 CV     1
 OR {  623}
   (( segid "    " and resid 87   and name HG2 ))
   (( segid "    " and resid 90   and name HB2 ))
 OR {  623}
   (( segid "    " and resid 87   and name HG2 ))
   (( segid "    " and resid 90   and name HB1 ))
 ASSI {  624}
   (( segid "    " and resid 87   and name HG1 ))
   (  segid "    " and resid 86   and name HG1%)
      4.400     2.400     1.600 peak   624 spectrum    2 weight  0.10000E+01 volume  0.41394E-03 ppm1      2.279 ppm2      0.877 CV     1
 OR {  624}
   (( segid "    " and resid 87   and name HG2 ))
   (  segid "    " and resid 86   and name HG1%)
 ASSI {  625}
   (( segid "    " and resid 87   and name HG2 ))
   (  segid "    " and resid 88   and name HG2%)
      4.600     2.700     1.400 peak   625 spectrum    2 weight  0.10000E+01 volume  0.36044E-03 ppm1      2.280 ppm2      0.959 CV     1
 OR {  625}
   (( segid "    " and resid 87   and name HG1 ))
   (  segid "    " and resid 88   and name HG2%)
 ASSI {  627}
   (( segid "    " and resid 87   and name HG2 ))
   (  segid "    " and resid 86   and name HG2%)
      3.600     1.600     1.600 peak   627 spectrum    2 weight  0.10000E+01 volume  0.10863E-03 ppm1      2.282 ppm2      1.021 CV     1
 OR {  627}
   (( segid "    " and resid 87   and name HG1 ))
   (  segid "    " and resid 86   and name HG2%)
 ASSI {  628}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 65   and name HG2 ))
      2.900     1.000     1.000 peak   628 spectrum    2 weight  0.10000E+01 volume  0.66811E-02 ppm1      2.068 ppm2      1.567 CV     1
 OR {  628}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 65   and name HG2 ))
 OR {  628}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 65   and name HG1 ))
 ASSI {  629}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 71   and name HD2 ))
      2.800     1.000     1.000 peak   629 spectrum    2 weight  0.10000E+01 volume  0.22349E-02 ppm1      1.543 ppm2      2.919 CV     1
 OR {  629}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HD1 ))
 OR {  629}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HD2 ))
 OR {  629}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 71   and name HD1 ))
 ASSI {  630}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HG2 ))
      2.400     0.700     0.700 peak   630 spectrum    2 weight  0.10000E+01 volume  0.39413E-02 ppm1      1.537 ppm2      1.219 CV     1
 OR {  630}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 71   and name HG1 ))
 OR {  630}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 71   and name HG2 ))
 OR {  630}
   (( segid "    " and resid 71   and name HB2 ))
   (( segid "    " and resid 71   and name HG1 ))
 ASSI {  631}
   (( segid "    " and resid 71   and name HB1 ))
   (  segid "    " and resid 99   and name HD2%)
      3.300     1.400     1.400 peak   631 spectrum    2 weight  0.10000E+01 volume  0.11452E-02 ppm1      1.574 ppm2      0.674 CV     1
 OR {  631}
   (( segid "    " and resid 71   and name HB2 ))
   (  segid "    " and resid 99   and name HD2%)
 ASSI {  633}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 46   and name HG12))
      2.700     0.900     0.900 peak   633 spectrum    2 weight  0.10000E+01 volume  0.18880E-02 ppm1      1.980 ppm2      1.544 CV     1
 OR {  633}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 46   and name HG11))
 ASSI {  637}
   (( segid "    " and resid 46   and name HB  ))
   (  segid "    " and resid 69   and name HG2%)
      4.000     2.000     2.000 peak   637 spectrum    2 weight  0.10000E+01 volume  0.51438E-03 ppm1      1.963 ppm2      0.510 CV     1
 ASSI {  639}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 21   and name HA  ))
      3.000     1.100     1.100 peak   639 spectrum    2 weight  0.10000E+01 volume  0.25267E-02 ppm1      2.275 ppm2      4.046 CV     1
 OR {  639}
   (( segid "    " and resid 21   and name HG1 ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  640}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 22   and name HE1 ))
      4.500     2.600     1.500 peak   640 spectrum    2 weight  0.10000E+01 volume  0.19773E-03 ppm1      2.212 ppm2      2.869 CV     1
 OR {  640}
   (( segid "    " and resid 21   and name HG1 ))
   (( segid "    " and resid 22   and name HE1 ))
 OR {  640}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 22   and name HE2 ))
 OR {  640}
   (( segid "    " and resid 21   and name HG1 ))
   (( segid "    " and resid 22   and name HE2 ))
 ASSI {  641}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 22   and name HD1 ))
      4.400     2.400     1.600 peak   641 spectrum    2 weight  0.10000E+01 volume  0.21594E-03 ppm1      2.282 ppm2      1.576 CV     1
 OR {  641}
   (( segid "    " and resid 21   and name HG1 ))
   (( segid "    " and resid 22   and name HD1 ))
 OR {  641}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 22   and name HD2 ))
 OR {  641}
   (( segid "    " and resid 21   and name HG1 ))
   (( segid "    " and resid 22   and name HD2 ))
 ASSI {  644}
   (( segid "    " and resid 21   and name HG1 ))
   (( segid "    " and resid 22   and name HG1 ))
      3.700     1.700     1.700 peak   644 spectrum    2 weight  0.10000E+01 volume  0.58260E-03 ppm1      2.180 ppm2      1.320 CV     1
 OR {  644}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 22   and name HG2 ))
 OR {  644}
   (( segid "    " and resid 21   and name HG1 ))
   (( segid "    " and resid 22   and name HG2 ))
 ASSI {  645}
   (( segid "    " and resid 42   and name HG2 ))
   (( segid "    " and resid 42   and name HA  ))
      2.400     0.700     0.700 peak   645 spectrum    2 weight  0.10000E+01 volume  0.63052E-02 ppm1      2.144 ppm2      4.213 CV     1
 OR {  645}
   (( segid "    " and resid 42   and name HG1 ))
   (( segid "    " and resid 42   and name HA  ))
 ASSI {  646}
   (( segid "    " and resid 42   and name HG1 ))
   (( segid "    " and resid 41   and name HA1 ))
      3.400     1.400     1.400 peak   646 spectrum    2 weight  0.10000E+01 volume  0.60569E-03 ppm1      2.147 ppm2      3.790 CV     1
 OR {  646}
   (( segid "    " and resid 42   and name HG2 ))
   (( segid "    " and resid 41   and name HA1 ))
 ASSI {  647}
   (( segid "    " and resid 42   and name HG1 ))
   (( segid "    " and resid 42   and name HB1 ))
      2.100     0.500     0.500 peak   647 spectrum    2 weight  0.10000E+01 volume  0.14811E-01 ppm1      2.140 ppm2      1.817 CV     1
 OR {  647}
   (( segid "    " and resid 42   and name HG2 ))
   (( segid "    " and resid 42   and name HB1 ))
 ASSI {  649}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 21   and name HB1 ))
      2.200     0.600     0.600 peak   649 spectrum    2 weight  0.10000E+01 volume  0.11186E-01 ppm1      2.271 ppm2      2.020 CV     1
 OR {  649}
   (( segid "    " and resid 21   and name HG1 ))
   (( segid "    " and resid 21   and name HB2 ))
 OR {  649}
   (( segid "    " and resid 21   and name HG1 ))
   (( segid "    " and resid 21   and name HB1 ))
 OR {  649}
   (( segid "    " and resid 21   and name HG2 ))
   (( segid "    " and resid 21   and name HB2 ))
 ASSI {  651}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 69   and name HB  ))
      4.200     2.200     1.800 peak   651 spectrum    2 weight  0.10000E+01 volume  0.12870E-03 ppm1      1.977 ppm2      1.323 CV     1
 ASSI {  654}
   (( segid "    " and resid 16   and name HB  ))
   (  segid "    " and resid 16   and name HG2%)
      2.200     0.600     0.600 peak   654 spectrum    2 weight  0.10000E+01 volume  0.60964E-02 ppm1      1.839 ppm2      0.754 CV     1
 ASSI {  655}
   (( segid "    " and resid 16   and name HB  ))
   (  segid "    " and resid 98   and name HD2%)
      4.000     2.000     2.000 peak   655 spectrum    2 weight  0.10000E+01 volume  0.13516E-02 ppm1      1.842 ppm2      0.685 CV     1
 ASSI {  656}
   (( segid "    " and resid 16   and name HB  ))
   (  segid "    " and resid 98   and name HD1%)
      3.000     1.100     1.100 peak   656 spectrum    2 weight  0.10000E+01 volume  0.11516E-02 ppm1      1.840 ppm2      0.586 CV     1
 ASSI {  657}
   (( segid "    " and resid 16   and name HB  ))
   (  segid "    " and resid 100  and name HD1%)
      3.500     1.600     1.600 peak   657 spectrum    2 weight  0.10000E+01 volume  0.88571E-03 ppm1      1.840 ppm2      0.526 CV     1
 ASSI {  660}
   (( segid "    " and resid 17   and name HG1 ))
   (( segid "    " and resid 17   and name HB2 ))
      2.400     0.700     0.700 peak   660 spectrum    2 weight  0.10000E+01 volume  0.57632E-02 ppm1      1.914 ppm2      1.677 CV     1
 OR {  660}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 17   and name HB1 ))
 OR {  660}
   (( segid "    " and resid 17   and name HG1 ))
   (( segid "    " and resid 17   and name HB1 ))
 OR {  660}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 17   and name HB2 ))
 ASSI {  662}
   (( segid "    " and resid 17   and name HG1 ))
   (( segid "    " and resid 98   and name HG  ))
      3.700     3.700     2.300 peak   662 spectrum    2 weight  0.10000E+01 volume  0.11347E-02 ppm1      1.914 ppm2      1.450 CV     1
 OR {  662}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 98   and name HG  ))
 ASSI {  664}
   (( segid "    " and resid 17   and name HG1 ))
   (( segid "    " and resid 97   and name HG1 ))
      3.300     1.300     1.300 peak   664 spectrum    2 weight  0.10000E+01 volume  0.88338E-03 ppm1      1.793 ppm2      1.325 CV     1
 OR {  664}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 97   and name HG1 ))
 OR {  664}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 97   and name HG2 ))
 ASSI {  666}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 66   and name HA  ))
      2.800     1.000     1.000 peak   666 spectrum    2 weight  0.10000E+01 volume  0.23563E-02 ppm1      3.364 ppm2      4.186 CV     1
 OR {  666}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 66   and name HA  ))
 ASSI {  668}
   (( segid "    " and resid 52   and name HB  ))
   (( segid "    " and resid 52   and name HG11))
      2.800     1.000     1.000 peak   668 spectrum    2 weight  0.10000E+01 volume  0.13010E-02 ppm1      1.588 ppm2      1.394 CV     1
 OR {  668}
   (( segid "    " and resid 52   and name HB  ))
   (( segid "    " and resid 52   and name HG12))
 ASSI {  672}
   (( segid "    " and resid 52   and name HB  ))
   (( segid "    " and resid 26   and name HB2 ))
      3.100     3.100     2.900 peak   672 spectrum    2 weight  0.10000E+01 volume  0.27029E-03 ppm1      1.596 ppm2      3.694 CV     1
 OR {  672}
   (( segid "    " and resid 52   and name HB  ))
   (( segid "    " and resid 26   and name HB1 ))
 ASSI {  673}
   (( segid "    " and resid 69   and name HB  ))
   (  segid "    " and resid 69   and name HG2%)
      2.200     0.600     0.600 peak   673 spectrum    2 weight  0.10000E+01 volume  0.52453E-02 ppm1      1.319 ppm2      0.512 CV     1
 ASSI {  674}
   (( segid "    " and resid 69   and name HB  ))
   (  segid "    " and resid 46   and name HG2%)
      2.400     0.700     0.700 peak   674 spectrum    2 weight  0.10000E+01 volume  0.35269E-02 ppm1      1.320 ppm2      0.680 CV     1
 ASSI {  680}
   (( segid "    " and resid 5    and name HB2 ))
   (  segid "    " and resid 13   and name HD2%)
      4.300     2.300     1.700 peak   680 spectrum    2 weight  0.10000E+01 volume  0.30451E-03 ppm1      2.904 ppm2      0.677 CV     1
 OR {  680}
   (( segid "    " and resid 5    and name HB1 ))
   (  segid "    " and resid 13   and name HD2%)
 ASSI {  683}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 63   and name HA  ))
      3.500     1.600     1.600 peak   683 spectrum    2 weight  0.10000E+01 volume  0.51883E-03 ppm1      1.402 ppm2      4.279 CV     1
 ASSI {  684}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 63   and name HG11))
      3.300     1.300     1.300 peak   684 spectrum    2 weight  0.10000E+01 volume  0.65843E-03 ppm1      1.394 ppm2      1.764 CV     1
 OR {  684}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 63   and name HG12))
 ASSI {  685}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 57   and name HB% )
      3.100     1.200     1.200 peak   685 spectrum    2 weight  0.10000E+01 volume  0.12019E-02 ppm1      1.398 ppm2      1.197 CV     1
 ASSI {  687}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 51   and name HD2%)
      2.900     1.000     1.000 peak   687 spectrum    2 weight  0.10000E+01 volume  0.28632E-02 ppm1      1.384 ppm2      0.569 CV     1
 ASSI {  688}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 51   and name HD1%)
      2.700     0.900     0.900 peak   688 spectrum    2 weight  0.10000E+01 volume  0.25008E-02 ppm1      1.390 ppm2      0.645 CV     1
 ASSI {  690}
   (( segid "    " and resid 29   and name HB  ))
   (( segid "    " and resid 29   and name HG12))
      3.000     1.100     1.100 peak   690 spectrum    2 weight  0.10000E+01 volume  0.10321E-02 ppm1      1.551 ppm2      1.307 CV     1
 OR {  690}
   (( segid "    " and resid 29   and name HB  ))
   (( segid "    " and resid 29   and name HG11))
 ASSI {  691}
   (( segid "    " and resid 29   and name HB  ))
   (  segid "    " and resid 89   and name HD1%)
      2.600     0.800     0.800 peak   691 spectrum    2 weight  0.10000E+01 volume  0.25201E-02 ppm1      1.564 ppm2      0.686 CV     1
 ASSI {  694}
   (( segid "    " and resid 29   and name HB  ))
   (  segid "    " and resid 57   and name HB% )
      4.700     2.700     1.300 peak   694 spectrum    2 weight  0.10000E+01 volume  0.32023E-03 ppm1      1.553 ppm2      1.196 CV     1
 ASSI {  695}
   (( segid "    " and resid 29   and name HB  ))
   (  segid "    " and resid 27   and name HD1%)
      5.300     3.500     0.700 peak   695 spectrum    2 weight  0.10000E+01 volume  0.10341E-03 ppm1      1.560 ppm2      0.814 CV     1
 ASSI {  697}
   (( segid "    " and resid 23   and name HB2 ))
   (  segid "    " and resid 24   and name HG2%)
      3.900     1.900     1.900 peak   697 spectrum    2 weight  0.10000E+01 volume  0.71709E-03 ppm1      2.685 ppm2      1.129 CV     1
 OR {  697}
   (( segid "    " and resid 23   and name HB1 ))
   (  segid "    " and resid 24   and name HG2%)
 ASSI {  702}
   (( segid "    " and resid 84   and name HB2 ))
   (  segid "    " and resid 81   and name HB% )
      4.300     2.300     1.700 peak   702 spectrum    2 weight  0.10000E+01 volume  0.23729E-03 ppm1      2.687 ppm2      1.409 CV     1
 OR {  702}
   (( segid "    " and resid 84   and name HB1 ))
   (  segid "    " and resid 81   and name HB% )
 ASSI {  703}
   (( segid "    " and resid 104  and name HB2 ))
   (  segid "    " and resid 104  and name HD1%)
      2.400     0.700     0.700 peak   703 spectrum    2 weight  0.10000E+01 volume  0.43755E-02 ppm1      1.319 ppm2      0.714 CV     1
 OR {  703}
   (( segid "    " and resid 104  and name HB1 ))
   (  segid "    " and resid 104  and name HD1%)
 ASSI {  705}
   (( segid "    " and resid 36   and name HB1 ))
   (  segid "    " and resid 43   and name HB% )
      2.900     2.900     3.100 peak   705 spectrum    2 weight  0.10000E+01 volume  0.43334E-03 ppm1      2.598 ppm2      1.322 CV     1
 OR {  705}
   (( segid "    " and resid 36   and name HB2 ))
   (  segid "    " and resid 43   and name HB% )
 ASSI {  706}
   (( segid "    " and resid 7    and name HB2 ))
   (  segid "    " and resid 8    and name HB% )
      5.000     3.100     1.000 peak   706 spectrum    2 weight  0.10000E+01 volume  0.18416E-03 ppm1      2.611 ppm2      1.285 CV     1
 OR {  706}
   (( segid "    " and resid 7    and name HB1 ))
   (  segid "    " and resid 8    and name HB% )
 ASSI {  708}
   (( segid "    " and resid 67   and name HB1 ))
   (  segid "    " and resid 100  and name HD2%)
      3.000     1.100     1.100 peak   708 spectrum    2 weight  0.10000E+01 volume  0.13770E-02 ppm1      2.690 ppm2      0.680 CV     1
 OR {  708}
   (( segid "    " and resid 67   and name HB2 ))
   (  segid "    " and resid 100  and name HD2%)
 ASSI {  714}
   (( segid "    " and resid 49   and name HE2 ))
   (( segid "    " and resid 32   and name HA  ))
      2.300     2.300     3.700 peak   714 spectrum    2 weight  0.10000E+01 volume  0.17951E-02 ppm1      2.871 ppm2      4.522 CV     1
 OR {  714}
   (( segid "    " and resid 49   and name HE1 ))
   (( segid "    " and resid 32   and name HA  ))
 ASSI {  715}
   (( segid "    " and resid 49   and name HE1 ))
   (( segid "    " and resid 49   and name HA  ))
      4.100     2.100     1.900 peak   715 spectrum    2 weight  0.10000E+01 volume  0.83028E-03 ppm1      2.860 ppm2      4.280 CV     1
 OR {  715}
   (( segid "    " and resid 49   and name HE2 ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI {  717}
   (( segid "    " and resid 22   and name HE2 ))
   (( segid "    " and resid 22   and name HB2 ))
      3.600     1.700     1.700 peak   717 spectrum    2 weight  0.10000E+01 volume  0.14204E-02 ppm1      2.870 ppm2      1.735 CV     1
 OR {  717}
   (( segid "    " and resid 22   and name HE1 ))
   (( segid "    " and resid 22   and name HB2 ))
 OR {  717}
   (( segid "    " and resid 22   and name HE1 ))
   (( segid "    " and resid 22   and name HB1 ))
 OR {  717}
   (( segid "    " and resid 22   and name HE2 ))
   (( segid "    " and resid 22   and name HB1 ))
 ASSI {  718}
   (( segid "    " and resid 22   and name HE2 ))
   (( segid "    " and resid 22   and name HD2 ))
      2.000     0.500     0.500 peak   718 spectrum    2 weight  0.10000E+01 volume  0.15063E-01 ppm1      2.864 ppm2      1.574 CV     1
 OR {  718}
   (( segid "    " and resid 22   and name HE1 ))
   (( segid "    " and resid 22   and name HD1 ))
 OR {  718}
   (( segid "    " and resid 22   and name HE1 ))
   (( segid "    " and resid 22   and name HD2 ))
 OR {  718}
   (( segid "    " and resid 22   and name HE2 ))
   (( segid "    " and resid 22   and name HD1 ))
 ASSI {  719}
   (( segid "    " and resid 22   and name HE2 ))
   (( segid "    " and resid 22   and name HG2 ))
      2.200     0.600     0.600 peak   719 spectrum    2 weight  0.10000E+01 volume  0.10653E-01 ppm1      2.867 ppm2      1.319 CV     1
 OR {  719}
   (( segid "    " and resid 22   and name HE1 ))
   (( segid "    " and resid 22   and name HG2 ))
 OR {  719}
   (( segid "    " and resid 22   and name HE1 ))
   (( segid "    " and resid 22   and name HG1 ))
 OR {  719}
   (( segid "    " and resid 22   and name HE2 ))
   (( segid "    " and resid 22   and name HG1 ))
 ASSI {  720}
   (( segid "    " and resid 49   and name HE2 ))
   (( segid "    " and resid 49   and name HG2 ))
      2.500     0.800     0.800 peak   720 spectrum    2 weight  0.10000E+01 volume  0.56536E-02 ppm1      2.859 ppm2      1.219 CV     1
 OR {  720}
   (( segid "    " and resid 49   and name HE1 ))
   (( segid "    " and resid 49   and name HG1 ))
 OR {  720}
   (( segid "    " and resid 49   and name HE1 ))
   (( segid "    " and resid 49   and name HG2 ))
 OR {  720}
   (( segid "    " and resid 49   and name HE2 ))
   (( segid "    " and resid 49   and name HG1 ))
 ASSI {  728}
   (( segid "    " and resid 89   and name HB1 ))
   (( segid "    " and resid 89   and name HA  ))
      2.900     1.000     1.000 peak   728 spectrum    2 weight  0.10000E+01 volume  0.13568E-02 ppm1      1.418 ppm2      3.786 CV     1
 OR {  728}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 89   and name HA  ))
 ASSI {  731}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 89   and name HG  ))
      2.900     1.000     1.000 peak   731 spectrum    2 weight  0.10000E+01 volume  0.12641E-02 ppm1      1.881 ppm2      1.584 CV     1
 OR {  731}
   (( segid "    " and resid 89   and name HB1 ))
   (( segid "    " and resid 89   and name HG  ))
 ASSI {  735}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 86   and name HA  ))
      4.400     2.400     1.600 peak   735 spectrum    2 weight  0.10000E+01 volume  0.12515E-03 ppm1      1.890 ppm2      3.419 CV     1
 OR {  735}
   (( segid "    " and resid 89   and name HB1 ))
   (( segid "    " and resid 86   and name HA  ))
 ASSI {  736}
   (( segid "    " and resid 89   and name HB1 ))
   (  segid "    " and resid 72   and name HG1%)
      4.300     2.300     1.700 peak   736 spectrum    2 weight  0.10000E+01 volume  0.60709E-03 ppm1      1.406 ppm2      0.567 CV     1
 OR {  736}
   (( segid "    " and resid 89   and name HB2 ))
   (  segid "    " and resid 72   and name HG1%)
 ASSI {  740}
   (( segid "    " and resid 106  and name HB1 ))
   (  segid "    " and resid 106  and name HD1%)
      2.000     0.500     0.500 peak   740 spectrum    2 weight  0.10000E+01 volume  0.19971E-01 ppm1      1.471 ppm2      0.780 CV     1
 OR {  740}
   (( segid "    " and resid 106  and name HB2 ))
   (  segid "    " and resid 106  and name HD1%)
 ASSI {  741}
   (( segid "    " and resid 106  and name HB2 ))
   (  segid "    " and resid 106  and name HD2%)
      2.100     0.600     0.600 peak   741 spectrum    2 weight  0.10000E+01 volume  0.16530E-01 ppm1      1.474 ppm2      0.726 CV     1
 OR {  741}
   (( segid "    " and resid 106  and name HB1 ))
   (  segid "    " and resid 106  and name HD2%)
 ASSI {  742}
   (( segid "    " and resid 101  and name HB  ))
   (  segid "    " and resid 70   and name HD1%)
      2.700     0.900     0.900 peak   742 spectrum    2 weight  0.10000E+01 volume  0.13500E-02 ppm1      1.482 ppm2      0.515 CV     1
 ASSI {  743}
   (( segid "    " and resid 101  and name HB  ))
   (  segid "    " and resid 101  and name HD1%)
      2.700     0.900     0.900 peak   743 spectrum    2 weight  0.10000E+01 volume  0.19993E-02 ppm1      1.485 ppm2      0.429 CV     1
 ASSI {  745}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 45   and name HA2 ))
      2.900     1.000     1.000 peak   745 spectrum    2 weight  0.10000E+01 volume  0.10411E-02 ppm1      2.641 ppm2      4.031 CV     1
 OR {  745}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 45   and name HA1 ))
 ASSI {  747}
   (( segid "    " and resid 68   and name HE2 ))
   (( segid "    " and resid 68   and name HB1 ))
      4.600     2.600     1.400 peak   747 spectrum    2 weight  0.10000E+01 volume  0.47053E-03 ppm1      2.639 ppm2      1.704 CV     1
 OR {  747}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 68   and name HB2 ))
 OR {  747}
   (( segid "    " and resid 68   and name HE2 ))
   (( segid "    " and resid 68   and name HB2 ))
 OR {  747}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 68   and name HB1 ))
 ASSI {  750}
   (( segid "    " and resid 68   and name HE2 ))
   (( segid "    " and resid 68   and name HG2 ))
      2.200     0.600     0.600 peak   750 spectrum    2 weight  0.10000E+01 volume  0.68231E-02 ppm1      2.644 ppm2      0.766 CV     1
 OR {  750}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 68   and name HG1 ))
 OR {  750}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 68   and name HG2 ))
 OR {  750}
   (( segid "    " and resid 68   and name HE2 ))
   (( segid "    " and resid 68   and name HG1 ))
 ASSI {  751}
   (( segid "    " and resid 68   and name HE2 ))
   (  segid "    " and resid 70   and name HD2%)
      2.800     0.900     0.900 peak   751 spectrum    2 weight  0.10000E+01 volume  0.22626E-02 ppm1      2.643 ppm2      0.565 CV     1
 OR {  751}
   (( segid "    " and resid 68   and name HE1 ))
   (  segid "    " and resid 70   and name HD2%)
 ASSI {  753}
   (( segid "    " and resid 68   and name HE2 ))
   (  segid "    " and resid 101  and name HD1%)
      4.300     2.300     1.700 peak   753 spectrum    2 weight  0.10000E+01 volume  0.51536E-03 ppm1      2.641 ppm2      0.427 CV     1
 OR {  753}
   (( segid "    " and resid 68   and name HE1 ))
   (  segid "    " and resid 101  and name HD1%)
 ASSI {  759}
   (( segid "    " and resid 62   and name HD1 ))
   (  segid "    " and resid 16   and name HG2%)
      3.900     1.900     1.900 peak   759 spectrum    2 weight  0.10000E+01 volume  0.41820E-03 ppm1      3.011 ppm2      0.765 CV     1
 ASSI {  763}
   (( segid "    " and resid 90   and name HD1 ))
   (( segid "    " and resid 90   and name HG1 ))
      1.900     0.500     0.500 peak   763 spectrum    2 weight  0.10000E+01 volume  0.15550E-01 ppm1      3.046 ppm2      1.519 CV     1
 OR {  763}
   (( segid "    " and resid 90   and name HD2 ))
   (( segid "    " and resid 90   and name HG1 ))
 OR {  763}
   (( segid "    " and resid 90   and name HD1 ))
   (( segid "    " and resid 90   and name HG2 ))
 OR {  763}
   (( segid "    " and resid 90   and name HD2 ))
   (( segid "    " and resid 90   and name HG2 ))
 ASSI {  765}
   (( segid "    " and resid 90   and name HD2 ))
   (( segid "    " and resid 90   and name HB1 ))
      2.300     0.700     0.700 peak   765 spectrum    2 weight  0.10000E+01 volume  0.68449E-02 ppm1      3.058 ppm2      1.838 CV     1
 OR {  765}
   (( segid "    " and resid 90   and name HD2 ))
   (( segid "    " and resid 90   and name HB2 ))
 OR {  765}
   (( segid "    " and resid 90   and name HD1 ))
   (( segid "    " and resid 90   and name HB1 ))
 OR {  765}
   (( segid "    " and resid 90   and name HD1 ))
   (( segid "    " and resid 90   and name HB2 ))
 ASSI {  766}
   (( segid "    " and resid 103  and name HD2 ))
   (( segid "    " and resid 103  and name HA  ))
      3.500     1.600     1.600 peak   766 spectrum    2 weight  0.10000E+01 volume  0.17683E-02 ppm1      3.002 ppm2      4.224 CV     1
 OR {  766}
   (( segid "    " and resid 103  and name HD1 ))
   (( segid "    " and resid 103  and name HA  ))
 ASSI {  767}
   (( segid "    " and resid 35   and name HD1 ))
   (( segid "    " and resid 35   and name HA  ))
      3.100     1.200     1.200 peak   767 spectrum    2 weight  0.10000E+01 volume  0.15317E-02 ppm1      3.036 ppm2      4.082 CV     1
 OR {  767}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 35   and name HA  ))
 ASSI {  768}
   (( segid "    " and resid 90   and name HD2 ))
   (( segid "    " and resid 87   and name HA  ))
      4.600     2.700     1.400 peak   768 spectrum    2 weight  0.10000E+01 volume  0.35808E-03 ppm1      3.142 ppm2      4.125 CV     1
 OR {  768}
   (( segid "    " and resid 90   and name HD1 ))
   (( segid "    " and resid 87   and name HA  ))
 ASSI {  769}
   (( segid "    " and resid 90   and name HD2 ))
   (( segid "    " and resid 90   and name HA  ))
      4.400     2.400     1.600 peak   769 spectrum    2 weight  0.10000E+01 volume  0.58094E-03 ppm1      3.151 ppm2      3.956 CV     1
 OR {  769}
   (( segid "    " and resid 90   and name HD1 ))
   (( segid "    " and resid 90   and name HA  ))
 ASSI {  775}
   (( segid "    " and resid 90   and name HD1 ))
   (  segid "    " and resid 86   and name HG1%)
      3.600     1.600     1.600 peak   775 spectrum    2 weight  0.10000E+01 volume  0.61168E-03 ppm1      3.054 ppm2      0.875 CV     1
 OR {  775}
   (( segid "    " and resid 90   and name HD2 ))
   (  segid "    " and resid 86   and name HG1%)
 ASSI {  778}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 20   and name HB2 ))
      3.800     1.800     1.800 peak   778 spectrum    2 weight  0.10000E+01 volume  0.28256E-02 ppm1      1.457 ppm2      1.614 CV     1
 ASSI {  779}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 20   and name HB2 ))
      3.800     1.800     1.800 peak   779 spectrum    2 weight  0.10000E+01 volume  0.35813E-02 ppm1      1.717 ppm2      1.619 CV     1
 OR {  779}
   (( segid "    " and resid 27   and name HB1 ))
   (( segid "    " and resid 20   and name HB2 ))
 OR {  779}
   (( segid "    " and resid 27   and name HB1 ))
   (( segid "    " and resid 20   and name HB1 ))
 ASSI {  783}
   (( segid "    " and resid 27   and name HB1 ))
   (  segid "    " and resid 89   and name HD2%)
      3.600     1.700     1.700 peak   783 spectrum    2 weight  0.10000E+01 volume  0.86447E-03 ppm1      1.459 ppm2      0.648 CV     1
 OR {  783}
   (( segid "    " and resid 27   and name HB2 ))
   (  segid "    " and resid 89   and name HD2%)
 ASSI {  786}
   (( segid "    " and resid 27   and name HB1 ))
   (  segid "    " and resid 29   and name HG2%)
      4.700     2.700     1.300 peak   786 spectrum    2 weight  0.10000E+01 volume  0.42435E-03 ppm1      1.451 ppm2      0.594 CV     1
 OR {  786}
   (( segid "    " and resid 27   and name HB2 ))
   (  segid "    " and resid 29   and name HG2%)
 ASSI {  789}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 51   and name HG  ))
      2.900     1.000     1.000 peak   789 spectrum    2 weight  0.10000E+01 volume  0.14438E-02 ppm1      0.940 ppm2      1.363 CV     1
 OR {  789}
   (( segid "    " and resid 51   and name HB1 ))
   (( segid "    " and resid 51   and name HG  ))
 ASSI {  793}
   (( segid "    " and resid 51   and name HB2 ))
   (  segid "    " and resid 51   and name HD1%)
      2.800     1.000     1.000 peak   793 spectrum    2 weight  0.10000E+01 volume  0.19015E-02 ppm1      1.590 ppm2      0.646 CV     1
 OR {  793}
   (( segid "    " and resid 51   and name HB1 ))
   (  segid "    " and resid 51   and name HD1%)
 ASSI {  799}
   (( segid "    " and resid 70   and name HB1 ))
   (  segid "    " and resid 70   and name HD2%)
      3.000     1.100     1.100 peak   799 spectrum    2 weight  0.10000E+01 volume  0.15243E-02 ppm1      1.332 ppm2      0.565 CV     1
 OR {  799}
   (( segid "    " and resid 70   and name HB2 ))
   (  segid "    " and resid 70   and name HD2%)
 ASSI {  802}
   (( segid "    " and resid 70   and name HB2 ))
   (  segid "    " and resid 99   and name HD2%)
      3.600     1.700     1.700 peak   802 spectrum    2 weight  0.10000E+01 volume  0.59385E-03 ppm1      1.248 ppm2      0.647 CV     1
 OR {  802}
   (( segid "    " and resid 70   and name HB1 ))
   (  segid "    " and resid 99   and name HD2%)
 ASSI {  803}
   (( segid "    " and resid 20   and name HD1 ))
   (( segid "    " and resid 27   and name HA  ))
      5.000     3.200     1.000 peak   803 spectrum    2 weight  0.10000E+01 volume  0.12074E-03 ppm1      2.876 ppm2      4.110 CV     1
 OR {  803}
   (( segid "    " and resid 20   and name HD2 ))
   (( segid "    " and resid 27   and name HA  ))
 ASSI {  807}
   (( segid "    " and resid 20   and name HD2 ))
   (( segid "    " and resid 20   and name HG2 ))
      1.900     0.400     0.400 peak   807 spectrum    2 weight  0.10000E+01 volume  0.16819E-01 ppm1      2.883 ppm2      1.399 CV     1
 OR {  807}
   (( segid "    " and resid 20   and name HD1 ))
   (( segid "    " and resid 20   and name HG1 ))
 OR {  807}
   (( segid "    " and resid 20   and name HD2 ))
   (( segid "    " and resid 20   and name HG1 ))
 OR {  807}
   (( segid "    " and resid 20   and name HD1 ))
   (( segid "    " and resid 20   and name HG2 ))
 ASSI {  808}
   (( segid "    " and resid 20   and name HD1 ))
   (( segid "    " and resid 20   and name HB2 ))
      2.300     0.700     0.700 peak   808 spectrum    2 weight  0.10000E+01 volume  0.66737E-02 ppm1      2.883 ppm2      1.622 CV     1
 OR {  808}
   (( segid "    " and resid 20   and name HD1 ))
   (( segid "    " and resid 20   and name HB1 ))
 OR {  808}
   (( segid "    " and resid 20   and name HD2 ))
   (( segid "    " and resid 20   and name HB2 ))
 OR {  808}
   (( segid "    " and resid 20   and name HD2 ))
   (( segid "    " and resid 20   and name HB1 ))
 ASSI {  809}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 62   and name HG1 ))
      2.300     0.700     0.700 peak   809 spectrum    2 weight  0.10000E+01 volume  0.54037E-02 ppm1      3.274 ppm2      1.569 CV     1
 OR {  809}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HG2 ))
 OR {  809}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HG1 ))
 OR {  809}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 62   and name HG2 ))
 ASSI {  812}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 62   and name HA  ))
      5.300     3.500     0.700 peak   812 spectrum    2 weight  0.10000E+01 volume  0.13461E-03 ppm1      3.275 ppm2      4.012 CV     1
 OR {  812}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI {  813}
   (( segid "    " and resid 71   and name HD2 ))
   (  segid "    " and resid 99   and name HD1%)
      3.900     1.900     1.900 peak   813 spectrum    2 weight  0.10000E+01 volume  0.14330E-02 ppm1      2.916 ppm2      0.680 CV     1
 OR {  813}
   (( segid "    " and resid 71   and name HD1 ))
   (  segid "    " and resid 99   and name HD1%)
 ASSI {  819}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 62   and name HB1 ))
      2.800     1.000     1.000 peak   819 spectrum    2 weight  0.10000E+01 volume  0.29034E-02 ppm1      3.031 ppm2      1.568 CV     1
 OR {  819}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HB2 ))
 OR {  819}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HB1 ))
 OR {  819}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI {  822}
   (( segid "    " and resid 71   and name HD1 ))
   (  segid "    " and resid 70   and name HD2%)
      5.600     3.900     0.400 peak   822 spectrum    2 weight  0.10000E+01 volume  0.94280E-04 ppm1      2.918 ppm2      0.558 CV     1
 OR {  822}
   (( segid "    " and resid 71   and name HD2 ))
   (  segid "    " and resid 70   and name HD2%)
 ASSI {  824}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 76   and name HB1 ))
      4.500     2.600     1.500 peak   824 spectrum    2 weight  0.10000E+01 volume  0.19822E-03 ppm1      2.909 ppm2      2.687 CV     1
 OR {  824}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 76   and name HB2 ))
 OR {  824}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 76   and name HB1 ))
 OR {  824}
   (( segid "    " and resid 71   and name HD2 ))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI {  827}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 13   and name HG  ))
      2.300     0.600     0.600 peak   827 spectrum    2 weight  0.10000E+01 volume  0.64578E-02 ppm1      1.556 ppm2      1.379 CV     1
 OR {  827}
   (( segid "    " and resid 13   and name HB1 ))
   (( segid "    " and resid 13   and name HG  ))
 ASSI {  831}
   (( segid "    " and resid 13   and name HB1 ))
   (  segid "    " and resid 101  and name HD1%)
      5.200     3.300     0.800 peak   831 spectrum    2 weight  0.10000E+01 volume  0.28439E-03 ppm1      1.356 ppm2      0.429 CV     1
 OR {  831}
   (( segid "    " and resid 13   and name HB2 ))
   (  segid "    " and resid 101  and name HD1%)
 ASSI {  834}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name HG  ))
      2.900     1.000     1.000 peak   834 spectrum    2 weight  0.10000E+01 volume  0.10562E-02 ppm1      1.118 ppm2      1.390 CV     1
 OR {  834}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 18   and name HG  ))
 ASSI {  836}
   (( segid "    " and resid 54   and name HA2 ))
   (  segid "    " and resid 59   and name HD2%)
      3.400     1.400     1.400 peak   836 spectrum    2 weight  0.10000E+01 volume  0.82027E-03 ppm1      4.067 ppm2      0.779 CV     1
 OR {  836}
   (( segid "    " and resid 54   and name HA1 ))
   (  segid "    " and resid 59   and name HD2%)
 ASSI {  838}
   (( segid "    " and resid 45   and name HA2 ))
   (( segid "    " and resid 68   and name HE1 ))
      3.800     1.800     1.800 peak   838 spectrum    2 weight  0.10000E+01 volume  0.39615E-03 ppm1      4.036 ppm2      2.650 CV     1
 OR {  838}
   (( segid "    " and resid 45   and name HA1 ))
   (( segid "    " and resid 68   and name HE1 ))
 OR {  838}
   (( segid "    " and resid 45   and name HA1 ))
   (( segid "    " and resid 68   and name HE2 ))
 ASSI {  839}
   (( segid "    " and resid 33   and name HA2 ))
   (  segid "    " and resid 46   and name HD1%)
      3.300     1.400     1.400 peak   839 spectrum    2 weight  0.10000E+01 volume  0.75619E-03 ppm1      3.715 ppm2      0.601 CV     1
 OR {  839}
   (( segid "    " and resid 33   and name HA1 ))
   (  segid "    " and resid 46   and name HD1%)
 ASSI {  840}
   (( segid "    " and resid 54   and name HA2 ))
   (  segid "    " and resid 58   and name HB% )
      5.400     3.700     0.600 peak   840 spectrum    2 weight  0.10000E+01 volume  0.17274E-03 ppm1      4.069 ppm2      1.369 CV     1
 OR {  840}
   (( segid "    " and resid 54   and name HA1 ))
   (  segid "    " and resid 58   and name HB% )
 ASSI {  845}
   (( segid "    " and resid 54   and name HA2 ))
   (  segid "    " and resid 59   and name HD1%)
      3.600     1.600     1.600 peak   845 spectrum    2 weight  0.10000E+01 volume  0.75583E-03 ppm1      3.472 ppm2      0.712 CV     1
 OR {  845}
   (( segid "    " and resid 54   and name HA1 ))
   (  segid "    " and resid 59   and name HD1%)
 ASSI {  847}
   (( segid "    " and resid 28   and name HA2 ))
   (  segid "    " and resid 52   and name HG2%)
      4.500     2.600     1.500 peak   847 spectrum    2 weight  0.10000E+01 volume  0.55771E-03 ppm1      3.445 ppm2      0.884 CV     1
 OR {  847}
   (( segid "    " and resid 28   and name HA1 ))
   (  segid "    " and resid 52   and name HG2%)
 ASSI {  848}
   (( segid "    " and resid 28   and name HA2 ))
   (( segid "    " and resid 52   and name HB  ))
      2.600     0.900     0.900 peak   848 spectrum    2 weight  0.10000E+01 volume  0.10679E-02 ppm1      3.454 ppm2      1.599 CV     1
 OR {  848}
   (( segid "    " and resid 28   and name HA1 ))
   (( segid "    " and resid 52   and name HB  ))
 ASSI {  850}
   (( segid "    " and resid 10   and name HA2 ))
   (  segid "    " and resid 106  and name HD1%)
      3.600     1.600     1.600 peak   850 spectrum    2 weight  0.10000E+01 volume  0.54230E-03 ppm1      3.801 ppm2      0.774 CV     1
 OR {  850}
   (( segid "    " and resid 10   and name HA1 ))
   (  segid "    " and resid 106  and name HD1%)
 ASSI {  851}
   (( segid "    " and resid 10   and name HA2 ))
   (( segid "    " and resid 104  and name HB2 ))
      3.000     1.100     1.100 peak   851 spectrum    2 weight  0.10000E+01 volume  0.12488E-02 ppm1      3.801 ppm2      1.320 CV     1
 OR {  851}
   (( segid "    " and resid 10   and name HA1 ))
   (( segid "    " and resid 104  and name HB2 ))
 OR {  851}
   (( segid "    " and resid 10   and name HA2 ))
   (( segid "    " and resid 104  and name HB1 ))
 ASSI {  856}
   (( segid "    " and resid 99   and name HB2 ))
   (  segid "    " and resid 70   and name HD1%)
      4.400     2.400     1.600 peak   856 spectrum    2 weight  0.10000E+01 volume  0.51978E-03 ppm1      1.569 ppm2      0.518 CV     1
 OR {  856}
   (( segid "    " and resid 99   and name HB1 ))
   (  segid "    " and resid 70   and name HD1%)
 ASSI {  857}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 18   and name HB2 ))
      4.300     2.300     1.700 peak   857 spectrum    2 weight  0.10000E+01 volume  0.74912E-03 ppm1      1.538 ppm2      1.143 CV     1
 OR {  857}
   (( segid "    " and resid 98   and name HB1 ))
   (( segid "    " and resid 18   and name HB2 ))
 OR {  857}
   (( segid "    " and resid 98   and name HB2 ))
   (( segid "    " and resid 18   and name HB1 ))
 ASSI {  858}
   (( segid "    " and resid 98   and name HB2 ))
   (  segid "    " and resid 98   and name HD1%)
      3.000     1.200     1.200 peak   858 spectrum    2 weight  0.10000E+01 volume  0.99754E-03 ppm1      1.540 ppm2      0.590 CV     1
 OR {  858}
   (( segid "    " and resid 98   and name HB1 ))
   (  segid "    " and resid 98   and name HD1%)
 ASSI {  861}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 94   and name HB2 ))
      3.100     1.200     1.200 peak   861 spectrum    2 weight  0.10000E+01 volume  0.11031E-02 ppm1      5.000 ppm2      2.814 CV     1
 OR {  861}
   (( segid "    " and resid 94   and name HA  ))
   (( segid "    " and resid 94   and name HB1 ))
 ASSI {  863}
   (( segid "    " and resid 95   and name HD2 ))
   (( segid "    " and resid 95   and name HB1 ))
      3.200     1.300     1.300 peak   863 spectrum    2 weight  0.10000E+01 volume  0.21619E-02 ppm1      3.484 ppm2      1.348 CV     1
 OR {  863}
   (( segid "    " and resid 95   and name HD1 ))
   (( segid "    " and resid 95   and name HB2 ))
 OR {  863}
   (( segid "    " and resid 95   and name HD1 ))
   (( segid "    " and resid 95   and name HB1 ))
 OR {  863}
   (( segid "    " and resid 95   and name HD2 ))
   (( segid "    " and resid 95   and name HB2 ))
 ASSI {  867}
   (( segid "    " and resid 105  and name HD2 ))
   (( segid "    " and resid 105  and name HA  ))
      4.300     2.300     1.700 peak   867 spectrum    2 weight  0.10000E+01 volume  0.27721E-03 ppm1      3.678 ppm2      4.274 CV     1
 OR {  867}
   (( segid "    " and resid 105  and name HD1 ))
   (( segid "    " and resid 105  and name HA  ))
 ASSI {  874}
   (( segid "    " and resid 105  and name HD1 ))
   (( segid "    " and resid 104  and name HB1 ))
      3.800     1.800     1.800 peak   874 spectrum    2 weight  0.10000E+01 volume  0.31954E-03 ppm1      3.679 ppm2      1.393 CV     1
 OR {  874}
   (( segid "    " and resid 105  and name HD2 ))
   (( segid "    " and resid 104  and name HB1 ))
 OR {  874}
   (( segid "    " and resid 105  and name HD2 ))
   (( segid "    " and resid 104  and name HB2 ))
 ASSI {  875}
   (( segid "    " and resid 65   and name HD1 ))
   (( segid "    " and resid 51   and name HG  ))
      3.500     1.500     1.500 peak   875 spectrum    2 weight  0.10000E+01 volume  0.45643E-03 ppm1      3.685 ppm2      1.345 CV     1
 ASSI {  877}
   (( segid "    " and resid 105  and name HD1 ))
   (  segid "    " and resid 104  and name HD2%)
      3.400     1.400     1.400 peak   877 spectrum    2 weight  0.10000E+01 volume  0.21184E-02 ppm1      3.514 ppm2      0.741 CV     1
 ASSI {  878}
   (( segid "    " and resid 105  and name HD2 ))
   (  segid "    " and resid 104  and name HD2%)
      3.100     1.200     1.200 peak   878 spectrum    2 weight  0.10000E+01 volume  0.16101E-02 ppm1      3.682 ppm2      0.741 CV     1
 ASSI {  881}
   (( segid "    " and resid 53   and name HD1 ))
   (( segid "    " and resid 53   and name HA  ))
      2.700     0.900     0.900 peak   881 spectrum    2 weight  0.10000E+01 volume  0.37349E-02 ppm1      3.573 ppm2      4.122 CV     1
 OR {  881}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI {  883}
   (( segid "    " and resid 53   and name HD1 ))
   (( segid "    " and resid 53   and name HG1 ))
      3.000     1.100     1.100 peak   883 spectrum    2 weight  0.10000E+01 volume  0.11784E-02 ppm1      3.574 ppm2      2.052 CV     1
 OR {  883}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HG2 ))
 OR {  883}
   (( segid "    " and resid 53   and name HD1 ))
   (( segid "    " and resid 53   and name HG2 ))
 OR {  883}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HG1 ))
 ASSI {  887}
   (( segid "    " and resid 53   and name HD2 ))
   (  segid "    " and resid 52   and name HG2%)
      3.300     1.400     1.400 peak   887 spectrum    2 weight  0.10000E+01 volume  0.11881E-02 ppm1      3.572 ppm2      0.883 CV     1
 OR {  887}
   (( segid "    " and resid 53   and name HD1 ))
   (  segid "    " and resid 52   and name HG2%)
 ASSI {  891}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HB1 ))
      4.400     2.400     1.600 peak   891 spectrum    2 weight  0.10000E+01 volume  0.35302E-03 ppm1      3.573 ppm2      1.805 CV     1
 OR {  891}
   (( segid "    " and resid 53   and name HD1 ))
   (( segid "    " and resid 53   and name HB2 ))
 OR {  891}
   (( segid "    " and resid 53   and name HD1 ))
   (( segid "    " and resid 53   and name HB1 ))
 OR {  891}
   (( segid "    " and resid 53   and name HD2 ))
   (( segid "    " and resid 53   and name HB2 ))
 ASSI {  894}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 29   and name HA  ))
      3.400     1.500     1.500 peak   894 spectrum    2 weight  0.10000E+01 volume  0.80650E-03 ppm1      5.258 ppm2      4.207 CV     1
 ASSI {  895}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HB1 ))
      2.800     1.000     1.000 peak   895 spectrum    2 weight  0.10000E+01 volume  0.16754E-02 ppm1      5.251 ppm2      1.575 CV     1
 OR {  895}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HB2 ))
 ASSI {  901}
   (( segid "    " and resid 43   and name HA  ))
   (  segid "    " and resid 34   and name HE% )
      4.100     2.100     1.900 peak   901 spectrum    2 weight  0.10000E+01 volume  0.34125E-03 ppm1      4.365 ppm2      1.847 CV     1
 ASSI {  905}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 96   and name HG2%)
      4.300     2.300     1.700 peak   905 spectrum    2 weight  0.10000E+01 volume  0.60869E-03 ppm1      4.169 ppm2      0.871 CV     1
 ASSI {  907}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 72   and name HG1%)
      4.100     2.100     1.900 peak   907 spectrum    2 weight  0.10000E+01 volume  0.37130E-03 ppm1      4.175 ppm2      0.563 CV     1
 ASSI {  908}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 27   and name HD1%)
      5.900     4.400     0.100 peak   908 spectrum    2 weight  0.10000E+01 volume  0.87589E-04 ppm1      4.170 ppm2      0.806 CV     1
 ASSI {  909}
   (( segid "    " and resid 8    and name HA  ))
   (  segid "    " and resid 106  and name HD1%)
      5.200     5.200     0.800 peak   909 spectrum    2 weight  0.10000E+01 volume  0.14214E-03 ppm1      4.267 ppm2      0.777 CV     1
 ASSI {  910}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 105  and name HD2 ))
      2.400     0.700     0.700 peak   910 spectrum    2 weight  0.10000E+01 volume  0.34612E-02 ppm1      4.459 ppm2      3.682 CV     1
 OR {  910}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 105  and name HD1 ))
 ASSI {  911}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 105  and name HG1 ))
      4.500     2.500     1.500 peak   911 spectrum    2 weight  0.10000E+01 volume  0.93921E-03 ppm1      4.457 ppm2      1.888 CV     1
 OR {  911}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 105  and name HG2 ))
 ASSI {  912}
   (( segid "    " and resid 104  and name HA  ))
   (  segid "    " and resid 104  and name HD2%)
      2.300     0.700     0.700 peak   912 spectrum    2 weight  0.10000E+01 volume  0.48140E-02 ppm1      4.461 ppm2      0.741 CV     1
 ASSI {  913}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HB1 ))
      2.900     1.100     1.100 peak   913 spectrum    2 weight  0.10000E+01 volume  0.11711E-02 ppm1      4.455 ppm2      1.405 CV     1
 OR {  913}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HB2 ))
 ASSI {  914}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HG2 ))
      3.200     1.300     1.300 peak   914 spectrum    2 weight  0.10000E+01 volume  0.99290E-03 ppm1      4.720 ppm2      2.114 CV     1
 OR {  914}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HG1 ))
 ASSI {  916}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB1 ))
      4.200     2.200     1.800 peak   916 spectrum    2 weight  0.10000E+01 volume  0.16288E-03 ppm1      4.715 ppm2      1.870 CV     1
 OR {  916}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
 ASSI {  917}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 91   and name HB2 ))
      2.700     0.900     0.900 peak   917 spectrum    2 weight  0.10000E+01 volume  0.28589E-02 ppm1      4.645 ppm2      2.862 CV     1
 OR {  917}
   (( segid "    " and resid 91   and name HA  ))
   (( segid "    " and resid 91   and name HB1 ))
 ASSI {  919}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 18   and name HD2%)
      2.300     0.700     0.700 peak   919 spectrum    2 weight  0.10000E+01 volume  0.50549E-02 ppm1      4.772 ppm2      0.756 CV     1
 ASSI {  920}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 18   and name HD1%)
      2.600     0.900     0.900 peak   920 spectrum    2 weight  0.10000E+01 volume  0.21227E-02 ppm1      4.771 ppm2      0.689 CV     1
 ASSI {  922}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HB1 ))
      2.600     0.900     0.900 peak   922 spectrum    2 weight  0.10000E+01 volume  0.25876E-02 ppm1      4.769 ppm2      1.509 CV     1
 OR {  922}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HB2 ))
 ASSI {  923}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HG  ))
      3.800     1.800     1.800 peak   923 spectrum    2 weight  0.10000E+01 volume  0.75921E-03 ppm1      4.771 ppm2      1.409 CV     1
 ASSI {  924}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 16   and name HG1%)
      5.500     3.800     0.500 peak   924 spectrum    2 weight  0.10000E+01 volume  0.10178E-03 ppm1      4.768 ppm2      0.856 CV     1
 ASSI {  926}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 76   and name HB1 ))
      2.600     0.800     0.800 peak   926 spectrum    2 weight  0.10000E+01 volume  0.27215E-02 ppm1      4.718 ppm2      2.937 CV     1
 OR {  926}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI {  928}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 71   and name HG2 ))
      3.600     1.600     1.600 peak   928 spectrum    2 weight  0.10000E+01 volume  0.80027E-03 ppm1      4.729 ppm2      1.347 CV     1
 OR {  928}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 71   and name HG1 ))
 ASSI {  930}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 71   and name HA  ))
      3.700     1.700     1.700 peak   930 spectrum    2 weight  0.10000E+01 volume  0.18597E-03 ppm1      4.718 ppm2      5.133 CV     1
 ASSI {  931}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 98   and name HD1%)
      3.700     1.700     1.700 peak   931 spectrum    2 weight  0.10000E+01 volume  0.17324E-02 ppm1      5.137 ppm2      0.584 CV     1
 ASSI {  934}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HB1 ))
      2.600     0.800     0.800 peak   934 spectrum    2 weight  0.10000E+01 volume  0.22779E-02 ppm1      5.143 ppm2      1.477 CV     1
 OR {  934}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HB2 ))
 ASSI {  935}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 72   and name HA  ))
      3.400     1.400     1.400 peak   935 spectrum    2 weight  0.10000E+01 volume  0.51669E-03 ppm1      5.136 ppm2      4.259 CV     1
 ASSI {  936}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 15   and name HA  ))
      2.800     1.000     1.000 peak   936 spectrum    2 weight  0.10000E+01 volume  0.12322E-02 ppm1      4.848 ppm2      5.450 CV     1
 ASSI {  937}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 15   and name HB1 ))
      3.400     1.400     1.400 peak   937 spectrum    2 weight  0.10000E+01 volume  0.82676E-03 ppm1      4.844 ppm2      3.620 CV     1
 OR {  937}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 15   and name HB2 ))
 ASSI {  938}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 99   and name HG  ))
      3.500     1.500     1.500 peak   938 spectrum    2 weight  0.10000E+01 volume  0.60491E-03 ppm1      4.847 ppm2      1.556 CV     1
 ASSI {  939}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 99   and name HB1 ))
      2.900     1.000     1.000 peak   939 spectrum    2 weight  0.10000E+01 volume  0.12694E-02 ppm1      4.849 ppm2      1.213 CV     1
 OR {  939}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 99   and name HB2 ))
 ASSI {  940}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 99   and name HD1%)
      2.400     0.700     0.700 peak   940 spectrum    2 weight  0.10000E+01 volume  0.37328E-02 ppm1      4.848 ppm2      0.686 CV     1
 ASSI {  941}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 100  and name HD1%)
      5.000     3.100     1.000 peak   941 spectrum    2 weight  0.10000E+01 volume  0.37468E-03 ppm1      4.837 ppm2      0.520 CV     1
 ASSI {  942}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 16   and name HG2%)
      4.100     2.100     1.900 peak   942 spectrum    2 weight  0.10000E+01 volume  0.52149E-03 ppm1      4.841 ppm2      0.745 CV     1
 ASSI {  943}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 98   and name HD2%)
      2.100     0.600     0.600 peak   943 spectrum    2 weight  0.10000E+01 volume  0.76615E-02 ppm1      5.165 ppm2      0.682 CV     1
 ASSI {  944}
   (( segid "    " and resid 13   and name HA  ))
   (  segid "    " and resid 101  and name HG2%)
      3.700     1.700     1.700 peak   944 spectrum    2 weight  0.10000E+01 volume  0.16108E-02 ppm1      5.162 ppm2      0.761 CV     1
 ASSI {  945}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HB2 ))
      3.100     1.200     1.200 peak   945 spectrum    2 weight  0.10000E+01 volume  0.90504E-03 ppm1      4.752 ppm2      1.774 CV     1
 OR {  945}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HB1 ))
 ASSI {  946}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HG2 ))
      3.500     1.500     1.500 peak   946 spectrum    2 weight  0.10000E+01 volume  0.81104E-03 ppm1      4.758 ppm2      1.532 CV     1
 OR {  946}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HG1 ))
 ASSI {  948}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HD1 ))
      4.200     2.200     1.800 peak   948 spectrum    2 weight  0.10000E+01 volume  0.11896E-03 ppm1      4.763 ppm2      3.201 CV     1
 OR {  948}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HD2 ))
 ASSI {  950}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HB1 ))
      2.400     0.800     0.800 peak   950 spectrum    2 weight  0.10000E+01 volume  0.33238E-02 ppm1      5.178 ppm2      1.379 CV     1
 OR {  950}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HB2 ))
 ASSI {  951}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 12   and name HB1 ))
      2.600     0.800     0.800 peak   951 spectrum    2 weight  0.10000E+01 volume  0.32061E-02 ppm1      4.493 ppm2      3.667 CV     1
 OR {  951}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 12   and name HB2 ))
 ASSI {  952}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HB2 ))
      1.900     0.500     0.500 peak   952 spectrum    2 weight  0.10000E+01 volume  0.20214E-01 ppm1      4.487 ppm2      2.602 CV     1
 OR {  952}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HB1 ))
 ASSI {  953}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HB2 ))
      3.200     1.300     1.300 peak   953 spectrum    2 weight  0.10000E+01 volume  0.58412E-03 ppm1      4.676 ppm2      1.417 CV     1
 OR {  953}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HB1 ))
 ASSI {  954}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HG1 ))
      3.000     1.100     1.100 peak   954 spectrum    2 weight  0.10000E+01 volume  0.91486E-03 ppm1      4.679 ppm2      0.771 CV     1
 OR {  954}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HG2 ))
 ASSI {  956}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 17   and name HA  ))
      3.200     1.300     1.300 peak   956 spectrum    2 weight  0.10000E+01 volume  0.61035E-03 ppm1      4.967 ppm2      5.073 CV     1
 ASSI {  957}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HB1 ))
      2.600     0.900     0.900 peak   957 spectrum    2 weight  0.10000E+01 volume  0.22230E-02 ppm1      4.957 ppm2      1.689 CV     1
 OR {  957}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HB2 ))
 ASSI {  961}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HG1 ))
      3.400     1.400     1.400 peak   961 spectrum    2 weight  0.10000E+01 volume  0.54981E-03 ppm1      4.951 ppm2      1.329 CV     1
 OR {  961}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HG2 ))
 ASSI {  962}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HG1 ))
      3.300     1.400     1.400 peak   962 spectrum    2 weight  0.10000E+01 volume  0.77516E-03 ppm1      5.071 ppm2      1.920 CV     1
 OR {  962}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HG2 ))
 ASSI {  963}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HB2 ))
      2.700     0.900     0.900 peak   963 spectrum    2 weight  0.10000E+01 volume  0.24397E-02 ppm1      5.071 ppm2      1.780 CV     1
 OR {  963}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HB1 ))
 ASSI {  966}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 69   and name HA  ))
      3.200     1.300     1.300 peak   966 spectrum    2 weight  0.10000E+01 volume  0.75086E-03 ppm1      5.326 ppm2      3.869 CV     1
 ASSI {  967}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HG  ))
      3.000     1.100     1.100 peak   967 spectrum    2 weight  0.10000E+01 volume  0.18899E-02 ppm1      5.327 ppm2      1.318 CV     1
 ASSI {  968}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HB2 ))
      2.800     1.000     1.000 peak   968 spectrum    2 weight  0.10000E+01 volume  0.99043E-03 ppm1      5.331 ppm2      1.245 CV     1
 OR {  968}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HB1 ))
 ASSI {  969}
   (( segid "    " and resid 100  and name HA  ))
   (  segid "    " and resid 101  and name HG2%)
      4.000     2.000     2.000 peak   969 spectrum    2 weight  0.10000E+01 volume  0.85682E-03 ppm1      5.323 ppm2      0.761 CV     1
 ASSI {  970}
   (( segid "    " and resid 100  and name HA  ))
   (  segid "    " and resid 100  and name HD2%)
      3.600     1.600     1.600 peak   970 spectrum    2 weight  0.10000E+01 volume  0.26675E-02 ppm1      5.330 ppm2      0.679 CV     1
 ASSI {  971}
   (( segid "    " and resid 100  and name HA  ))
   (  segid "    " and resid 70   and name HD2%)
      4.800     2.800     1.200 peak   971 spectrum    2 weight  0.10000E+01 volume  0.39513E-03 ppm1      5.332 ppm2      0.574 CV     1
 ASSI {  972}
   (( segid "    " and resid 100  and name HA  ))
   (  segid "    " and resid 100  and name HD1%)
      3.400     1.400     1.400 peak   972 spectrum    2 weight  0.10000E+01 volume  0.15759E-02 ppm1      5.329 ppm2      0.521 CV     1
 ASSI {  973}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 47   and name HA  ))
      4.000     2.000     2.000 peak   973 spectrum    2 weight  0.10000E+01 volume  0.13794E-03 ppm1      4.675 ppm2      5.120 CV     1
 ASSI {  974}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 17   and name HG1 ))
      4.300     2.300     1.700 peak   974 spectrum    2 weight  0.10000E+01 volume  0.29027E-03 ppm1      4.945 ppm2      1.907 CV     1
 OR {  974}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 17   and name HG2 ))
 ASSI {  975}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HB1 ))
      4.000     2.000     2.000 peak   975 spectrum    2 weight  0.10000E+01 volume  0.29143E-03 ppm1      3.965 ppm2      2.675 CV     1
 OR {  975}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HB2 ))
 ASSI {  977}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 51   and name HB1 ))
      3.500     1.500     1.500 peak   977 spectrum    2 weight  0.10000E+01 volume  0.68223E-03 ppm1      3.955 ppm2      1.592 CV     1
 OR {  977}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 51   and name HB2 ))
 ASSI {  981}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 18   and name HD1%)
      2.600     0.900     0.900 peak   981 spectrum    2 weight  0.10000E+01 volume  0.23771E-02 ppm1      3.963 ppm2      0.687 CV     1
 ASSI {  984}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HD1 ))
      3.700     1.700     1.700 peak   984 spectrum    2 weight  0.10000E+01 volume  0.88150E-03 ppm1      4.256 ppm2      2.877 CV     1
 OR {  984}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HD2 ))
 ASSI {  985}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HB2 ))
      2.500     0.800     0.800 peak   985 spectrum    2 weight  0.10000E+01 volume  0.26682E-02 ppm1      4.256 ppm2      1.626 CV     1
 OR {  985}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HB1 ))
 ASSI {  988}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HG1 ))
      2.700     0.900     0.900 peak   988 spectrum    2 weight  0.10000E+01 volume  0.25852E-02 ppm1      4.490 ppm2      2.339 CV     1
 OR {  988}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HG2 ))
 ASSI {  989}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HB1 ))
      2.600     0.800     0.800 peak   989 spectrum    2 weight  0.10000E+01 volume  0.28121E-02 ppm1      4.490 ppm2      1.935 CV     1
 OR {  989}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HB2 ))
 ASSI {  990}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 34   and name HE% )
      3.900     1.900     1.900 peak   990 spectrum    2 weight  0.10000E+01 volume  0.79216E-03 ppm1      4.491 ppm2      1.846 CV     1
 ASSI {  992}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 106  and name HB2 ))
      2.000     0.500     0.500 peak   992 spectrum    2 weight  0.10000E+01 volume  0.13200E-01 ppm1      4.199 ppm2      1.458 CV     1
 OR {  992}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 106  and name HB1 ))
 ASSI {  993}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 107  and name HB1 ))
      2.000     0.500     0.500 peak   993 spectrum    2 weight  0.10000E+01 volume  0.14822E-01 ppm1      4.277 ppm2      1.489 CV     1
 OR {  993}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 107  and name HB2 ))
 ASSI {  998}
   (( segid "    " and resid 70   and name HA  ))
   (  segid "    " and resid 77   and name HG2%)
      3.300     1.400     1.400 peak   998 spectrum    2 weight  0.10000E+01 volume  0.61147E-03 ppm1      4.370 ppm2      0.416 CV     1
 ASSI {  999}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB1 ))
      2.600     0.900     0.900 peak   999 spectrum    2 weight  0.10000E+01 volume  0.22148E-02 ppm1      4.373 ppm2      1.322 CV     1
 OR {  999}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB2 ))
 ASSI { 1001}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 78   and name HG2 ))
      3.900     1.900     1.900 peak  1001 spectrum    2 weight  0.10000E+01 volume  0.26858E-03 ppm1      4.378 ppm2      2.387 CV     1
 OR { 1001}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 78   and name HG1 ))
 ASSI { 1002}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HD1 ))
      4.400     2.500     1.600 peak  1002 spectrum    2 weight  0.10000E+01 volume  0.48228E-03 ppm1      5.131 ppm2      2.930 CV     1
 OR { 1002}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HD2 ))
 ASSI { 1003}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HG2 ))
      3.100     1.200     1.200 peak  1003 spectrum    2 weight  0.10000E+01 volume  0.10835E-02 ppm1      5.135 ppm2      1.347 CV     1
 OR { 1003}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HG1 ))
 ASSI { 1006}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 69   and name HG2%)
      4.900     2.900     1.100 peak  1006 spectrum    2 weight  0.10000E+01 volume  0.13654E-03 ppm1      5.130 ppm2      0.509 CV     1
 ASSI { 1008}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 59   and name HB1 ))
      2.900     1.100     1.100 peak  1008 spectrum    2 weight  0.10000E+01 volume  0.14554E-02 ppm1      4.093 ppm2      1.680 CV     1
 OR { 1008}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 1010}
   (( segid "    " and resid 56   and name HA  ))
   (  segid "    " and resid 59   and name HD2%)
      4.400     2.400     1.600 peak  1010 spectrum    2 weight  0.10000E+01 volume  0.92176E-03 ppm1      4.091 ppm2      0.778 CV     1
 ASSI { 1012}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 16   and name HG2%)
      3.900     1.900     1.900 peak  1012 spectrum    2 weight  0.10000E+01 volume  0.46050E-03 ppm1      5.465 ppm2      0.746 CV     1
 ASSI { 1013}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 99   and name HD1%)
      3.000     1.100     1.100 peak  1013 spectrum    2 weight  0.10000E+01 volume  0.21038E-02 ppm1      5.454 ppm2      0.686 CV     1
 ASSI { 1014}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 100  and name HD1%)
      3.700     1.700     1.700 peak  1014 spectrum    2 weight  0.10000E+01 volume  0.44927E-03 ppm1      5.452 ppm2      0.521 CV     1
 ASSI { 1015}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 16   and name HG1%)
      5.700     4.100     0.300 peak  1015 spectrum    2 weight  0.10000E+01 volume  0.16496E-03 ppm1      5.455 ppm2      0.854 CV     1
 ASSI { 1019}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HB1 ))
      2.300     0.600     0.600 peak  1019 spectrum    2 weight  0.10000E+01 volume  0.90666E-02 ppm1      4.258 ppm2      2.683 CV     1
 OR { 1019}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HB2 ))
 ASSI { 1021}
   (( segid "    " and resid 80   and name HA  ))
   (  segid "    " and resid 81   and name HB% )
      3.500     1.500     1.500 peak  1021 spectrum    2 weight  0.10000E+01 volume  0.34917E-02 ppm1      4.214 ppm2      1.403 CV     1
 ASSI { 1024}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 2    and name HB1 ))
      2.900     1.100     1.100 peak  1024 spectrum    2 weight  0.10000E+01 volume  0.28287E-02 ppm1      4.522 ppm2      3.698 CV     1
 OR { 1024}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 2    and name HB2 ))
 ASSI { 1025}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 3    and name HB1 ))
      2.600     0.800     0.800 peak  1025 spectrum    2 weight  0.10000E+01 volume  0.38172E-02 ppm1      4.523 ppm2      3.064 CV     1
 OR { 1025}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 3    and name HB2 ))
 ASSI { 1027}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HB1 ))
      3.500     1.600     1.600 peak  1027 spectrum    2 weight  0.10000E+01 volume  0.50827E-03 ppm1      4.782 ppm2      2.700 CV     1
 OR { 1027}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HB2 ))
 ASSI { 1030}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HB1 ))
      2.700     0.900     0.900 peak  1030 spectrum    2 weight  0.10000E+01 volume  0.14672E-02 ppm1      5.122 ppm2      2.554 CV     1
 OR { 1030}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HB2 ))
 ASSI { 1031}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HG1 ))
      2.800     1.000     1.000 peak  1031 spectrum    2 weight  0.10000E+01 volume  0.19554E-02 ppm1      4.192 ppm2      2.478 CV     1
 OR { 1031}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HG2 ))
 ASSI { 1032}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HB2 ))
      2.200     0.600     0.600 peak  1032 spectrum    2 weight  0.10000E+01 volume  0.73500E-02 ppm1      4.201 ppm2      1.931 CV     1
 OR { 1032}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HB1 ))
 ASSI { 1035}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HE1 ))
      4.300     2.300     1.700 peak  1035 spectrum    2 weight  0.10000E+01 volume  0.58536E-03 ppm1      4.220 ppm2      2.869 CV     1
 OR { 1035}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HE2 ))
 ASSI { 1036}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HB2 ))
      2.600     0.800     0.800 peak  1036 spectrum    2 weight  0.10000E+01 volume  0.46421E-02 ppm1      4.192 ppm2      2.093 CV     1
 ASSI { 1037}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HG1 ))
      2.500     0.800     0.800 peak  1037 spectrum    2 weight  0.10000E+01 volume  0.67015E-02 ppm1      4.213 ppm2      1.322 CV     1
 OR { 1037}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HG2 ))
 ASSI { 1038}
   (( segid "    " and resid 80   and name HA  ))
   (  segid "    " and resid 85   and name HG2%)
      5.000     3.100     1.000 peak  1038 spectrum    2 weight  0.10000E+01 volume  0.20327E-03 ppm1      4.194 ppm2      0.910 CV     1
 ASSI { 1040}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB2 ))
      2.000     0.500     0.500 peak  1040 spectrum    2 weight  0.10000E+01 volume  0.11717E-01 ppm1      4.212 ppm2      1.730 CV     1
 OR { 1040}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB1 ))
 ASSI { 1041}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HD1 ))
      2.400     0.700     0.700 peak  1041 spectrum    2 weight  0.10000E+01 volume  0.41465E-02 ppm1      4.203 ppm2      1.570 CV     1
 OR { 1041}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HD2 ))
 ASSI { 1042}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 103  and name HA  ))
      2.700     0.900     0.900 peak  1042 spectrum    2 weight  0.10000E+01 volume  0.13009E-02 ppm1      5.273 ppm2      4.228 CV     1
 ASSI { 1043}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HB1 ))
      2.900     1.100     1.100 peak  1043 spectrum    2 weight  0.10000E+01 volume  0.12178E-02 ppm1      5.282 ppm2      2.870 CV     1
 OR { 1043}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HB2 ))
 ASSI { 1045}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 104  and name HG  ))
      3.200     1.300     1.300 peak  1045 spectrum    2 weight  0.10000E+01 volume  0.14953E-02 ppm1      5.276 ppm2      1.339 CV     1
 ASSI { 1046}
   (( segid "    " and resid 11   and name HA  ))
   (  segid "    " and resid 104  and name HD1%)
      3.800     1.800     1.800 peak  1046 spectrum    2 weight  0.10000E+01 volume  0.85601E-03 ppm1      5.271 ppm2      0.720 CV     1
 ASSI { 1047}
   (( segid "    " and resid 11   and name HA  ))
   (  segid "    " and resid 101  and name HD1%)
      4.800     2.900     1.200 peak  1047 spectrum    2 weight  0.10000E+01 volume  0.15640E-03 ppm1      5.279 ppm2      0.431 CV     1
 ASSI { 1049}
   (( segid "    " and resid 59   and name HA  ))
   (  segid "    " and resid 59   and name HD1%)
      3.800     1.800     1.800 peak  1049 spectrum    2 weight  0.10000E+01 volume  0.24868E-02 ppm1      3.934 ppm2      0.712 CV     1
 ASSI { 1050}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HB2 ))
      2.600     0.800     0.800 peak  1050 spectrum    2 weight  0.10000E+01 volume  0.32926E-02 ppm1      3.940 ppm2      1.429 CV     1
 OR { 1050}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HB1 ))
 ASSI { 1051}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HG  ))
      2.800     0.900     0.900 peak  1051 spectrum    2 weight  0.10000E+01 volume  0.29310E-02 ppm1      3.942 ppm2      1.593 CV     1
 ASSI { 1054}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HB2 ))
      2.400     0.700     0.700 peak  1054 spectrum    2 weight  0.10000E+01 volume  0.45203E-02 ppm1      4.531 ppm2      3.664 CV     1
 OR { 1054}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HB1 ))
 ASSI { 1055}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HB1 ))
      2.700     0.900     0.900 peak  1055 spectrum    2 weight  0.10000E+01 volume  0.28377E-02 ppm1      4.530 ppm2      2.831 CV     1
 OR { 1055}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI { 1057}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 87   and name HG2 ))
      3.800     1.800     1.800 peak  1057 spectrum    2 weight  0.10000E+01 volume  0.41216E-03 ppm1      4.525 ppm2      2.279 CV     1
 OR { 1057}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 87   and name HG1 ))
 ASSI { 1058}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 82   and name HG2 ))
      4.600     2.600     1.400 peak  1058 spectrum    2 weight  0.10000E+01 volume  0.39052E-03 ppm1      4.525 ppm2      2.155 CV     1
 OR { 1058}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 82   and name HG1 ))
 ASSI { 1059}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 87   and name HB2 ))
      3.200     1.300     1.300 peak  1059 spectrum    2 weight  0.10000E+01 volume  0.11229E-02 ppm1      4.527 ppm2      2.053 CV     1
 OR { 1059}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 87   and name HB1 ))
 ASSI { 1060}
   (( segid "    " and resid 84   and name HA  ))
   (  segid "    " and resid 80   and name HE% )
      4.200     2.200     1.800 peak  1060 spectrum    2 weight  0.10000E+01 volume  0.46019E-03 ppm1      4.527 ppm2      1.892 CV     1
 ASSI { 1061}
   (( segid "    " and resid 32   and name HA  ))
   (  segid "    " and resid 31   and name HD1%)
      4.300     2.300     1.700 peak  1061 spectrum    2 weight  0.10000E+01 volume  0.41620E-03 ppm1      4.531 ppm2      0.671 CV     1
 ASSI { 1063}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB2 ))
      2.600     0.900     0.900 peak  1063 spectrum    2 weight  0.10000E+01 volume  0.30175E-02 ppm1      4.753 ppm2      3.766 CV     1
 OR { 1063}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB1 ))
 ASSI { 1064}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HB1 ))
      2.200     0.600     0.600 peak  1064 spectrum    2 weight  0.10000E+01 volume  0.81877E-02 ppm1      4.738 ppm2      3.666 CV     1
 OR { 1064}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HB2 ))
 ASSI { 1066}
   (( segid "    " and resid 30   and name HA  ))
   (  segid "    " and resid 31   and name HG2%)
      4.200     2.200     1.800 peak  1066 spectrum    2 weight  0.10000E+01 volume  0.67258E-03 ppm1      4.755 ppm2      0.592 CV     1
 ASSI { 1067}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HB1 ))
      2.600     0.800     0.800 peak  1067 spectrum    2 weight  0.10000E+01 volume  0.32351E-02 ppm1      4.835 ppm2      2.806 CV     1
 OR { 1067}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HB2 ))
 ASSI { 1070}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HB2 ))
      2.900     1.000     1.000 peak  1070 spectrum    2 weight  0.10000E+01 volume  0.11782E-02 ppm1      4.032 ppm2      2.655 CV     1
 OR { 1070}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI { 1071}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 65   and name HB2 ))
      3.000     1.100     1.100 peak  1071 spectrum    2 weight  0.10000E+01 volume  0.11385E-02 ppm1      4.268 ppm2      2.135 CV     1
 OR { 1071}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 65   and name HB1 ))
 ASSI { 1074}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name HB2 ))
      2.600     0.900     0.900 peak  1074 spectrum    2 weight  0.10000E+01 volume  0.23978E-02 ppm1      4.115 ppm2      1.450 CV     1
 OR { 1074}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name HB1 ))
 ASSI { 1076}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HB1 ))
      2.300     0.600     0.600 peak  1076 spectrum    2 weight  0.10000E+01 volume  0.70556E-02 ppm1      4.267 ppm2      3.782 CV     1
 OR { 1076}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HB2 ))
 ASSI { 1078}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 20   and name HB2 ))
      4.500     2.500     1.500 peak  1078 spectrum    2 weight  0.10000E+01 volume  0.15479E-02 ppm1      4.114 ppm2      1.623 CV     1
 OR { 1078}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 20   and name HB1 ))
 ASSI { 1079}
   (( segid "    " and resid 27   and name HA  ))
   (  segid "    " and resid 56   and name HB% )
      2.600     0.800     0.800 peak  1079 spectrum    2 weight  0.10000E+01 volume  0.34600E-02 ppm1      4.111 ppm2      1.507 CV     1
 ASSI { 1081}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HB2 ))
      2.700     0.900     0.900 peak  1081 spectrum    2 weight  0.10000E+01 volume  0.32848E-02 ppm1      4.248 ppm2      2.672 CV     1
 OR { 1081}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HB1 ))
 ASSI { 1084}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HD1 ))
      3.300     1.400     1.400 peak  1084 spectrum    2 weight  0.10000E+01 volume  0.36669E-02 ppm1      4.284 ppm2      1.490 CV     1
 OR { 1084}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HD2 ))
 ASSI { 1085}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HB1 ))
      2.700     0.900     0.900 peak  1085 spectrum    2 weight  0.10000E+01 volume  0.22293E-02 ppm1      4.281 ppm2      1.387 CV     1
 OR { 1085}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HB2 ))
 ASSI { 1086}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HG1 ))
      2.700     0.900     0.900 peak  1086 spectrum    2 weight  0.10000E+01 volume  0.24387E-02 ppm1      4.287 ppm2      1.307 CV     1
 OR { 1086}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HG2 ))
 ASSI { 1088}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 18   and name HD2%)
      3.400     1.400     1.400 peak  1088 spectrum    2 weight  0.10000E+01 volume  0.15191E-02 ppm1      4.250 ppm2      0.759 CV     1
 ASSI { 1089}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HB1 ))
      2.200     0.600     0.600 peak  1089 spectrum    2 weight  0.10000E+01 volume  0.62933E-02 ppm1      4.553 ppm2      2.836 CV     1
 OR { 1089}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI { 1090}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 51   and name HD1%)
      4.700     2.700     1.300 peak  1090 spectrum    2 weight  0.10000E+01 volume  0.32037E-03 ppm1      4.266 ppm2      0.650 CV     1
 ASSI { 1094}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HB1 ))
      2.300     0.700     0.700 peak  1094 spectrum    2 weight  0.10000E+01 volume  0.66542E-02 ppm1      4.042 ppm2      1.917 CV     1
 OR { 1094}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 1095}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 26   and name HB1 ))
      2.300     0.600     0.600 peak  1095 spectrum    2 weight  0.10000E+01 volume  0.72194E-02 ppm1      4.435 ppm2      3.874 CV     1
 OR { 1095}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 26   and name HB2 ))
 ASSI { 1096}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HB1 ))
      2.800     1.000     1.000 peak  1096 spectrum    2 weight  0.10000E+01 volume  0.20054E-02 ppm1      4.386 ppm2      4.021 CV     1
 OR { 1096}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HB2 ))
 ASSI { 1097}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 58   and name HB% )
      4.700     2.700     1.300 peak  1097 spectrum    2 weight  0.10000E+01 volume  0.29386E-03 ppm1      4.390 ppm2      1.372 CV     1
 ASSI { 1098}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 52   and name HG2%)
      4.100     2.100     1.900 peak  1098 spectrum    2 weight  0.10000E+01 volume  0.39884E-03 ppm1      4.389 ppm2      0.879 CV     1
 ASSI { 1100}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 5    and name HB1 ))
      2.400     0.700     0.700 peak  1100 spectrum    2 weight  0.10000E+01 volume  0.45741E-02 ppm1      4.483 ppm2      2.922 CV     1
 OR { 1100}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 5    and name HB2 ))
 ASSI { 1102}
   (( segid "    " and resid 46   and name HA  ))
   (  segid "    " and resid 46   and name HG2%)
      2.500     0.800     0.800 peak  1102 spectrum    2 weight  0.10000E+01 volume  0.31010E-02 ppm1      4.482 ppm2      0.678 CV     1
 ASSI { 1103}
   (( segid "    " and resid 46   and name HA  ))
   (  segid "    " and resid 46   and name HD1%)
      2.300     0.700     0.700 peak  1103 spectrum    2 weight  0.10000E+01 volume  0.39855E-02 ppm1      4.486 ppm2      0.600 CV     1
 ASSI { 1104}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HB  ))
      4.100     2.100     1.900 peak  1104 spectrum    2 weight  0.10000E+01 volume  0.19177E-03 ppm1      4.485 ppm2      1.978 CV     1
 ASSI { 1105}
   (( segid "    " and resid 5    and name HA  ))
   (  segid "    " and resid 8    and name HB% )
      4.500     2.500     1.500 peak  1105 spectrum    2 weight  0.10000E+01 volume  0.17441E-03 ppm1      4.481 ppm2      1.282 CV     1
 ASSI { 1106}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 69   and name HB  ))
      5.300     3.500     0.700 peak  1106 spectrum    2 weight  0.10000E+01 volume  0.11478E-03 ppm1      4.483 ppm2      1.317 CV     1
 ASSI { 1107}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HB1 ))
      2.100     0.500     0.500 peak  1107 spectrum    2 weight  0.10000E+01 volume  0.13995E-01 ppm1      4.352 ppm2      3.680 CV     1
 OR { 1107}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HB2 ))
 ASSI { 1108}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 59   and name HD1%)
      3.700     1.700     1.700 peak  1108 spectrum    2 weight  0.10000E+01 volume  0.51983E-03 ppm1      4.352 ppm2      0.721 CV     1
 ASSI { 1111}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 89   and name HG  ))
      2.700     0.900     0.900 peak  1111 spectrum    2 weight  0.10000E+01 volume  0.33433E-02 ppm1      3.791 ppm2      1.416 CV     1
 ASSI { 1117}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 72   and name HG1%)
      2.900     1.100     1.100 peak  1117 spectrum    2 weight  0.10000E+01 volume  0.23140E-02 ppm1      3.791 ppm2      0.564 CV     1
 ASSI { 1121}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 78   and name HG2 ))
      3.000     1.100     1.100 peak  1121 spectrum    2 weight  0.10000E+01 volume  0.20941E-02 ppm1      4.026 ppm2      2.227 CV     1
 OR { 1121}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 78   and name HG1 ))
 ASSI { 1123}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 78   and name HB1 ))
      2.300     0.700     0.700 peak  1123 spectrum    2 weight  0.10000E+01 volume  0.69381E-02 ppm1      4.026 ppm2      1.953 CV     1
 OR { 1123}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 78   and name HB2 ))
 ASSI { 1128}
   (( segid "    " and resid 52   and name HA  ))
   (  segid "    " and resid 52   and name HG2%)
      2.600     0.900     0.900 peak  1128 spectrum    2 weight  0.10000E+01 volume  0.25486E-02 ppm1      4.127 ppm2      0.881 CV     1
 ASSI { 1129}
   (( segid "    " and resid 52   and name HA  ))
   (  segid "    " and resid 52   and name HD1%)
      3.000     1.200     1.200 peak  1129 spectrum    2 weight  0.10000E+01 volume  0.14434E-02 ppm1      4.131 ppm2      0.670 CV     1
 ASSI { 1130}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB1 ))
      2.100     0.500     0.500 peak  1130 spectrum    2 weight  0.10000E+01 volume  0.11696E-01 ppm1      4.016 ppm2      1.560 CV     1
 OR { 1130}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 1131}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB2 ))
      2.200     0.600     0.600 peak  1131 spectrum    2 weight  0.10000E+01 volume  0.10694E-01 ppm1      4.395 ppm2      3.867 CV     1
 OR { 1131}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI { 1133}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 16   and name HG1%)
      5.500     3.800     0.500 peak  1133 spectrum    2 weight  0.10000E+01 volume  0.19780E-03 ppm1      4.009 ppm2      0.857 CV     1
 ASSI { 1135}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 87   and name HB1 ))
      2.300     0.600     0.600 peak  1135 spectrum    2 weight  0.10000E+01 volume  0.64150E-02 ppm1      4.125 ppm2      2.054 CV     1
 OR { 1135}
   (( segid "    " and resid 87   and name HA  ))
   (( segid "    " and resid 87   and name HB2 ))
 ASSI { 1138}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name HB  ))
      2.600     0.900     0.900 peak  1138 spectrum    2 weight  0.10000E+01 volume  0.14597E-02 ppm1      5.227 ppm2      1.480 CV     1
 ASSI { 1139}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name HG12))
      2.700     0.900     0.900 peak  1139 spectrum    2 weight  0.10000E+01 volume  0.20643E-02 ppm1      5.231 ppm2      1.383 CV     1
 OR { 1139}
   (( segid "    " and resid 101  and name HA  ))
   (( segid "    " and resid 101  and name HG11))
 ASSI { 1142}
   (( segid "    " and resid 101  and name HA  ))
   (  segid "    " and resid 70   and name HD1%)
      4.300     2.300     1.700 peak  1142 spectrum    2 weight  0.10000E+01 volume  0.44411E-03 ppm1      5.229 ppm2      0.511 CV     1
 ASSI { 1146}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name HB1 ))
      2.200     0.600     0.600 peak  1146 spectrum    2 weight  0.10000E+01 volume  0.91536E-02 ppm1      3.955 ppm2      1.840 CV     1
 OR { 1146}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name HB2 ))
 ASSI { 1147}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name HG1 ))
      2.400     0.700     0.700 peak  1147 spectrum    2 weight  0.10000E+01 volume  0.50606E-02 ppm1      3.958 ppm2      1.644 CV     1
 OR { 1147}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 90   and name HG2 ))
 ASSI { 1150}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 8    and name HB% )
      4.700     2.800     1.300 peak  1150 spectrum    2 weight  0.10000E+01 volume  0.50256E-03 ppm1      4.293 ppm2      1.278 CV     1
 ASSI { 1152}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 20   and name HD2 ))
      4.000     2.000     2.000 peak  1152 spectrum    2 weight  0.10000E+01 volume  0.43964E-03 ppm1      4.343 ppm2      2.874 CV     1
 OR { 1152}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 20   and name HD1 ))
 ASSI { 1153}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 20   and name HG2 ))
      3.700     1.800     1.800 peak  1153 spectrum    2 weight  0.10000E+01 volume  0.66036E-03 ppm1      4.331 ppm2      1.401 CV     1
 OR { 1153}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 20   and name HG1 ))
 ASSI { 1154}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HB2 ))
      2.300     0.600     0.600 peak  1154 spectrum    2 weight  0.10000E+01 volume  0.78522E-02 ppm1      4.345 ppm2      3.887 CV     1
 OR { 1154}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HB1 ))
 ASSI { 1155}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 106  and name HD1%)
      4.100     2.100     1.900 peak  1155 spectrum    2 weight  0.10000E+01 volume  0.22157E-03 ppm1      4.286 ppm2      0.771 CV     1
 ASSI { 1156}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 48   and name HA  ))
      2.500     0.800     0.800 peak  1156 spectrum    2 weight  0.10000E+01 volume  0.17438E-02 ppm1      5.191 ppm2      3.682 CV     1
 ASSI { 1157}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HB  ))
      2.600     0.900     0.900 peak  1157 spectrum    2 weight  0.10000E+01 volume  0.16908E-02 ppm1      5.196 ppm2      1.757 CV     1
 ASSI { 1158}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HG12))
      4.100     2.100     1.900 peak  1158 spectrum    2 weight  0.10000E+01 volume  0.35050E-03 ppm1      5.198 ppm2      1.207 CV     1
 OR { 1158}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HG11))
 ASSI { 1161}
   (( segid "    " and resid 31   and name HA  ))
   (  segid "    " and resid 31   and name HD1%)
      3.300     1.400     1.400 peak  1161 spectrum    2 weight  0.10000E+01 volume  0.37080E-02 ppm1      5.203 ppm2      0.674 CV     1
 ASSI { 1162}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HB  ))
      2.600     0.900     0.900 peak  1162 spectrum    2 weight  0.10000E+01 volume  0.30556E-02 ppm1      4.373 ppm2      1.836 CV     1
 ASSI { 1163}
   (( segid "    " and resid 16   and name HA  ))
   (  segid "    " and resid 16   and name HG1%)
      2.600     0.800     0.800 peak  1163 spectrum    2 weight  0.10000E+01 volume  0.31531E-02 ppm1      4.372 ppm2      0.856 CV     1
 ASSI { 1164}
   (( segid "    " and resid 16   and name HA  ))
   (  segid "    " and resid 16   and name HG2%)
      2.400     0.700     0.700 peak  1164 spectrum    2 weight  0.10000E+01 volume  0.49374E-02 ppm1      4.363 ppm2      0.753 CV     1
 ASSI { 1166}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 92   and name HB% )
      4.500     2.500     1.500 peak  1166 spectrum    2 weight  0.10000E+01 volume  0.94979E-03 ppm1      4.299 ppm2      1.419 CV     1
 ASSI { 1168}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HB  ))
      2.900     1.000     1.000 peak  1168 spectrum    2 weight  0.10000E+01 volume  0.14333E-02 ppm1      4.211 ppm2      1.578 CV     1
 ASSI { 1169}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HG11))
      2.900     1.100     1.100 peak  1169 spectrum    2 weight  0.10000E+01 volume  0.11277E-02 ppm1      4.211 ppm2      1.333 CV     1
 OR { 1169}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HG12))
 ASSI { 1171}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 72   and name HG1%)
      1.900     0.500     0.500 peak  1171 spectrum    2 weight  0.10000E+01 volume  0.16966E-01 ppm1      4.229 ppm2      0.566 CV     1
 ASSI { 1173}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HB1 ))
      2.200     0.600     0.600 peak  1173 spectrum    2 weight  0.10000E+01 volume  0.68649E-02 ppm1      3.577 ppm2      2.005 CV     1
 OR { 1173}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HB2 ))
 ASSI { 1175}
   (( segid "    " and resid 82   and name HA  ))
   (  segid "    " and resid 85   and name HG1%)
      4.200     2.300     1.800 peak  1175 spectrum    2 weight  0.10000E+01 volume  0.57723E-03 ppm1      3.574 ppm2      0.732 CV     1
 ASSI { 1176}
   (( segid "    " and resid 82   and name HA  ))
   (  segid "    " and resid 31   and name HD1%)
      2.800     1.000     1.000 peak  1176 spectrum    2 weight  0.10000E+01 volume  0.18711E-02 ppm1      3.577 ppm2      0.672 CV     1
 ASSI { 1178}
   (( segid "    " and resid 77   and name HA  ))
   (( segid "    " and resid 77   and name HB  ))
      2.500     0.800     0.800 peak  1178 spectrum    2 weight  0.10000E+01 volume  0.24314E-02 ppm1      4.487 ppm2      2.373 CV     1
 ASSI { 1179}
   (( segid "    " and resid 77   and name HA  ))
   (  segid "    " and resid 80   and name HE% )
      2.600     0.800     0.800 peak  1179 spectrum    2 weight  0.10000E+01 volume  0.19229E-02 ppm1      4.485 ppm2      1.893 CV     1
 ASSI { 1180}
   (( segid "    " and resid 77   and name HA  ))
   (  segid "    " and resid 85   and name HG2%)
      3.600     1.700     1.700 peak  1180 spectrum    2 weight  0.10000E+01 volume  0.68977E-03 ppm1      4.485 ppm2      0.908 CV     1
 ASSI { 1181}
   (( segid "    " and resid 77   and name HA  ))
   (  segid "    " and resid 77   and name HG1%)
      2.400     0.700     0.700 peak  1181 spectrum    2 weight  0.10000E+01 volume  0.41161E-02 ppm1      4.485 ppm2      0.763 CV     1
 ASSI { 1182}
   (( segid "    " and resid 77   and name HA  ))
   (  segid "    " and resid 75   and name HG1%)
      3.800     1.800     1.800 peak  1182 spectrum    2 weight  0.10000E+01 volume  0.88749E-03 ppm1      4.480 ppm2      0.682 CV     1
 ASSI { 1183}
   (( segid "    " and resid 77   and name HA  ))
   (  segid "    " and resid 77   and name HG2%)
      3.400     1.400     1.400 peak  1183 spectrum    2 weight  0.10000E+01 volume  0.12073E-02 ppm1      4.484 ppm2      0.417 CV     1
 ASSI { 1184}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 96   and name HG2%)
      2.700     0.900     0.900 peak  1184 spectrum    2 weight  0.10000E+01 volume  0.55678E-02 ppm1      4.307 ppm2      0.871 CV     1
 ASSI { 1186}
   (( segid "    " and resid 82   and name HA  ))
   (  segid "    " and resid 86   and name HG2%)
      4.500     2.500     1.500 peak  1186 spectrum    2 weight  0.10000E+01 volume  0.19169E-03 ppm1      3.586 ppm2      1.024 CV     1
 ASSI { 1189}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HG12))
      2.900     1.000     1.000 peak  1189 spectrum    2 weight  0.10000E+01 volume  0.14797E-02 ppm1      4.271 ppm2      1.395 CV     1
 OR { 1189}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HG11))
 ASSI { 1190}
   (( segid "    " and resid 24   and name HA  ))
   (  segid "    " and resid 24   and name HG2%)
      2.200     0.600     0.600 peak  1190 spectrum    2 weight  0.10000E+01 volume  0.11622E-01 ppm1      4.285 ppm2      1.129 CV     1
 ASSI { 1191}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 63   and name HG2%)
      2.400     0.700     0.700 peak  1191 spectrum    2 weight  0.10000E+01 volume  0.43101E-02 ppm1      4.267 ppm2      0.763 CV     1
 ASSI { 1192}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 35   and name HA  ))
      2.600     2.600     3.400 peak  1192 spectrum    2 weight  0.10000E+01 volume  0.68623E-03 ppm1      4.468 ppm2      4.086 CV     1
 ASSI { 1193}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HB  ))
      2.200     0.600     0.600 peak  1193 spectrum    2 weight  0.10000E+01 volume  0.71793E-02 ppm1      4.470 ppm2      4.235 CV     1
 ASSI { 1194}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 44   and name HG2%)
      2.400     0.700     0.700 peak  1194 spectrum    2 weight  0.10000E+01 volume  0.62055E-02 ppm1      4.470 ppm2      1.117 CV     1
 ASSI { 1195}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 43   and name HB% )
      3.100     1.200     1.200 peak  1195 spectrum    2 weight  0.10000E+01 volume  0.27096E-03 ppm1      4.460 ppm2      1.318 CV     1
 ASSI { 1199}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 86   and name HB  ))
      3.900     1.900     1.900 peak  1199 spectrum    2 weight  0.10000E+01 volume  0.80997E-03 ppm1      3.823 ppm2      2.120 CV     1
 OR { 1199}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 86   and name HB  ))
 ASSI { 1200}
   (( segid "    " and resid 83   and name HB1 ))
   (  segid "    " and resid 86   and name HG2%)
      4.400     2.500     1.600 peak  1200 spectrum    2 weight  0.10000E+01 volume  0.48960E-03 ppm1      3.819 ppm2      1.022 CV     1
 OR { 1200}
   (( segid "    " and resid 83   and name HB2 ))
   (  segid "    " and resid 86   and name HG2%)
 ASSI { 1202}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HB  ))
      2.800     1.000     1.000 peak  1202 spectrum    2 weight  0.10000E+01 volume  0.15588E-02 ppm1      3.862 ppm2      1.324 CV     1
 ASSI { 1203}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HG11))
      3.600     1.600     1.600 peak  1203 spectrum    2 weight  0.10000E+01 volume  0.56612E-03 ppm1      3.848 ppm2      1.411 CV     1
 OR { 1203}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HG12))
 ASSI { 1204}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 69   and name HD1%)
      2.100     0.500     0.500 peak  1204 spectrum    2 weight  0.10000E+01 volume  0.62505E-02 ppm1      3.865 ppm2      0.514 CV     1
 ASSI { 1205}
   (( segid "    " and resid 39   and name HA  ))
   (  segid "    " and resid 39   and name HG2%)
      2.300     0.700     0.700 peak  1205 spectrum    2 weight  0.10000E+01 volume  0.70033E-02 ppm1      4.340 ppm2      1.122 CV     1
 ASSI { 1206}
   (( segid "    " and resid 75   and name HA  ))
   (  segid "    " and resid 75   and name HG1%)
      2.100     0.500     0.500 peak  1206 spectrum    2 weight  0.10000E+01 volume  0.12195E-01 ppm1      3.833 ppm2      0.679 CV     1
 ASSI { 1208}
   (( segid "    " and resid 75   and name HA  ))
   (  segid "    " and resid 75   and name HG2%)
      2.300     0.600     0.600 peak  1208 spectrum    2 weight  0.10000E+01 volume  0.75129E-02 ppm1      3.828 ppm2      0.848 CV     1
 ASSI { 1210}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HG2 ))
      3.200     1.300     1.300 peak  1210 spectrum    2 weight  0.10000E+01 volume  0.33497E-02 ppm1      4.271 ppm2      1.890 CV     1
 OR { 1210}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HG1 ))
 ASSI { 1212}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 95   and name HB2 ))
      3.200     1.300     1.300 peak  1212 spectrum    2 weight  0.10000E+01 volume  0.48076E-03 ppm1      4.267 ppm2      1.463 CV     1
 OR { 1212}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 95   and name HB1 ))
 ASSI { 1214}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 48   and name HG2%)
      2.000     0.500     0.500 peak  1214 spectrum    2 weight  0.10000E+01 volume  0.85988E-02 ppm1      3.681 ppm2      0.680 CV     1
 ASSI { 1215}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 48   and name HG1%)
      2.100     0.500     0.500 peak  1215 spectrum    2 weight  0.10000E+01 volume  0.80458E-02 ppm1      3.684 ppm2      0.561 CV     1
 ASSI { 1217}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HG1 ))
      2.900     1.000     1.000 peak  1217 spectrum    2 weight  0.10000E+01 volume  0.46590E-02 ppm1      3.790 ppm2      2.126 CV     1
 OR { 1217}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HG2 ))
 ASSI { 1220}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 20   and name HD2 ))
      3.800     1.800     1.800 peak  1220 spectrum    2 weight  0.10000E+01 volume  0.98529E-03 ppm1      3.863 ppm2      2.872 CV     1
 OR { 1220}
   (( segid "    " and resid 25   and name HB1 ))
   (( segid "    " and resid 20   and name HD2 ))
 OR { 1220}
   (( segid "    " and resid 25   and name HB2 ))
   (( segid "    " and resid 20   and name HD1 ))
 OR { 1220}
   (( segid "    " and resid 25   and name HB1 ))
   (( segid "    " and resid 20   and name HD1 ))
 ASSI { 1221}
   (( segid "    " and resid 26   and name HB2 ))
   (  segid "    " and resid 24   and name HG2%)
      2.800     2.800     3.200 peak  1221 spectrum    2 weight  0.10000E+01 volume  0.45962E-03 ppm1      3.872 ppm2      1.123 CV     1
 OR { 1221}
   (( segid "    " and resid 26   and name HB1 ))
   (  segid "    " and resid 24   and name HG2%)
 ASSI { 1226}
   (( segid "    " and resid 53   and name HA  ))
   (  segid "    " and resid 58   and name HB% )
      2.700     0.900     0.900 peak  1226 spectrum    2 weight  0.10000E+01 volume  0.22977E-02 ppm1      4.125 ppm2      1.364 CV     1
 ASSI { 1227}
   (( segid "    " and resid 53   and name HA  ))
   (  segid "    " and resid 52   and name HG2%)
      4.600     2.700     1.400 peak  1227 spectrum    2 weight  0.10000E+01 volume  0.14304E-03 ppm1      4.124 ppm2      0.878 CV     1
 ASSI { 1228}
   (( segid "    " and resid 12   and name HB2 ))
   (  segid "    " and resid 104  and name HD2%)
      2.700     0.900     0.900 peak  1228 spectrum    2 weight  0.10000E+01 volume  0.39218E-02 ppm1      3.650 ppm2      0.741 CV     1
 OR { 1228}
   (( segid "    " and resid 12   and name HB1 ))
   (  segid "    " and resid 104  and name HD2%)
 ASSI { 1229}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 49   and name HE2 ))
      3.400     1.400     1.400 peak  1229 spectrum    2 weight  0.10000E+01 volume  0.83011E-03 ppm1      3.655 ppm2      2.846 CV     1
 OR { 1229}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 49   and name HE1 ))
 OR { 1229}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 49   and name HE2 ))
 OR { 1229}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 49   and name HE1 ))
 ASSI { 1232}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 49   and name HD1 ))
      2.900     1.100     1.100 peak  1232 spectrum    2 weight  0.10000E+01 volume  0.21195E-02 ppm1      3.657 ppm2      1.494 CV     1
 OR { 1232}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 49   and name HD2 ))
 OR { 1232}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 49   and name HD1 ))
 OR { 1232}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 49   and name HD2 ))
 ASSI { 1233}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 49   and name HG1 ))
      3.900     1.900     1.900 peak  1233 spectrum    2 weight  0.10000E+01 volume  0.97046E-03 ppm1      3.651 ppm2      1.320 CV     1
 OR { 1233}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 49   and name HG1 ))
 OR { 1233}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 49   and name HG2 ))
 OR { 1233}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 49   and name HG2 ))
 ASSI { 1241}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 49   and name HB1 ))
      2.900     1.100     1.100 peak  1241 spectrum    2 weight  0.10000E+01 volume  0.15850E-02 ppm1      3.653 ppm2      1.377 CV     1
 OR { 1241}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 49   and name HB1 ))
 OR { 1241}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 49   and name HB2 ))
 OR { 1241}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 49   and name HB2 ))
 ASSI { 1242}
   (( segid "    " and resid 15   and name HB1 ))
   (( segid "    " and resid 15   and name HA  ))
      2.300     0.600     0.600 peak  1242 spectrum    2 weight  0.10000E+01 volume  0.60519E-02 ppm1      3.617 ppm2      5.456 CV     1
 OR { 1242}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI { 1243}
   (( segid "    " and resid 15   and name HB2 ))
   (  segid "    " and resid 99   and name HD1%)
      2.400     0.700     0.700 peak  1243 spectrum    2 weight  0.10000E+01 volume  0.62833E-02 ppm1      3.615 ppm2      0.687 CV     1
 OR { 1243}
   (( segid "    " and resid 15   and name HB1 ))
   (  segid "    " and resid 99   and name HD1%)
 ASSI { 1245}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 91   and name HB1 ))
      3.600     1.600     1.600 peak  1245 spectrum    2 weight  0.10000E+01 volume  0.39851E-03 ppm1      3.561 ppm2      2.839 CV     1
 OR { 1245}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 91   and name HB2 ))
 ASSI { 1250}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 72   and name HG1%)
      4.300     2.300     1.700 peak  1250 spectrum    2 weight  0.10000E+01 volume  0.46799E-03 ppm1      3.579 ppm2      0.563 CV     1
 ASSI { 1251}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 75   and name HG2%)
      4.400     2.400     1.600 peak  1251 spectrum    2 weight  0.10000E+01 volume  0.38495E-03 ppm1      3.563 ppm2      0.842 CV     1
 ASSI { 1253}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 88   and name HB  ))
      2.500     0.800     0.800 peak  1253 spectrum    2 weight  0.10000E+01 volume  0.30154E-02 ppm1      3.410 ppm2      2.160 CV     1
 ASSI { 1254}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 85   and name HB  ))
      3.200     1.300     1.300 peak  1254 spectrum    2 weight  0.10000E+01 volume  0.90036E-03 ppm1      3.411 ppm2      1.987 CV     1
 ASSI { 1255}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 80   and name HE% )
      3.100     1.200     1.200 peak  1255 spectrum    2 weight  0.10000E+01 volume  0.91125E-03 ppm1      3.406 ppm2      1.891 CV     1
 ASSI { 1256}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 85   and name HG2%)
      2.600     0.800     0.800 peak  1256 spectrum    2 weight  0.10000E+01 volume  0.32101E-02 ppm1      3.410 ppm2      0.908 CV     1
 ASSI { 1257}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 88   and name HG2%)
      2.600     0.900     0.900 peak  1257 spectrum    2 weight  0.10000E+01 volume  0.34196E-02 ppm1      3.413 ppm2      0.959 CV     1
 ASSI { 1258}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 85   and name HG1%)
      2.400     0.700     0.700 peak  1258 spectrum    2 weight  0.10000E+01 volume  0.49973E-02 ppm1      3.411 ppm2      0.733 CV     1
 ASSI { 1261}
   (( segid "    " and resid 86   and name HA  ))
   (  segid "    " and resid 86   and name HG1%)
      2.400     0.700     0.700 peak  1261 spectrum    2 weight  0.10000E+01 volume  0.45800E-02 ppm1      3.413 ppm2      0.876 CV     1
 ASSI { 1262}
   (( segid "    " and resid 86   and name HA  ))
   (  segid "    " and resid 89   and name HD1%)
      2.400     0.700     0.700 peak  1262 spectrum    2 weight  0.10000E+01 volume  0.44314E-02 ppm1      3.414 ppm2      0.687 CV     1
 ASSI { 1264}
   (( segid "    " and resid 24   and name HB  ))
   (  segid "    " and resid 24   and name HG2%)
      2.000     0.500     0.500 peak  1264 spectrum    2 weight  0.10000E+01 volume  0.13783E-01 ppm1      4.190 ppm2      1.091 CV     1
 ASSI { 1265}
   (( segid "    " and resid 40   and name HB  ))
   (  segid "    " and resid 40   and name HG2%)
      2.100     0.600     0.600 peak  1265 spectrum    2 weight  0.10000E+01 volume  0.11935E-01 ppm1      4.290 ppm2      1.128 CV     1
 ASSI { 1267}
   (( segid "    " and resid 44   and name HB  ))
   (  segid "    " and resid 44   and name HG2%)
      2.000     0.500     0.500 peak  1267 spectrum    2 weight  0.10000E+01 volume  0.13197E-01 ppm1      4.234 ppm2      1.117 CV     1
 ASSI { 1268}
   (  segid "    " and resid 8    and name HB% )
   (  segid "    " and resid 5    and name HD% )
      3.400     1.400     1.400 peak  1268 spectrum    2 weight  0.10000E+01 volume  0.76382E-03 ppm1      1.289 ppm2      7.080 CV     1
 ASSI { 1269}
   (  segid "    " and resid 8    and name HB% )
   (  segid "    " and resid 5    and name HE% )
      3.100     3.100     2.900 peak  1269 spectrum    2 weight  0.10000E+01 volume  0.25686E-03 ppm1      1.282 ppm2      6.825 CV     1
 ASSI { 1270}
   (( segid "    " and resid 4    and name HA2 ))
   (  segid "    " and resid 5    and name HD% )
      4.300     2.400     1.700 peak  1270 spectrum    2 weight  0.10000E+01 volume  0.30413E-03 ppm1      3.789 ppm2      7.080 CV     1
 OR { 1270}
   (( segid "    " and resid 4    and name HA1 ))
   (  segid "    " and resid 5    and name HD% )
 ASSI { 1271}
   (( segid "    " and resid 4    and name HA2 ))
   (  segid "    " and resid 5    and name HE% )
      4.500     2.500     1.500 peak  1271 spectrum    2 weight  0.10000E+01 volume  0.27136E-03 ppm1      3.776 ppm2      6.793 CV     1
 OR { 1271}
   (( segid "    " and resid 4    and name HA1 ))
   (  segid "    " and resid 5    and name HE% )
 ASSI { 1272}
   (  segid "    " and resid 101  and name HG2%)
   (  segid "    " and resid 11   and name HD% )
      3.800     1.800     1.800 peak  1272 spectrum    2 weight  0.10000E+01 volume  0.89812E-03 ppm1      0.768 ppm2      7.083 CV     1
 ASSI { 1273}
   (  segid "    " and resid 101  and name HG2%)
   (  segid "    " and resid 14   and name HD% )
      4.200     2.200     1.800 peak  1273 spectrum    2 weight  0.10000E+01 volume  0.83351E-03 ppm1      0.766 ppm2      6.835 CV     1
 ASSI { 1274}
   (  segid "    " and resid 34   and name HE% )
   (  segid "    " and resid 47   and name HE% )
      3.700     1.700     1.700 peak  1274 spectrum    2 weight  0.10000E+01 volume  0.66533E-03 ppm1      1.846 ppm2      6.741 CV     1
 ASSI { 1276}
   (( segid "    " and resid 103  and name HD2 ))
   (  segid "    " and resid 11   and name HD% )
      2.400     2.400     3.600 peak  1276 spectrum    2 weight  0.10000E+01 volume  0.11144E-02 ppm1      2.994 ppm2      7.090 CV     1
 ASSI { 1277}
   (( segid "    " and resid 35   and name HD2 ))
   (  segid "    " and resid 47   and name HE% )
      3.000     3.000     3.000 peak  1277 spectrum    2 weight  0.10000E+01 volume  0.32903E-03 ppm1      3.014 ppm2      6.767 CV     1
 OR { 1277}
   (( segid "    " and resid 35   and name HD1 ))
   (  segid "    " and resid 47   and name HE% )
 ASSI { 1278}
   (( segid "    " and resid 103  and name HD2 ))
   (( segid "    " and resid 11   and name HZ  ))
      4.200     2.200     1.800 peak  1278 spectrum    2 weight  0.10000E+01 volume  0.24468E-03 ppm1      2.996 ppm2      7.345 CV     1
 OR { 1278}
   (( segid "    " and resid 103  and name HD1 ))
   (( segid "    " and resid 11   and name HZ  ))
 ASSI { 1279}
   (( segid "    " and resid 11   and name HB2 ))
   (  segid "    " and resid 11   and name HD% )
      3.300     1.400     1.400 peak  1279 spectrum    2 weight  0.10000E+01 volume  0.62921E-03 ppm1      2.803 ppm2      7.088 CV     1
 OR { 1279}
   (( segid "    " and resid 11   and name HB1 ))
   (  segid "    " and resid 11   and name HD% )
 ASSI { 1280}
   (( segid "    " and resid 11   and name HB2 ))
   (  segid "    " and resid 5    and name HE% )
      2.700     2.700     3.300 peak  1280 spectrum    2 weight  0.10000E+01 volume  0.66093E-03 ppm1      2.790 ppm2      6.833 CV     1
 OR { 1280}
   (( segid "    " and resid 11   and name HB1 ))
   (  segid "    " and resid 5    and name HE% )
 ASSI { 1281}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 47   and name HD% )
      3.400     1.400     1.400 peak  1281 spectrum    2 weight  0.10000E+01 volume  0.56080E-03 ppm1      2.605 ppm2      6.980 CV     1
 OR { 1281}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 47   and name HD% )
 ASSI { 1282}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 47   and name HE% )
      4.100     2.100     1.900 peak  1282 spectrum    2 weight  0.10000E+01 volume  0.93871E-03 ppm1      2.627 ppm2      6.743 CV     1
 OR { 1282}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 47   and name HE% )
 ASSI { 1283}
   (( segid "    " and resid 14   and name HB2 ))
   (  segid "    " and resid 14   and name HD% )
      3.300     1.400     1.400 peak  1283 spectrum    2 weight  0.10000E+01 volume  0.62319E-03 ppm1      2.829 ppm2      6.834 CV     1
 OR { 1283}
   (( segid "    " and resid 14   and name HB1 ))
   (  segid "    " and resid 14   and name HD% )
 ASSI { 1284}
   (( segid "    " and resid 19   and name HB2 ))
   (  segid "    " and resid 19   and name HD% )
      2.800     1.000     1.000 peak  1284 spectrum    2 weight  0.10000E+01 volume  0.15999E-02 ppm1      2.878 ppm2      7.238 CV     1
 OR { 1284}
   (( segid "    " and resid 19   and name HB1 ))
   (  segid "    " and resid 19   and name HD% )
 ASSI { 1285}
   (( segid "    " and resid 19   and name HB2 ))
   (  segid "    " and resid 19   and name HE% )
      4.300     2.300     1.700 peak  1285 spectrum    2 weight  0.10000E+01 volume  0.71091E-03 ppm1      2.876 ppm2      7.303 CV     1
 OR { 1285}
   (( segid "    " and resid 19   and name HB1 ))
   (  segid "    " and resid 19   and name HE% )
 ASSI { 1286}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HZ  ))
      3.500     3.500     2.500 peak  1286 spectrum    2 weight  0.10000E+01 volume  0.20195E-02 ppm1      2.872 ppm2      6.992 CV     1
 OR { 1286}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 19   and name HZ  ))
 ASSI { 1287}
   (  segid "    " and resid 101  and name HD1%)
   (( segid "    " and resid 11   and name HZ  ))
      4.700     2.800     1.300 peak  1287 spectrum    2 weight  0.10000E+01 volume  0.36710E-03 ppm1      0.440 ppm2      7.337 CV     1
 ASSI { 1288}
   (  segid "    " and resid 101  and name HD1%)
   (  segid "    " and resid 11   and name HD% )
      2.900     1.100     1.100 peak  1288 spectrum    2 weight  0.10000E+01 volume  0.14663E-02 ppm1      0.432 ppm2      7.086 CV     1
 ASSI { 1289}
   (  segid "    " and resid 101  and name HD1%)
   (  segid "    " and resid 14   and name HD% )
      4.200     2.200     1.800 peak  1289 spectrum    2 weight  0.10000E+01 volume  0.10255E-02 ppm1      0.434 ppm2      6.826 CV     1
 ASSI { 1290}
   (( segid "    " and resid 5    and name HB2 ))
   (  segid "    " and resid 5    and name HD% )
      2.600     0.900     0.900 peak  1290 spectrum    2 weight  0.10000E+01 volume  0.26746E-02 ppm1      2.923 ppm2      7.074 CV     1
 OR { 1290}
   (( segid "    " and resid 5    and name HB1 ))
   (  segid "    " and resid 5    and name HD% )
 ASSI { 1291}
   (( segid "    " and resid 5    and name HB2 ))
   (  segid "    " and resid 5    and name HE% )
      3.500     1.500     1.500 peak  1291 spectrum    2 weight  0.10000E+01 volume  0.29129E-02 ppm1      2.924 ppm2      6.811 CV     1
 OR { 1291}
   (( segid "    " and resid 5    and name HB1 ))
   (  segid "    " and resid 5    and name HE% )
 ASSI { 1292}
   (( segid "    " and resid 9    and name HB2 ))
   (  segid "    " and resid 11   and name HD% )
      3.700     1.700     1.700 peak  1292 spectrum    2 weight  0.10000E+01 volume  0.40474E-03 ppm1      3.763 ppm2      7.070 CV     1
 OR { 1292}
   (( segid "    " and resid 9    and name HB1 ))
   (  segid "    " and resid 11   and name HD% )
 ASSI { 1293}
   (( segid "    " and resid 34   and name HG1 ))
   (  segid "    " and resid 47   and name HE% )
      4.400     2.400     1.600 peak  1293 spectrum    2 weight  0.10000E+01 volume  0.44079E-03 ppm1      2.343 ppm2      6.752 CV     1
 OR { 1293}
   (( segid "    " and resid 34   and name HG2 ))
   (  segid "    " and resid 47   and name HE% )
 ASSI { 1294}
   (( segid "    " and resid 34   and name HG1 ))
   (  segid "    " and resid 47   and name HD% )
      4.700     2.800     1.300 peak  1294 spectrum    2 weight  0.10000E+01 volume  0.34313E-03 ppm1      2.346 ppm2      6.971 CV     1
 OR { 1294}
   (( segid "    " and resid 34   and name HG2 ))
   (  segid "    " and resid 47   and name HD% )
 ASSI { 1295}
   (( segid "    " and resid 5    and name HA  ))
   (  segid "    " and resid 5    and name HE% )
      3.400     1.500     1.500 peak  1295 spectrum    2 weight  0.10000E+01 volume  0.20454E-02 ppm1      4.482 ppm2      6.812 CV     1
 ASSI { 1296}
   (( segid "    " and resid 5    and name HA  ))
   (  segid "    " and resid 5    and name HD% )
      2.800     1.000     1.000 peak  1296 spectrum    2 weight  0.10000E+01 volume  0.23564E-02 ppm1      4.481 ppm2      7.072 CV     1
 ASSI { 1297}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 14   and name HD% )
      3.600     1.600     1.600 peak  1297 spectrum    2 weight  0.10000E+01 volume  0.62067E-03 ppm1      4.836 ppm2      6.837 CV     1
 ASSI { 1298}
   (( segid "    " and resid 11   and name HA  ))
   (  segid "    " and resid 11   and name HD% )
      3.400     1.400     1.400 peak  1298 spectrum    2 weight  0.10000E+01 volume  0.62840E-03 ppm1      5.273 ppm2      7.092 CV     1
 ASSI { 1299}
   (( segid "    " and resid 11   and name HA  ))
   (  segid "    " and resid 14   and name HD% )
      4.600     2.600     1.400 peak  1299 spectrum    2 weight  0.10000E+01 volume  0.34574E-03 ppm1      5.279 ppm2      6.834 CV     1
 ASSI { 1300}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 3    and name HE1 ))
      4.300     2.300     1.700 peak  1300 spectrum    2 weight  0.10000E+01 volume  0.55894E-03 ppm1      2.937 ppm2      7.112 CV     1
 OR { 1300}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 3    and name HE1 ))
 ASSI { 1301}
   (( segid "    " and resid 3    and name HB1 ))
   (( segid "    " and resid 3    and name HD2 ))
      3.400     1.500     1.500 peak  1301 spectrum    2 weight  0.10000E+01 volume  0.84702E-03 ppm1      2.937 ppm2      6.798 CV     1
 OR { 1301}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 3    and name HD2 ))
 ASSI { 1304}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 47   and name HD% )
      3.300     1.300     1.300 peak  1304 spectrum    2 weight  0.10000E+01 volume  0.73693E-03 ppm1      4.183 ppm2      6.969 CV     1
 ASSI { 1305}
   (( segid "    " and resid 66   and name HA  ))
   (  segid "    " and resid 47   and name HE% )
      2.400     2.400     3.600 peak  1305 spectrum    2 weight  0.10000E+01 volume  0.11924E-02 ppm1      4.187 ppm2      6.734 CV     1
 ASSI { 1306}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 11   and name HD% )
      3.400     1.400     1.400 peak  1306 spectrum    2 weight  0.10000E+01 volume  0.80821E-03 ppm1      4.227 ppm2      7.085 CV     1
 ASSI { 1307}
   (( segid "    " and resid 103  and name HA  ))
   (  segid "    " and resid 14   and name HD% )
      2.800     2.800     3.200 peak  1307 spectrum    2 weight  0.10000E+01 volume  0.47191E-03 ppm1      4.220 ppm2      6.838 CV     1
 ASSI { 1308}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 3    and name HE1 ))
      4.900     3.100     1.100 peak  1308 spectrum    2 weight  0.10000E+01 volume  0.18159E-03 ppm1      4.522 ppm2      7.109 CV     1
 ASSI { 1309}
   (( segid "    " and resid 3    and name HA  ))
   (( segid "    " and resid 3    and name HD2 ))
      3.900     1.900     1.900 peak  1309 spectrum    2 weight  0.10000E+01 volume  0.37623E-03 ppm1      4.518 ppm2      6.801 CV     1
 ASSI { 1310}
   (( segid "    " and resid 47   and name HA  ))
   (  segid "    " and resid 47   and name HD% )
      4.700     2.700     1.300 peak  1310 spectrum    2 weight  0.10000E+01 volume  0.26444E-03 ppm1      5.111 ppm2      6.967 CV     1
 ASSI { 1311}
   (( segid "    " and resid 47   and name HA  ))
   (  segid "    " and resid 47   and name HE% )
      4.600     2.600     1.400 peak  1311 spectrum    2 weight  0.10000E+01 volume  0.45541E-03 ppm1      5.126 ppm2      6.718 CV     1
 ASSI { 1312}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 47   and name HD% )
      6.000     5.800     0.000 peak  1312 spectrum    2 weight  0.10000E+01 volume  0.38374E-04 ppm1      4.495 ppm2      6.959 CV     1
 ASSI { 1313}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 47   and name HE% )
      3.800     1.800     1.800 peak  1313 spectrum    2 weight  0.10000E+01 volume  0.44868E-03 ppm1      4.487 ppm2      6.743 CV     1
 ASSI { 1314}
   (( segid "    " and resid 101  and name HG11))
   (  segid "    " and resid 11   and name HD% )
      4.400     2.400     1.600 peak  1314 spectrum    2 weight  0.10000E+01 volume  0.15281E-03 ppm1      0.848 ppm2      7.087 CV     1
 OR { 1314}
   (( segid "    " and resid 101  and name HG12))
   (  segid "    " and resid 11   and name HD% )
 ASSI { 1315}
   (( segid "    " and resid 101  and name HG12))
   (  segid "    " and resid 14   and name HD% )
      5.300     3.500     0.700 peak  1315 spectrum    2 weight  0.10000E+01 volume  0.13670E-03 ppm1      0.848 ppm2      6.825 CV     1
 OR { 1315}
   (( segid "    " and resid 101  and name HG11))
   (  segid "    " and resid 14   and name HD% )
 ASSI { 1318}
   (( segid "    " and resid 103  and name HG1 ))
   (  segid "    " and resid 11   and name HD% )
      3.000     1.100     1.100 peak  1318 spectrum    2 weight  0.10000E+01 volume  0.73093E-03 ppm1      1.387 ppm2      7.085 CV     1
 ASSI { 1319}
   (  segid "    " and resid 100  and name HD1%)
   (  segid "    " and resid 14   and name HE% )
      3.900     1.900     1.900 peak  1319 spectrum    2 weight  0.10000E+01 volume  0.52767E-03 ppm1      0.532 ppm2      6.333 CV     1
 ASSI { 1320}
   (  segid "    " and resid 13   and name HD1%)
   (  segid "    " and resid 5    and name HD% )
      2.900     1.100     1.100 peak  1320 spectrum    2 weight  0.10000E+01 volume  0.16088E-02 ppm1      0.693 ppm2      7.078 CV     1
 ASSI { 1321}
   (  segid "    " and resid 13   and name HD1%)
   (  segid "    " and resid 5    and name HE% )
      2.400     2.400     3.600 peak  1321 spectrum    2 weight  0.10000E+01 volume  0.11020E-02 ppm1      0.701 ppm2      6.810 CV     1
 ASSI {   20}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
      4.700     2.800     1.300 peak    20 spectrum    1 weight  0.10000E+01 volume  0.33885E-03 ppm1      9.432 ppm2      3.761 CV     1
 OR {   20}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 30   and name HB2 ))
 ASSI {   41}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HB1 ))
      3.000     1.200     1.200 peak    41 spectrum    1 weight  0.10000E+01 volume  0.96558E-03 ppm1      9.113 ppm2      1.491 CV     1
 OR {   41}
   (( segid "    " and resid 19   and name HN  ))
   (  segid "    " and resid 56   and name HB% )
 ASSI {   87}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 100  and name HD2%)
      4.000     2.000     2.000 peak    87 spectrum    1 weight  0.10000E+01 volume  0.11429E-02 ppm1      8.962 ppm2      0.667 CV     1
 OR {   87}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 99   and name HD2%)
 ASSI {  190}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 46   and name HD1%)
      3.400     1.400     1.400 peak   190 spectrum    1 weight  0.10000E+01 volume  0.23422E-02 ppm1      8.728 ppm2      0.589 CV     1
 OR {  190}
   (( segid "    " and resid 18   and name HN  ))
   (  segid "    " and resid 98   and name HD1%)
 ASSI {  191}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      2.900     1.000     1.000 peak   191 spectrum    1 weight  0.10000E+01 volume  0.26575E-02 ppm1      8.725 ppm2      0.676 CV     1
 OR {  191}
   (( segid "    " and resid 18   and name HN  ))
   (  segid "    " and resid 18   and name HD1%)
 ASSI {  281}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      2.700     0.900     0.900 peak   281 spectrum    1 weight  0.10000E+01 volume  0.27296E-02 ppm1      8.615 ppm2      4.044 CV     1
 OR {  281}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI {  286}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 99   and name HD1%)
      3.900     1.900     1.900 peak   286 spectrum    1 weight  0.10000E+01 volume  0.10589E-02 ppm1      8.595 ppm2      0.687 CV     1
 OR {  286}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 100  and name HD2%)
 OR {  286}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 98   and name HD2%)
 ASSI {  297}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 100  and name HD2%)
      3.500     3.500     2.500 peak   297 spectrum    1 weight  0.10000E+01 volume  0.10605E-02 ppm1      8.555 ppm2      0.677 CV     1
 OR {  297}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
 ASSI {  431}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.300     0.600     0.600 peak   431 spectrum    1 weight  0.10000E+01 volume  0.74943E-02 ppm1      8.352 ppm2      4.476 CV     1
 OR {  431}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  487}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 106  and name HD2%)
      5.000     3.100     1.000 peak   487 spectrum    1 weight  0.10000E+01 volume  0.17617E-03 ppm1      8.239 ppm2      0.724 CV     1
 OR {  487}
   (( segid "    " and resid 9    and name HN  ))
   (  segid "    " and resid 104  and name HD1%)
 ASSI {  534}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      3.200     1.300     1.300 peak   534 spectrum    1 weight  0.10000E+01 volume  0.96853E-03 ppm1      8.200 ppm2      3.412 CV     1
 OR {  534}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI {  577}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 16   and name HG2%)
      4.000     2.000     2.000 peak   577 spectrum    1 weight  0.10000E+01 volume  0.75802E-03 ppm1      8.109 ppm2      0.747 CV     1
 OR {  577}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 18   and name HD2%)
 ASSI {  682}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      3.500     1.600     1.600 peak   682 spectrum    1 weight  0.10000E+01 volume  0.44576E-03 ppm1      7.944 ppm2      1.409 CV     1
 OR {  682}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 20   and name HB1 ))
 ASSI {  692}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 46   and name HD1%)
      4.600     2.600     1.400 peak   692 spectrum    1 weight  0.10000E+01 volume  0.45396E-03 ppm1      7.896 ppm2      0.592 CV     1
 OR {  692}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 31   and name HG2%)
 OR {  692}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 29   and name HG2%)
 ASSI {  836}
   (( segid "    " and resid 37   and name HE21))
   (( segid "    " and resid 37   and name HN  ))
      4.100     2.100     1.900 peak   836 spectrum    1 weight  0.10000E+01 volume  0.36446E-03 ppm1      7.499 ppm2      8.342 CV     1
 OR {  836}
   (( segid "    " and resid 78   and name HE21))
   (( segid "    " and resid 46   and name HN  ))
 ASSI {  851}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 89   and name HD1%)
      3.600     1.600     1.600 peak   851 spectrum    1 weight  0.10000E+01 volume  0.14626E-02 ppm1      7.467 ppm2      0.675 CV     1
 OR {  851}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 52   and name HD1%)
 OR {  851}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 48   and name HG2%)
 ASSI {  884}
   (( segid "    " and resid 82   and name HE21))
   (  segid "    " and resid 46   and name HD1%)
      2.900     2.900     3.100 peak   884 spectrum    1 weight  0.10000E+01 volume  0.44038E-03 ppm1      7.342 ppm2      0.588 CV     1
 OR {  884}
   (( segid "    " and resid 82   and name HE21))
   (  segid "    " and resid 31   and name HG2%)
 ASSI {  926}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      4.500     2.500     1.500 peak   926 spectrum    1 weight  0.10000E+01 volume  0.32489E-03 ppm1      6.979 ppm2      3.574 CV     1
 OR {  926}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 93   and name HA2 ))
 ASSI {  940}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 85   and name HB  ))
      3.900     1.900     1.900 peak   940 spectrum    1 weight  0.10000E+01 volume  0.74354E-03 ppm1      6.966 ppm2      2.003 CV     1
 OR {  940}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 82   and name HB1 ))
 ASSI { 1093}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 63   and name HG2%)
      3.600     3.600     2.400 peak  1093 spectrum    1 weight  0.10000E+01 volume  0.10542E-02 ppm1      7.936 ppm2      0.757 CV     1
 OR { 1093}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 68   and name HG1 ))
 OR { 1093}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 101  and name HG2%)
 OR { 1093}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 68   and name HG2 ))
 ASSI {   15}
   (  segid "    " and resid 52   and name HD1%)
   (( segid "    " and resid 30   and name HB1 ))
      2.300     2.300     3.700 peak    15 spectrum    2 weight  0.10000E+01 volume  0.18031E-02 ppm1      0.672 ppm2      3.675 CV     1
 OR {   15}
   (  segid "    " and resid 52   and name HD1%)
   (( segid "    " and resid 26   and name HB2 ))
 ASSI {   72}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 88   and name HB  ))
      3.400     1.400     1.400 peak    72 spectrum    2 weight  0.10000E+01 volume  0.15693E-02 ppm1      1.856 ppm2      2.175 CV     1
 OR {   72}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 75   and name HB  ))
 ASSI {   95}
   (  segid "    " and resid 29   and name HG2%)
   (( segid "    " and resid 30   and name HB2 ))
      4.100     2.100     1.900 peak    95 spectrum    2 weight  0.10000E+01 volume  0.80952E-03 ppm1      0.592 ppm2      3.774 CV     1
 OR {   95}
   (  segid "    " and resid 31   and name HG2%)
   (( segid "    " and resid 30   and name HB2 ))
 OR {   95}
   (  segid "    " and resid 29   and name HG2%)
   (( segid "    " and resid 65   and name HA  ))
 OR {   95}
   (  segid "    " and resid 29   and name HG2%)
   (( segid "    " and resid 89   and name HA  ))
 ASSI {   98}
   (  segid "    " and resid 31   and name HG2%)
   (( segid "    " and resid 85   and name HB  ))
      3.700     1.700     1.700 peak    98 spectrum    2 weight  0.10000E+01 volume  0.13836E-02 ppm1      0.591 ppm2      1.981 CV     1
 OR {   98}
   (  segid "    " and resid 31   and name HG2%)
   (( segid "    " and resid 46   and name HB  ))
 ASSI {  105}
   (  segid "    " and resid 56   and name HB% )
   (( segid "    " and resid 20   and name HD1 ))
      2.800     2.800     3.200 peak   105 spectrum    2 weight  0.10000E+01 volume  0.52087E-03 ppm1      1.499 ppm2      2.872 CV     1
 OR {  105}
   (  segid "    " and resid 56   and name HB% )
   (( segid "    " and resid 20   and name HD2 ))
 OR {  105}
   (  segid "    " and resid 56   and name HB% )
   (( segid "    " and resid 19   and name HB2 ))
 OR {  105}
   (  segid "    " and resid 56   and name HB% )
   (( segid "    " and resid 19   and name HB1 ))
 ASSI {  106}
   (  segid "    " and resid 56   and name HB% )
   (( segid "    " and resid 20   and name HA  ))
      2.700     2.700     3.300 peak   106 spectrum    2 weight  0.10000E+01 volume  0.25388E-02 ppm1      1.508 ppm2      4.256 CV     1
 OR {  106}
   (  segid "    " and resid 56   and name HB% )
   (( segid "    " and resid 60   and name HA  ))
 ASSI {  156}
   (  segid "    " and resid 57   and name HB% )
   (  segid "    " and resid 63   and name HG2%)
      2.800     2.800     3.200 peak   156 spectrum    2 weight  0.10000E+01 volume  0.26306E-02 ppm1      1.200 ppm2      0.755 CV     1
 OR {  156}
   (  segid "    " and resid 57   and name HB% )
   (  segid "    " and resid 18   and name HD2%)
 ASSI {  166}
   (  segid "    " and resid 72   and name HG2%)
   (( segid "    " and resid 89   and name HB2 ))
      4.100     2.100     1.900 peak   166 spectrum    2 weight  0.10000E+01 volume  0.50718E-03 ppm1      0.556 ppm2      1.420 CV     1
 OR {  166}
   (  segid "    " and resid 72   and name HG2%)
   (  segid "    " and resid 92   and name HB% )
 ASSI {  183}
   (  segid "    " and resid 96   and name HG1%)
   (( segid "    " and resid 96   and name HB  ))
      2.000     0.500     0.500 peak   183 spectrum    2 weight  0.10000E+01 volume  0.10690E-01 ppm1      0.743 ppm2      1.970 CV     1
 OR {  183}
   (  segid "    " and resid 85   and name HG1%)
   (( segid "    " and resid 85   and name HB  ))
 ASSI {  185}
   (  segid "    " and resid 77   and name HG1%)
   (  segid "    " and resid 72   and name HG2%)
      1.500     1.500     4.500 peak   185 spectrum    2 weight  0.10000E+01 volume  0.67127E-01 ppm1      0.746 ppm2      0.565 CV     1
 OR {  185}
   (  segid "    " and resid 88   and name HG1%)
   (  segid "    " and resid 72   and name HG1%)
 OR {  185}
   (  segid "    " and resid 88   and name HG1%)
   (  segid "    " and resid 72   and name HG2%)
 OR {  185}
   (  segid "    " and resid 85   and name HG1%)
   (  segid "    " and resid 72   and name HG2%)
 ASSI {  188}
   (  segid "    " and resid 72   and name HG1%)
   (  segid "    " and resid 92   and name HB% )
      3.000     3.000     3.000 peak   188 spectrum    2 weight  0.10000E+01 volume  0.43524E-02 ppm1      0.565 ppm2      1.417 CV     1
 OR {  188}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 69   and name HG12))
 OR {  188}
   (  segid "    " and resid 72   and name HG1%)
   (( segid "    " and resid 89   and name HB2 ))
 ASSI {  192}
   (  segid "    " and resid 48   and name HG1%)
   (( segid "    " and resid 51   and name HB2 ))
      3.800     3.800     2.200 peak   192 spectrum    2 weight  0.10000E+01 volume  0.13829E-02 ppm1      0.565 ppm2      0.958 CV     1
 OR {  192}
   (  segid "    " and resid 72   and name HG1%)
   (  segid "    " and resid 88   and name HG2%)
 ASSI {  210}
   (  segid "    " and resid 40   and name HG2%)
   (( segid "    " and resid 40   and name HB  ))
      1.900     0.500     0.500 peak   210 spectrum    2 weight  0.10000E+01 volume  0.23194E-01 ppm1      1.119 ppm2      4.285 CV     1
 OR {  210}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 24   and name HA  ))
 ASSI {  221}
   (  segid "    " and resid 16   and name HG1%)
   (( segid "    " and resid 63   and name HG11))
      3.000     1.100     1.100 peak   221 spectrum    2 weight  0.10000E+01 volume  0.18805E-02 ppm1      0.851 ppm2      1.396 CV     1
 OR {  221}
   (  segid "    " and resid 16   and name HG1%)
   (( segid "    " and resid 18   and name HG  ))
 ASSI {  239}
   (  segid "    " and resid 70   and name HD2%)
   (  segid "    " and resid 101  and name HG2%)
      2.100     2.100     3.900 peak   239 spectrum    2 weight  0.10000E+01 volume  0.89365E-02 ppm1      0.569 ppm2      0.767 CV     1
 OR {  239}
   (  segid "    " and resid 70   and name HD2%)
   (( segid "    " and resid 68   and name HG2 ))
 ASSI {  252}
   (  segid "    " and resid 86   and name HG2%)
   (( segid "    " and resid 89   and name HB2 ))
      4.400     2.400     1.600 peak   252 spectrum    2 weight  0.10000E+01 volume  0.40633E-03 ppm1      0.988 ppm2      1.419 CV     1
 OR {  252}
   (  segid "    " and resid 88   and name HG2%)
   (( segid "    " and resid 89   and name HB2 ))
 ASSI {  276}
   (  segid "    " and resid 18   and name HD2%)
   (( segid "    " and resid 57   and name HA  ))
      2.800     2.800     3.200 peak   276 spectrum    2 weight  0.10000E+01 volume  0.37777E-02 ppm1      0.760 ppm2      3.966 CV     1
 OR {  276}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 93   and name HA1 ))
 ASSI {  285}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 82   and name HG2 ))
      4.000     2.000     2.000 peak   285 spectrum    2 weight  0.10000E+01 volume  0.65239E-03 ppm1      0.902 ppm2      2.163 CV     1
 OR {  285}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 88   and name HB  ))
 OR {  285}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 82   and name HG1 ))
 ASSI {  303}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 48   and name HB  ))
      4.300     2.300     1.700 peak   303 spectrum    2 weight  0.10000E+01 volume  0.50958E-03 ppm1      0.571 ppm2      2.124 CV     1
 OR {  303}
   (  segid "    " and resid 51   and name HD2%)
   (( segid "    " and resid 65   and name HB1 ))
 ASSI {  310}
   (  segid "    " and resid 107  and name HD1%)
   (( segid "    " and resid 105  and name HG2 ))
      3.900     1.900     1.900 peak   310 spectrum    2 weight  0.10000E+01 volume  0.29695E-03 ppm1      0.793 ppm2      1.893 CV     1
 OR {  310}
   (  segid "    " and resid 107  and name HD1%)
   (( segid "    " and resid 108  and name HB1 ))
 OR {  310}
   (  segid "    " and resid 106  and name HD1%)
   (( segid "    " and resid 108  and name HB1 ))
 ASSI {  335}
   (  segid "    " and resid 18   and name HD1%)
   (( segid "    " and resid 60   and name HA  ))
      3.500     1.500     1.500 peak   335 spectrum    2 weight  0.10000E+01 volume  0.14965E-02 ppm1      0.660 ppm2      4.263 CV     1
 OR {  335}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 63   and name HA  ))
 OR {  335}
   (  segid "    " and resid 51   and name HD1%)
   (( segid "    " and resid 50   and name HA  ))
 ASSI {  342}
   (  segid "    " and resid 13   and name HD2%)
   (  segid "    " and resid 101  and name HD1%)
      2.000     2.000     4.000 peak   342 spectrum    2 weight  0.10000E+01 volume  0.16858E-01 ppm1      0.682 ppm2      0.428 CV     1
 OR {  342}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 29   and name HG12))
 ASSI {  354}
   (  segid "    " and resid 27   and name HD1%)
   (  segid "    " and resid 92   and name HB% )
      2.500     2.500     3.500 peak   354 spectrum    2 weight  0.10000E+01 volume  0.85201E-02 ppm1      0.808 ppm2      1.422 CV     1
 OR {  354}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 89   and name HB2 ))
 ASSI {  386}
   (( segid "    " and resid 20   and name HG1 ))
   (( segid "    " and resid 20   and name HA  ))
      2.400     0.700     0.700 peak   386 spectrum    2 weight  0.10000E+01 volume  0.43774E-02 ppm1      1.401 ppm2      4.241 CV     1
 OR {  386}
   (( segid "    " and resid 103  and name HG1 ))
   (( segid "    " and resid 103  and name HA  ))
 OR {  386}
   (( segid "    " and resid 20   and name HG2 ))
   (( segid "    " and resid 20   and name HA  ))
 OR {  386}
   (( segid "    " and resid 103  and name HG2 ))
   (( segid "    " and resid 103  and name HA  ))
 ASSI {  412}
   (( segid "    " and resid 104  and name HG  ))
   (( segid "    " and resid 12   and name HB2 ))
      3.600     1.600     1.600 peak   412 spectrum    2 weight  0.10000E+01 volume  0.54184E-03 ppm1      1.353 ppm2      3.667 CV     1
 OR {  412}
   (( segid "    " and resid 51   and name HG  ))
   (( segid "    " and resid 65   and name HD1 ))
 OR {  412}
   (( segid "    " and resid 104  and name HG  ))
   (( segid "    " and resid 12   and name HB1 ))
 OR {  412}
   (( segid "    " and resid 104  and name HG  ))
   (( segid "    " and resid 105  and name HD2 ))
 ASSI {  427}
   (( segid "    " and resid 63   and name HG12))
   (  segid "    " and resid 100  and name HD2%)
      3.100     3.100     2.900 peak   427 spectrum    2 weight  0.10000E+01 volume  0.11884E-02 ppm1      1.755 ppm2      0.679 CV     1
 OR {  427}
   (( segid "    " and resid 63   and name HG12))
   (  segid "    " and resid 18   and name HD1%)
 ASSI {  428}
   (( segid "    " and resid 63   and name HG12))
   (  segid "    " and resid 98   and name HD1%)
      4.300     2.400     1.700 peak   428 spectrum    2 weight  0.10000E+01 volume  0.22933E-03 ppm1      1.774 ppm2      0.578 CV     1
 OR {  428}
   (( segid "    " and resid 63   and name HG12))
   (  segid "    " and resid 51   and name HD2%)
 ASSI {  461}
   (( segid "    " and resid 78   and name HB2 ))
   (( segid "    " and resid 78   and name HG1 ))
      1.900     0.400     0.400 peak   461 spectrum    2 weight  0.10000E+01 volume  0.22545E-01 ppm1      2.091 ppm2      2.241 CV     1
 OR {  461}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HG2 ))
 OR {  461}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HG1 ))
 ASSI {  509}
   (( segid "    " and resid 85   and name HB  ))
   (  segid "    " and resid 46   and name HD1%)
      3.300     1.400     1.400 peak   509 spectrum    2 weight  0.10000E+01 volume  0.18981E-02 ppm1      1.986 ppm2      0.599 CV     1
 OR {  509}
   (( segid "    " and resid 85   and name HB  ))
   (  segid "    " and resid 31   and name HG2%)
 ASSI {  522}
   (( segid "    " and resid 65   and name HB2 ))
   (  segid "    " and resid 48   and name HG1%)
      4.300     2.300     1.700 peak   522 spectrum    2 weight  0.10000E+01 volume  0.58115E-03 ppm1      1.693 ppm2      0.570 CV     1
 OR {  522}
   (( segid "    " and resid 97   and name HB2 ))
   (  segid "    " and resid 72   and name HG1%)
 OR {  522}
   (( segid "    " and resid 97   and name HB1 ))
   (  segid "    " and resid 72   and name HG1%)
 OR {  522}
   (( segid "    " and resid 97   and name HB2 ))
   (  segid "    " and resid 98   and name HD1%)
 ASSI {  571}
   (( segid "    " and resid 82   and name HG2 ))
   (  segid "    " and resid 46   and name HD1%)
      2.900     2.900     3.100 peak   571 spectrum    2 weight  0.10000E+01 volume  0.49084E-02 ppm1      2.159 ppm2      0.597 CV     1
 OR {  571}
   (( segid "    " and resid 82   and name HG1 ))
   (  segid "    " and resid 46   and name HD1%)
 OR {  571}
   (( segid "    " and resid 82   and name HG1 ))
   (  segid "    " and resid 31   and name HG2%)
 ASSI {  577}
   (( segid "    " and resid 72   and name HB  ))
   (  segid "    " and resid 88   and name HG1%)
      2.800     1.000     1.000 peak   577 spectrum    2 weight  0.10000E+01 volume  0.27809E-02 ppm1      1.659 ppm2      0.753 CV     1
 OR {  577}
   (( segid "    " and resid 72   and name HB  ))
   (  segid "    " and resid 77   and name HG1%)
 ASSI {  608}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 34   and name HA  ))
      3.200     1.200     1.200 peak   608 spectrum    2 weight  0.10000E+01 volume  0.10725E-02 ppm1      1.930 ppm2      4.490 CV     1
 OR {  608}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 77   and name HA  ))
 ASSI {  609}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HA  ))
      3.100     1.200     1.200 peak   609 spectrum    2 weight  0.10000E+01 volume  0.86951E-03 ppm1      1.797 ppm2      4.491 CV     1
 OR {  609}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 77   and name HA  ))
 ASSI {  752}
   (( segid "    " and resid 68   and name HE2 ))
   (  segid "    " and resid 70   and name HD1%)
      4.400     2.500     1.600 peak   752 spectrum    2 weight  0.10000E+01 volume  0.49633E-03 ppm1      2.650 ppm2      0.512 CV     1
 OR {  752}
   (( segid "    " and resid 68   and name HE1 ))
   (  segid "    " and resid 70   and name HD1%)
 OR {  752}
   (( segid "    " and resid 68   and name HE2 ))
   (  segid "    " and resid 69   and name HG2%)
 OR {  752}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 69   and name HG2%)
 ASSI {  761}
   (( segid "    " and resid 97   and name HD2 ))
   (  segid "    " and resid 99   and name HD1%)
      4.300     2.300     1.700 peak   761 spectrum    2 weight  0.10000E+01 volume  0.21639E-03 ppm1      3.031 ppm2      0.682 CV     1
 OR {  761}
   (( segid "    " and resid 97   and name HD2 ))
   (  segid "    " and resid 99   and name HD2%)
 OR {  761}
   (( segid "    " and resid 97   and name HD2 ))
   (  segid "    " and resid 98   and name HD2%)
 ASSI {  762}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 35   and name HG2 ))
      1.700     0.300     0.500 peak   762 spectrum    2 weight  0.10000E+01 volume  0.42060E-01 ppm1      3.027 ppm2      1.374 CV     1
 OR {  762}
   (( segid "    " and resid 103  and name HD1 ))
   (( segid "    " and resid 103  and name HG1 ))
 OR {  762}
   (( segid "    " and resid 103  and name HD1 ))
   (( segid "    " and resid 103  and name HG2 ))
 OR {  762}
   (( segid "    " and resid 103  and name HD2 ))
   (( segid "    " and resid 103  and name HG1 ))
 OR {  762}
   (( segid "    " and resid 35   and name HD1 ))
   (( segid "    " and resid 35   and name HG1 ))
 OR {  762}
   (( segid "    " and resid 103  and name HD2 ))
   (( segid "    " and resid 103  and name HG2 ))
 OR {  762}
   (( segid "    " and resid 35   and name HD1 ))
   (( segid "    " and resid 35   and name HG2 ))
 ASSI {  849}
   (( segid "    " and resid 10   and name HA2 ))
   (  segid "    " and resid 104  and name HD1%)
      2.900     1.000     1.000 peak   849 spectrum    2 weight  0.10000E+01 volume  0.27269E-02 ppm1      3.816 ppm2      0.716 CV     1
 OR {  849}
   (( segid "    " and resid 10   and name HA2 ))
   (  segid "    " and resid 106  and name HD2%)
 OR {  849}
   (( segid "    " and resid 4    and name HA1 ))
   (  segid "    " and resid 13   and name HD1%)
 OR {  849}
   (( segid "    " and resid 10   and name HA1 ))
   (  segid "    " and resid 104  and name HD1%)
 ASSI {  903}
   (( segid "    " and resid 8    and name HA  ))
   (  segid "    " and resid 104  and name HD1%)
      4.000     4.000     2.000 peak   903 spectrum    2 weight  0.10000E+01 volume  0.60911E-03 ppm1      4.259 ppm2      0.725 CV     1
 OR {  903}
   (( segid "    " and resid 8    and name HA  ))
   (  segid "    " and resid 106  and name HD2%)
 ASSI {  925}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 71   and name HB1 ))
      2.900     1.100     1.100 peak   925 spectrum    2 weight  0.10000E+01 volume  0.13484E-02 ppm1      4.722 ppm2      1.575 CV     1
 OR {  925}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 65   and name HG2 ))
 ASSI {  932}
   (( segid "    " and resid 13   and name HA  ))
   (  segid "    " and resid 70   and name HD1%)
      3.400     1.500     1.500 peak   932 spectrum    2 weight  0.10000E+01 volume  0.15082E-02 ppm1      5.146 ppm2      0.522 CV     1
 OR {  932}
   (( segid "    " and resid 13   and name HA  ))
   (  segid "    " and resid 100  and name HD1%)
 OR {  932}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 29   and name HD1%)
 OR {  932}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI {  955}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 48   and name HG2%)
      4.800     2.900     1.200 peak   955 spectrum    2 weight  0.10000E+01 volume  0.33243E-03 ppm1      4.685 ppm2      0.683 CV     1
 OR {  955}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 46   and name HG2%)
 ASSI {  965}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 18   and name HD2%)
      3.800     1.800     1.800 peak   965 spectrum    2 weight  0.10000E+01 volume  0.59088E-03 ppm1      5.085 ppm2      0.761 CV     1
 OR {  965}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 16   and name HG2%)
 ASSI {  980}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 18   and name HD2%)
      2.700     2.700     3.300 peak   980 spectrum    2 weight  0.10000E+01 volume  0.42545E-02 ppm1      3.966 ppm2      0.758 CV     1
 OR {  980}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI {  982}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 98   and name HD1%)
      3.300     1.300     1.300 peak   982 spectrum    2 weight  0.10000E+01 volume  0.18612E-02 ppm1      3.959 ppm2      0.570 CV     1
 OR {  982}
   (( segid "    " and resid 58   and name HA  ))
   (  segid "    " and resid 51   and name HD2%)
 OR {  982}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 51   and name HD2%)
 ASSI { 1022}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 34   and name HA  ))
      3.800     1.800     1.800 peak  1022 spectrum    2 weight  0.10000E+01 volume  0.84828E-03 ppm1      4.088 ppm2      4.473 CV     1
 OR { 1022}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name HA  ))
 ASSI { 1029}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 100  and name HD2%)
      4.100     2.100     1.900 peak  1029 spectrum    2 weight  0.10000E+01 volume  0.61382E-03 ppm1      4.767 ppm2      0.678 CV     1
 OR { 1029}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 48   and name HG2%)
 ASSI { 1062}
   (( segid "    " and resid 32   and name HA  ))
   (  segid "    " and resid 31   and name HG2%)
      4.600     2.600     1.400 peak  1062 spectrum    2 weight  0.10000E+01 volume  0.30313E-03 ppm1      4.530 ppm2      0.597 CV     1
 OR { 1062}
   (( segid "    " and resid 32   and name HA  ))
   (  segid "    " and resid 46   and name HD1%)
 OR { 1062}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 98   and name HD1%)
 ASSI { 1065}
   (( segid "    " and resid 12   and name HA  ))
   (  segid "    " and resid 13   and name HD2%)
      3.800     1.800     1.800 peak  1065 spectrum    2 weight  0.10000E+01 volume  0.11752E-02 ppm1      4.746 ppm2      0.675 CV     1
 OR { 1065}
   (( segid "    " and resid 30   and name HA  ))
   (  segid "    " and resid 52   and name HD1%)
 OR { 1065}
   (( segid "    " and resid 30   and name HA  ))
   (  segid "    " and resid 48   and name HG2%)
 OR { 1065}
   (( segid "    " and resid 30   and name HA  ))
   (  segid "    " and resid 31   and name HD1%)
 ASSI { 1068}
   (( segid "    " and resid 84   and name HA  ))
   (  segid "    " and resid 81   and name HB% )
      4.700     2.800     1.300 peak  1068 spectrum    2 weight  0.10000E+01 volume  0.27310E-03 ppm1      4.531 ppm2      1.410 CV     1
 OR { 1068}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 49   and name HB2 ))
 OR { 1068}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 92   and name HB% )
 OR { 1068}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HG1 ))
 OR { 1068}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HG2 ))
 ASSI { 1080}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 48   and name HG1%)
      3.400     1.400     1.400 peak  1080 spectrum    2 weight  0.10000E+01 volume  0.10196E-02 ppm1      4.270 ppm2      0.566 CV     1
 OR { 1080}
   (( segid "    " and resid 49   and name HA  ))
   (  segid "    " and resid 48   and name HG1%)
 OR { 1080}
   (( segid "    " and resid 50   and name HA  ))
   (  segid "    " and resid 51   and name HD2%)
 ASSI { 1112}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 88   and name HG1%)
      3.000     3.000     3.000 peak  1112 spectrum    2 weight  0.10000E+01 volume  0.14582E-02 ppm1      3.787 ppm2      0.749 CV     1
 OR { 1112}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 96   and name HG1%)
 ASSI { 1114}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 96   and name HG2%)
      4.100     2.100     1.900 peak  1114 spectrum    2 weight  0.10000E+01 volume  0.32139E-03 ppm1      3.797 ppm2      0.875 CV     1
 OR { 1114}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 86   and name HG1%)
 ASSI { 1118}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB2 ))
      2.100     0.500     0.500 peak  1118 spectrum    2 weight  0.10000E+01 volume  0.14076E-01 ppm1      4.354 ppm2      3.753 CV     1
 OR { 1118}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HB2 ))
 ASSI { 1119}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 16   and name HG2%)
      4.400     2.400     1.600 peak  1119 spectrum    2 weight  0.10000E+01 volume  0.45943E-03 ppm1      4.015 ppm2      0.752 CV     1
 OR { 1119}
   (( segid "    " and resid 78   and name HA  ))
   (  segid "    " and resid 77   and name HG1%)
 OR { 1119}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI { 1149}
   (( segid "    " and resid 90   and name HA  ))
   (( segid "    " and resid 89   and name HB2 ))
      4.000     2.000     2.000 peak  1149 spectrum    2 weight  0.10000E+01 volume  0.32786E-03 ppm1      3.950 ppm2      1.416 CV     1
 OR { 1149}
   (( segid "    " and resid 90   and name HA  ))
   (  segid "    " and resid 92   and name HB% )
 ASSI { 1151}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 106  and name HD2%)
      4.200     4.200     1.800 peak  1151 spectrum    2 weight  0.10000E+01 volume  0.48140E-03 ppm1      4.303 ppm2      0.720 CV     1
 OR { 1151}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 104  and name HD1%)
 ASSI { 1187}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 98   and name HD2%)
      2.700     0.900     0.900 peak  1187 spectrum    2 weight  0.10000E+01 volume  0.54653E-02 ppm1      4.245 ppm2      0.682 CV     1
 OR { 1187}
   (( segid "    " and resid 29   and name HA  ))
   (  segid "    " and resid 48   and name HG2%)
 OR { 1187}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 100  and name HD2%)
 OR { 1187}
   (( segid "    " and resid 29   and name HA  ))
   (  segid "    " and resid 89   and name HD1%)
 OR { 1187}
   (( segid "    " and resid 72   and name HA  ))
   (  segid "    " and resid 75   and name HG1%)
 ASSI { 1213}
   (( segid "    " and resid 105  and name HA  ))
   (  segid "    " and resid 106  and name HD2%)
      4.400     2.500     1.600 peak  1213 spectrum    2 weight  0.10000E+01 volume  0.34339E-03 ppm1      4.269 ppm2      0.725 CV     1
 OR { 1213}
   (( segid "    " and resid 105  and name HA  ))
   (  segid "    " and resid 107  and name HD2%)
 OR { 1213}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 27   and name HD2%)
 ASSI { 1219}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 48   and name HG1%)
      2.500     2.500     3.500 peak  1219 spectrum    2 weight  0.10000E+01 volume  0.49067E-02 ppm1      3.790 ppm2      0.559 CV     1
 OR { 1219}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 51   and name HD2%)
 OR { 1219}
   (( segid "    " and resid 30   and name HB2 ))
   (  segid "    " and resid 48   and name HG1%)
 ASSI { 1234}
   (( segid "    " and resid 15   and name HB1 ))
   (( segid "    " and resid 99   and name HB1 ))
      4.600     2.600     1.400 peak  1234 spectrum    2 weight  0.10000E+01 volume  0.41675E-03 ppm1      3.651 ppm2      1.208 CV     1
 OR { 1234}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 99   and name HB1 ))
 OR { 1234}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 49   and name HG1 ))
 ASSI { 1247}
   (( segid "    " and resid 88   and name HA  ))
   (  segid "    " and resid 80   and name HE% )
      5.800     4.100     0.200 peak  1247 spectrum    2 weight  0.10000E+01 volume  0.17832E-03 ppm1      3.568 ppm2      1.895 CV     1
 OR { 1247}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 89   and name HB1 ))
 ASSI { 1263}
   (( segid "    " and resid 24   and name HB  ))
   (  segid "    " and resid 24   and name HG2%)
      2.000     0.500     0.500 peak  1263 spectrum    2 weight  0.10000E+01 volume  0.14863E-01 ppm1      4.216 ppm2      1.122 CV     1
 OR { 1263}
   (( segid "    " and resid 39   and name HB  ))
   (  segid "    " and resid 39   and name HG2%)
assign ( residue 14 and name HN ) ( residue 100 and name O ) 1.80 0.00 0.50
assign ( residue 16 and name HN ) ( residue 98 and name O ) 1.80 0.00 0.50
assign ( residue 18 and name HN ) ( residue 96 and name O ) 1.80 0.00 0.50
assign ( residue 20 and name HN ) ( residue 94 and name O ) 1.80 0.00 0.50
assign ( residue 48 and name HN ) ( residue 67 and name O ) 1.80 0.00 0.50
assign ( residue 49 and name HN ) ( residue 30 and name O ) 1.80 0.00 0.50
assign ( residue 50 and name HN ) ( residue 30 and name O ) 1.80 0.00 0.50
assign ( residue 52 and name HN ) ( residue 28 and name O ) 1.80 0.00 0.50
assign ( residue 59 and name HN ) ( residue 55 and name O ) 1.80 0.00 0.50
assign ( residue 60 and name HN ) ( residue 56 and name O ) 1.80 0.00 0.50
assign ( residue 67 and name HN ) ( residue 48 and name O ) 1.80 0.00 0.50
assign ( residue 68 and name HN ) ( residue 101 and name O ) 1.80 0.00 0.50
assign ( residue 70 and name HN ) ( residue 99 and name O ) 1.80 0.00 0.50
assign ( residue 71 and name HN ) ( residue 99 and name O ) 1.80 0.00 0.50
assign ( residue 73 and name HN ) ( residue 97 and name O ) 1.80 0.00 0.50
assign ( residue 77 and name HN ) ( residue 70 and name O ) 1.80 0.00 0.50
assign ( residue 85 and name HN ) ( residue 81 and name O ) 1.80 0.00 0.50
assign ( residue 86 and name HN ) ( residue 82 and name O ) 1.80 0.00 0.50
assign ( residue 87 and name HN ) ( residue 83 and name O ) 1.80 0.00 0.50
assign ( residue 88 and name HN ) ( residue 84 and name O ) 1.80 0.00 0.50
assign ( residue 89 and name HN ) ( residue 85 and name O ) 1.80 0.00 0.50
assign ( residue 90 and name HN ) ( residue 86 and name O ) 1.80 0.00 0.50
assign ( residue 92 and name HN ) ( residue 88 and name O ) 1.80 0.00 0.50
assign ( residue 96 and name HN ) ( residue 18 and name O ) 1.80 0.00 0.50
assign ( residue 97 and name HN ) ( residue 73 and name OD1 ) 1.80 0.00 0.50
assign ( residue 98 and name HN ) ( residue 16 and name O ) 1.80 0.00 0.50
assign ( residue 99 and name HN ) ( residue 71 and name O ) 1.80 0.00 0.50
assign ( residue 100 and name HN ) ( residue 14 and name O ) 1.80 0.00 0.50
assign ( residue 101 and name HN ) ( residue 68 and name O ) 1.80 0.00 0.50
assign ( residue 102 and name HN ) ( residue 12 and name O ) 1.80 0.00 0.50
assign ( residue 30 and name HN ) ( residue 50 and name O ) 1.80 0.00 0.50
assign ( residue 91 and name HN ) ( residue 87 and name O ) 1.80 0.00 0.50

assign ( residue 14 and name N  ) ( residue 100 and name O ) 2.80 0.00 0.50
assign ( residue 16 and name N  ) ( residue 98 and name O ) 2.80 0.00 0.50
assign ( residue 18 and name N  ) ( residue 96 and name O ) 2.80 0.00 0.50
assign ( residue 20 and name N  ) ( residue 94 and name O ) 2.80 0.00 0.50
assign ( residue 48 and name N  ) ( residue 67 and name O ) 2.80 0.00 0.50
assign ( residue 49 and name N  ) ( residue 30 and name O ) 2.80 0.00 0.50
assign ( residue 50 and name N  ) ( residue 30 and name O ) 2.80 0.00 0.50
assign ( residue 52 and name N  ) ( residue 28 and name O ) 2.80 0.00 0.50
assign ( residue 59 and name N  ) ( residue 55 and name O ) 2.80 0.00 0.50
assign ( residue 60 and name N  ) ( residue 56 and name O ) 2.80 0.00 0.50
assign ( residue 67 and name N  ) ( residue 48 and name O ) 2.80 0.00 0.50
assign ( residue 68 and name N  ) ( residue 101 and name O ) 2.80 0.00 0.50
assign ( residue 70 and name N  ) ( residue 99 and name O ) 2.80 0.00 0.50
assign ( residue 71 and name N  ) ( residue 99 and name O ) 2.80 0.00 0.50
assign ( residue 73 and name N  ) ( residue 97 and name O ) 2.80 0.00 0.50
assign ( residue 77 and name N  ) ( residue 70 and name O ) 2.80 0.00 0.50
assign ( residue 85 and name N  ) ( residue 81 and name O ) 2.80 0.00 0.50
assign ( residue 86 and name N  ) ( residue 82 and name O ) 2.80 0.00 0.50
assign ( residue 87 and name N  ) ( residue 83 and name O ) 2.80 0.00 0.50
assign ( residue 88 and name N  ) ( residue 84 and name O ) 2.80 0.00 0.50
assign ( residue 89 and name N  ) ( residue 85 and name O ) 2.80 0.00 0.50
assign ( residue 90 and name N  ) ( residue 86 and name O ) 2.80 0.00 0.50
assign ( residue 92 and name N  ) ( residue 88 and name O ) 2.80 0.00 0.50
assign ( residue 96 and name N  ) ( residue 18 and name O ) 2.80 0.00 0.50
assign ( residue 97 and name N  ) ( residue 73 and name OD1 ) 2.80 0.00 0.50
assign ( residue 98 and name N  ) ( residue 16 and name O ) 2.80 0.00 0.50
assign ( residue 99 and name N  ) ( residue 71 and name O ) 2.80 0.00 0.50
assign ( residue 100 and name N  ) ( residue 14 and name O ) 2.80 0.00 0.50
assign ( residue 101 and name N  ) ( residue 68 and name O ) 2.80 0.00 0.50
assign ( residue 102 and name N  ) ( residue 12 and name O ) 2.80 0.00 0.50
assign ( residue 30 and name N  ) ( residue 50 and name O ) 2.80 0.00 0.50
assign ( residue 91 and name N  ) ( residue 87 and name O ) 2.80 0.00 0.50

! phi and psi dihedral restraint file generated by Talos2Aria.py
!
! TALOS filename:
! /home/clarson/p60-1_input/pred_fixref.tab
!
! settings: min phiError=20.0, min psiError=20.0, errorFactor=2.0
!

! Talos derived phi restraint:
assign (resid  11 and name C)
       (resid  12 and name N)
       (resid  12 and name CA)
       (resid  12 and name C)
       1.0 -130  32 2

! Talos derived phi restraint:
assign (resid  12 and name C)
       (resid  13 and name N)
       (resid  13 and name CA)
       (resid  13 and name C)
       1.0 -103  30 2

! Talos derived phi restraint:
assign (resid  13 and name C)
       (resid  14 and name N)
       (resid  14 and name CA)
       (resid  14 and name C)
       1.0 -142  28 2

! Talos derived phi restraint:
assign (resid  14 and name C)
       (resid  15 and name N)
       (resid  15 and name CA)
       (resid  15 and name C)
       1.0 -118  34 2

! Talos derived phi restraint:
assign (resid  15 and name C)
       (resid  16 and name N)
       (resid  16 and name CA)
       (resid  16 and name C)
       1.0 -138  28 2

! Talos derived phi restraint:
assign (resid  16 and name C)
       (resid  17 and name N)
       (resid  17 and name CA)
       (resid  17 and name C)
       1.0 -115  26 2

! Talos derived phi restraint:
assign (resid  17 and name C)
       (resid  18 and name N)
       (resid  18 and name CA)
       (resid  18 and name C)
       1.0 -125  50 2

! Talos derived phi restraint:
assign (resid  18 and name C)
       (resid  19 and name N)
       (resid  19 and name CA)
       (resid  19 and name C)
       1.0 -109  60 2

! Talos derived phi restraint:
assign (resid  28 and name C)
       (resid  29 and name N)
       (resid  29 and name CA)
       (resid  29 and name C)
       1.0 -92  74 2

! Talos derived phi restraint:
assign (resid  29 and name C)
       (resid  30 and name N)
       (resid  30 and name CA)
       (resid  30 and name C)
       1.0 -94  20 2

! Talos derived phi restraint:
assign (resid  30 and name C)
       (resid  31 and name N)
       (resid  31 and name CA)
       (resid  31 and name C)
       1.0 -125  44 2

! Talos derived phi restraint:
assign (resid  31 and name C)
       (resid  32 and name N)
       (resid  32 and name CA)
       (resid  32 and name C)
       1.0 -131  50 2

! Talos derived phi restraint:
assign (resid  46 and name C)
       (resid  47 and name N)
       (resid  47 and name CA)
       (resid  47 and name C)
       1.0 -123  40 2

! Talos derived phi restraint:
assign (resid  50 and name C)
       (resid  51 and name N)
       (resid  51 and name CA)
       (resid  51 and name C)
       1.0 -112  30 2

! Talos derived phi restraint:
assign (resid  51 and name C)
       (resid  52 and name N)
       (resid  52 and name CA)
       (resid  52 and name C)
       1.0 -103  54 2

! Talos derived phi restraint:
assign (resid  54 and name C)
       (resid  55 and name N)
       (resid  55 and name CA)
       (resid  55 and name C)
       1.0 -106  74 2

! Talos derived phi restraint:
assign (resid  55 and name C)
       (resid  56 and name N)
       (resid  56 and name CA)
       (resid  56 and name C)
       1.0 -58  20 2

! Talos derived phi restraint:
assign (resid  56 and name C)
       (resid  57 and name N)
       (resid  57 and name CA)
       (resid  57 and name C)
       1.0 -62  20 2

! Talos derived phi restraint:
assign (resid  57 and name C)
       (resid  58 and name N)
       (resid  58 and name CA)
       (resid  58 and name C)
       1.0 -60  20 2

! Talos derived phi restraint:
assign (resid  58 and name C)
       (resid  59 and name N)
       (resid  59 and name CA)
       (resid  59 and name C)
       1.0 -63  20 2

! Talos derived phi restraint:
assign (resid  59 and name C)
       (resid  60 and name N)
       (resid  60 and name CA)
       (resid  60 and name C)
       1.0 -73  32 2

! Talos derived phi restraint:
assign (resid  61 and name C)
       (resid  62 and name N)
       (resid  62 and name CA)
       (resid  62 and name C)
       1.0 -88  32 2

! Talos derived phi restraint:
assign (resid  63 and name C)
       (resid  64 and name N)
       (resid  64 and name CA)
       (resid  64 and name C)
       1.0 -88  42 2

! Talos derived phi restraint:
assign (resid  67 and name C)
       (resid  68 and name N)
       (resid  68 and name CA)
       (resid  68 and name C)
       1.0 -122  56 2

! Talos derived phi restraint:
assign (resid  68 and name C)
       (resid  69 and name N)
       (resid  69 and name CA)
       (resid  69 and name C)
       1.0 -87  64 2

! Talos derived phi restraint:
assign (resid  70 and name C)
       (resid  71 and name N)
       (resid  71 and name CA)
       (resid  71 and name C)
       1.0 -133  46 2

! Talos derived phi restraint:
assign (resid  71 and name C)
       (resid  72 and name N)
       (resid  72 and name CA)
       (resid  72 and name C)
       1.0 -112  58 2

! Talos derived phi restraint:
assign (resid  72 and name C)
       (resid  73 and name N)
       (resid  73 and name CA)
       (resid  73 and name C)
       1.0 -71  34 2

! Talos derived phi restraint:
assign (resid  74 and name C)
       (resid  75 and name N)
       (resid  75 and name CA)
       (resid  75 and name C)
       1.0 -110  62 2

! Talos derived phi restraint:
assign (resid  80 and name C)
       (resid  81 and name N)
       (resid  81 and name CA)
       (resid  81 and name C)
       1.0 -90  62 2

! Talos derived phi restraint:
assign (resid  81 and name C)
       (resid  82 and name N)
       (resid  82 and name CA)
       (resid  82 and name C)
       1.0 -57  20 2

! Talos derived phi restraint:
assign (resid  82 and name C)
       (resid  83 and name N)
       (resid  83 and name CA)
       (resid  83 and name C)
       1.0 -62  20 2

! Talos derived phi restraint:
assign (resid  83 and name C)
       (resid  84 and name N)
       (resid  84 and name CA)
       (resid  84 and name C)
       1.0 -68  20 2

! Talos derived phi restraint:
assign (resid  84 and name C)
       (resid  85 and name N)
       (resid  85 and name CA)
       (resid  85 and name C)
       1.0 -62  20 2

! Talos derived phi restraint:
assign (resid  85 and name C)
       (resid  86 and name N)
       (resid  86 and name CA)
       (resid  86 and name C)
       1.0 -63  20 2

! Talos derived phi restraint:
assign (resid  86 and name C)
       (resid  87 and name N)
       (resid  87 and name CA)
       (resid  87 and name C)
       1.0 -63  20 2

! Talos derived phi restraint:
assign (resid  87 and name C)
       (resid  88 and name N)
       (resid  88 and name CA)
       (resid  88 and name C)
       1.0 -65  20 2

! Talos derived phi restraint:
assign (resid  88 and name C)
       (resid  89 and name N)
       (resid  89 and name CA)
       (resid  89 and name C)
       1.0 -61  20 2

! Talos derived phi restraint:
assign (resid  89 and name C)
       (resid  90 and name N)
       (resid  90 and name CA)
       (resid  90 and name C)
       1.0 -69  20 2

! Talos derived phi restraint:
assign (resid  90 and name C)
       (resid  91 and name N)
       (resid  91 and name CA)
       (resid  91 and name C)
       1.0 -85  28 2

! Talos derived phi restraint:
assign (resid  92 and name C)
       (resid  93 and name N)
       (resid  93 and name CA)
       (resid  93 and name C)
       1.0  81  20 2

! Talos derived phi restraint:
assign (resid  93 and name C)
       (resid  94 and name N)
       (resid  94 and name CA)
       (resid  94 and name C)
       1.0 -110  36 2

! Talos derived phi restraint:
assign (resid  95 and name C)
       (resid  96 and name N)
       (resid  96 and name CA)
       (resid  96 and name C)
       1.0 -114  40 2

! Talos derived phi restraint:
assign (resid  96 and name C)
       (resid  97 and name N)
       (resid  97 and name CA)
       (resid  97 and name C)
       1.0 -96  28 2

! Talos derived phi restraint:
assign (resid  97 and name C)
       (resid  98 and name N)
       (resid  98 and name CA)
       (resid  98 and name C)
       1.0 -125  20 2

! Talos derived phi restraint:
assign (resid  98 and name C)
       (resid  99 and name N)
       (resid  99 and name CA)
       (resid  99 and name C)
       1.0 -117  34 2

! Talos derived phi restraint:
assign (resid  99 and name C)
       (resid 100 and name N)
       (resid 100 and name CA)
       (resid 100 and name C)
       1.0 -129  28 2

! Talos derived phi restraint:
assign (resid 100 and name C)
       (resid 101 and name N)
       (resid 101 and name CA)
       (resid 101 and name C)
       1.0 -122  28 2

! Talos derived phi restraint:
assign (resid 101 and name C)
       (resid 102 and name N)
       (resid 102 and name CA)
       (resid 102 and name C)
       1.0 -124  42 2

! Talos derived phi restraint:
assign (resid 102 and name C)
       (resid 103 and name N)
       (resid 103 and name CA)
       (resid 103 and name C)
       1.0 -88  26 2

! Talos derived phi restraint:
assign (resid 103 and name C)
       (resid 104 and name N)
       (resid 104 and name CA)
       (resid 104 and name C)
       1.0 -89  64 2

! Talos derived psi restraint:
assign (resid  12 and name N)
       (resid  12 and name CA)
       (resid  12 and name C)
       (resid  13 and name N)
       1.0 137  32 2

! Talos derived psi restraint:
assign (resid  13 and name N)
       (resid  13 and name CA)
       (resid  13 and name C)
       (resid  14 and name N)
       1.0 130  28 2

! Talos derived psi restraint:
assign (resid  14 and name N)
       (resid  14 and name CA)
       (resid  14 and name C)
       (resid  15 and name N)
       1.0 160  38 2

! Talos derived psi restraint:
assign (resid  15 and name N)
       (resid  15 and name CA)
       (resid  15 and name C)
       (resid  16 and name N)
       1.0 147  20 2

! Talos derived psi restraint:
assign (resid  16 and name N)
       (resid  16 and name CA)
       (resid  16 and name C)
       (resid  17 and name N)
       1.0 149  20 2

! Talos derived psi restraint:
assign (resid  17 and name N)
       (resid  17 and name CA)
       (resid  17 and name C)
       (resid  18 and name N)
       1.0 135  28 2

! Talos derived psi restraint:
assign (resid  18 and name N)
       (resid  18 and name CA)
       (resid  18 and name C)
       (resid  19 and name N)
       1.0 136  30 2

! Talos derived psi restraint:
assign (resid  19 and name N)
       (resid  19 and name CA)
       (resid  19 and name C)
       (resid  20 and name N)
       1.0 132  28 2

! Talos derived psi restraint:
assign (resid  29 and name N)
       (resid  29 and name CA)
       (resid  29 and name C)
       (resid  30 and name N)
       1.0 137  28 2

! Talos derived psi restraint:
assign (resid  30 and name N)
       (resid  30 and name CA)
       (resid  30 and name C)
       (resid  31 and name N)
       1.0 118  28 2

! Talos derived psi restraint:
assign (resid  31 and name N)
       (resid  31 and name CA)
       (resid  31 and name C)
       (resid  32 and name N)
       1.0 162  20 2

! Talos derived psi restraint:
assign (resid  32 and name N)
       (resid  32 and name CA)
       (resid  32 and name C)
       (resid  33 and name N)
       1.0 151  20 2

! Talos derived psi restraint:
assign (resid  47 and name N)
       (resid  47 and name CA)
       (resid  47 and name C)
       (resid  48 and name N)
       1.0 155  48 2

! Talos derived psi restraint:
assign (resid  51 and name N)
       (resid  51 and name CA)
       (resid  51 and name C)
       (resid  52 and name N)
       1.0 144  26 2

! Talos derived psi restraint:
assign (resid  52 and name N)
       (resid  52 and name CA)
       (resid  52 and name C)
       (resid  53 and name N)
       1.0 145  46 2

! Talos derived psi restraint:
assign (resid  55 and name N)
       (resid  55 and name CA)
       (resid  55 and name C)
       (resid  56 and name N)
       1.0 164  24 2

! Talos derived psi restraint:
assign (resid  56 and name N)
       (resid  56 and name CA)
       (resid  56 and name C)
       (resid  57 and name N)
       1.0 -40  20 2

! Talos derived psi restraint:
assign (resid  57 and name N)
       (resid  57 and name CA)
       (resid  57 and name C)
       (resid  58 and name N)
       1.0 -41  24 2

! Talos derived psi restraint:
assign (resid  58 and name N)
       (resid  58 and name CA)
       (resid  58 and name C)
       (resid  59 and name N)
       1.0 -41  20 2

! Talos derived psi restraint:
assign (resid  59 and name N)
       (resid  59 and name CA)
       (resid  59 and name C)
       (resid  60 and name N)
       1.0 -40  20 2

! Talos derived psi restraint:
assign (resid  60 and name N)
       (resid  60 and name CA)
       (resid  60 and name C)
       (resid  61 and name N)
       1.0 -34  22 2

! Talos derived psi restraint:
assign (resid  62 and name N)
       (resid  62 and name CA)
       (resid  62 and name C)
       (resid  63 and name N)
       1.0 -13  34 2

! Talos derived psi restraint:
assign (resid  64 and name N)
       (resid  64 and name CA)
       (resid  64 and name C)
       (resid  65 and name N)
       1.0 130  30 2

! Talos derived psi restraint:
assign (resid  68 and name N)
       (resid  68 and name CA)
       (resid  68 and name C)
       (resid  69 and name N)
       1.0 130  50 2

! Talos derived psi restraint:
assign (resid  69 and name N)
       (resid  69 and name CA)
       (resid  69 and name C)
       (resid  70 and name N)
       1.0 137  20 2

! Talos derived psi restraint:
assign (resid  71 and name N)
       (resid  71 and name CA)
       (resid  71 and name C)
       (resid  72 and name N)
       1.0 155  20 2

! Talos derived psi restraint:
assign (resid  72 and name N)
       (resid  72 and name CA)
       (resid  72 and name C)
       (resid  73 and name N)
       1.0 135  40 2

! Talos derived psi restraint:
assign (resid  73 and name N)
       (resid  73 and name CA)
       (resid  73 and name C)
       (resid  74 and name N)
       1.0 131  22 2

! Talos derived psi restraint:
assign (resid  75 and name N)
       (resid  75 and name CA)
       (resid  75 and name C)
       (resid  76 and name N)
       1.0 130  30 2

! Talos derived psi restraint:
assign (resid  81 and name N)
       (resid  81 and name CA)
       (resid  81 and name C)
       (resid  82 and name N)
       1.0 143  42 2

! Talos derived psi restraint:
assign (resid  82 and name N)
       (resid  82 and name CA)
       (resid  82 and name C)
       (resid  83 and name N)
       1.0 -47  20 2

! Talos derived psi restraint:
assign (resid  83 and name N)
       (resid  83 and name CA)
       (resid  83 and name C)
       (resid  84 and name N)
       1.0 -39  20 2

! Talos derived psi restraint:
assign (resid  84 and name N)
       (resid  84 and name CA)
       (resid  84 and name C)
       (resid  85 and name N)
       1.0 -41  20 2

! Talos derived psi restraint:
assign (resid  85 and name N)
       (resid  85 and name CA)
       (resid  85 and name C)
       (resid  86 and name N)
       1.0 -45  20 2

! Talos derived psi restraint:
assign (resid  86 and name N)
       (resid  86 and name CA)
       (resid  86 and name C)
       (resid  87 and name N)
       1.0 -43  20 2

! Talos derived psi restraint:
assign (resid  87 and name N)
       (resid  87 and name CA)
       (resid  87 and name C)
       (resid  88 and name N)
       1.0 -39  20 2

! Talos derived psi restraint:
assign (resid  88 and name N)
       (resid  88 and name CA)
       (resid  88 and name C)
       (resid  89 and name N)
       1.0 -44  20 2

! Talos derived psi restraint:
assign (resid  89 and name N)
       (resid  89 and name CA)
       (resid  89 and name C)
       (resid  90 and name N)
       1.0 -42  20 2

! Talos derived psi restraint:
assign (resid  90 and name N)
       (resid  90 and name CA)
       (resid  90 and name C)
       (resid  91 and name N)
       1.0 -32  20 2

! Talos derived psi restraint:
assign (resid  91 and name N)
       (resid  91 and name CA)
       (resid  91 and name C)
       (resid  92 and name N)
       1.0 -17  34 2

! Talos derived psi restraint:
assign (resid  93 and name N)
       (resid  93 and name CA)
       (resid  93 and name C)
       (resid  94 and name N)
       1.0   1  24 2

! Talos derived psi restraint:
assign (resid  94 and name N)
       (resid  94 and name CA)
       (resid  94 and name C)
       (resid  95 and name N)
       1.0 143  42 2

! Talos derived psi restraint:
assign (resid  96 and name N)
       (resid  96 and name CA)
       (resid  96 and name C)
       (resid  97 and name N)
       1.0 130  28 2

! Talos derived psi restraint:
assign (resid  97 and name N)
       (resid  97 and name CA)
       (resid  97 and name C)
       (resid  98 and name N)
       1.0 125  20 2

! Talos derived psi restraint:
assign (resid  98 and name N)
       (resid  98 and name CA)
       (resid  98 and name C)
       (resid  99 and name N)
       1.0 138  34 2

! Talos derived psi restraint:
assign (resid  99 and name N)
       (resid  99 and name CA)
       (resid  99 and name C)
       (resid 100 and name N)
       1.0 126  26 2

! Talos derived psi restraint:
assign (resid 100 and name N)
       (resid 100 and name CA)
       (resid 100 and name C)
       (resid 101 and name N)
       1.0 138  30 2

! Talos derived psi restraint:
assign (resid 101 and name N)
       (resid 101 and name CA)
       (resid 101 and name C)
       (resid 102 and name N)
       1.0 135  20 2

! Talos derived psi restraint:
assign (resid 102 and name N)
       (resid 102 and name CA)
       (resid 102 and name C)
       (resid 103 and name N)
       1.0 126  20 2

! Talos derived psi restraint:
assign (resid 103 and name N)
       (resid 103 and name CA)
       (resid 103 and name C)
       (resid 104 and name N)
       1.0 127  20 2

! Talos derived psi restraint:
assign (resid 104 and name N)
       (resid 104 and name CA)
       (resid 104 and name C)
       (resid 105 and name N)
       1.0 139  58 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1  -3.003  -8.878  18.136
    2    H2   GLY   1           HT2      GLY   1  -3.509 -10.400  17.599
    3    H3   GLY   1           HT3      GLY   1  -4.397  -9.585  18.785
    4    HA2  GLY   1           HA1      GLY   1  -4.973  -7.847  17.208
    5    HA3  GLY   1           HA2      GLY   1  -4.047  -8.690  15.975
    6    H    SER   2           HN       SER   2  -7.064  -8.047  16.779
    7    HA   SER   2           HA       SER   2  -8.105 -10.731  16.180
    8    HG   SER   2           HG       SER   2  -9.216 -10.709  18.704
    9    HB2  SER   2           HB2      SER   2  -9.541  -8.316  17.309
   10    HB3  SER   2           HB1      SER   2 -10.266  -9.898  17.022
   11    H    HIS   3           HN       HIS   3  -7.506  -7.720  14.786
   12    HA   HIS   3           HA       HIS   3  -9.688  -7.426  13.045
   13    HD1  HIS   3           HD1      HIS   3  -6.097  -5.680  14.735
   14    HD2  HIS   3           HD2      HIS   3  -9.813  -4.269  13.524
   15    HE1  HIS   3           HE1      HIS   3  -6.663  -3.823  16.332
   16    HE2  HIS   3           HE2      HIS   3  -8.966  -3.061  15.648
   17    HB2  HIS   3           HB2      HIS   3  -6.828  -6.611  12.501
   18    HB3  HIS   3           HB1      HIS   3  -8.278  -5.933  11.769
   19    H    GLY   4           HN       GLY   4 -10.346  -8.655  11.410
   20    HA2  GLY   4           HA2      GLY   4  -8.327 -10.175   9.893
   21    HA3  GLY   4           HA1      GLY   4  -9.768 -10.980  10.491
   22    H    TYR   5           HN       TYR   5 -11.847  -9.567   9.889
   23    HA   TYR   5           HA       TYR   5 -13.291  -9.041   8.214
   24    HD1  TYR   5           HD1      TYR   5 -14.173  -6.218   7.826
   25    HD2  TYR   5           HD2      TYR   5 -10.206  -6.661   9.299
   26    HE1  TYR   5           HE1      TYR   5 -14.609  -4.474   9.504
   27    HE2  TYR   5           HE2      TYR   5 -10.630  -4.920  10.984
   28    HH   TYR   5           HH       TYR   5 -12.135  -3.018  11.328
   29    HB2  TYR   5           HB2      TYR   5 -10.842  -7.608   7.170
   30    HB3  TYR   5           HB1      TYR   5 -12.468  -7.395   6.528
   31    H    SER   6           HN       SER   6 -12.330 -11.574   7.981
   32    HA   SER   6           HA       SER   6 -11.255 -12.116   5.390
   33    HG   SER   6           HG       SER   6  -9.897 -13.361   6.868
   34    HB2  SER   6           HB2      SER   6 -12.624 -13.954   7.370
   35    HB3  SER   6           HB1      SER   6 -11.746 -14.482   5.934
   36    H    ASP   7           HN       ASP   7 -12.458 -11.458   3.695
   37    HA   ASP   7           HA       ASP   7 -14.157 -11.335   2.189
   38    HB2  ASP   7           HB2      ASP   7 -15.077 -13.875   3.551
   39    HB3  ASP   7           HB1      ASP   7 -15.624 -13.296   1.980
   40    H    ALA   8           HN       ALA   8 -15.011  -9.423   3.077
   41    HA   ALA   8           HA       ALA   8 -17.672  -9.778   4.221
   42    HB1  ALA   8           HB3      ALA   8 -16.181  -9.478   6.150
   43    HB2  ALA   8           HB1      ALA   8 -17.311  -8.135   5.971
   44    HB3  ALA   8           HB2      ALA   8 -15.629  -7.945   5.473
   45    H    SER   9           HN       SER   9 -18.773  -8.937   2.546
   46    HA   SER   9           HA       SER   9 -19.597  -7.433   1.059
   47    HG   SER   9           HG       SER   9 -20.965  -5.511   3.068
   48    HB2  SER   9           HB2      SER   9 -18.318  -5.466   2.970
   49    HB3  SER   9           HB1      SER   9 -19.460  -5.034   1.698
   50    H    GLY  10           HN       GLY  10 -16.737  -8.434   0.861
   51    HA2  GLY  10           HA2      GLY  10 -15.266  -8.293  -0.941
   52    HA3  GLY  10           HA1      GLY  10 -16.045  -6.796  -1.428
   53    H    PHE  11           HN       PHE  11 -14.634  -7.579   1.719
   54    HA   PHE  11           HA       PHE  11 -12.387  -5.785   1.192
   55    HD1  PHE  11           HD2      PHE  11 -12.367  -2.887   1.703
   56    HD2  PHE  11           HD1      PHE  11 -16.195  -4.701   2.108
   57    HE1  PHE  11           HE2      PHE  11 -13.368  -1.054   0.403
   58    HE2  PHE  11           HE1      PHE  11 -17.204  -2.871   0.808
   59    HZ   PHE  11           HZ       PHE  11 -15.790  -1.044  -0.047
   60    HB2  PHE  11           HB2      PHE  11 -14.357  -5.417   3.458
   61    HB3  PHE  11           HB1      PHE  11 -12.791  -4.618   3.377
   62    H    SER  12           HN       SER  12 -10.606  -6.804   1.789
   63    HA   SER  12           HA       SER  12 -10.579  -8.326   4.281
   64    HG   SER  12           HG       SER  12  -9.753 -10.981   3.956
   65    HB2  SER  12           HB2      SER  12 -11.056 -10.006   2.573
   66    HB3  SER  12           HB1      SER  12  -9.672  -9.462   1.625
   67    H    LEU  13           HN       LEU  13  -8.603  -8.403   5.297
   68    HA   LEU  13           HA       LEU  13  -6.704  -6.395   4.487
   69    HG   LEU  13           HG       LEU  13  -8.524  -6.670   6.958
   70    HB2  LEU  13           HB2      LEU  13  -6.655  -8.319   6.815
   71    HB3  LEU  13           HB1      LEU  13  -5.545  -6.982   6.582
   72   HD11  LEU  13          HD11      LEU  13  -7.962  -5.880   9.203
   73   HD12  LEU  13          HD12      LEU  13  -6.268  -6.284   8.923
   74   HD13  LEU  13          HD13      LEU  13  -7.483  -7.562   8.973
   75   HD21  LEU  13          HD23      LEU  13  -6.242  -4.713   6.796
   76   HD22  LEU  13          HD21      LEU  13  -7.845  -4.297   7.404
   77   HD23  LEU  13          HD22      LEU  13  -7.646  -4.827   5.734
   78    H    TYR  14           HN       TYR  14  -4.884  -6.703   3.388
   79    HA   TYR  14           HA       TYR  14  -3.842  -9.446   3.144
   80    HD1  TYR  14           HD2      TYR  14  -3.934 -10.982   0.617
   81    HD2  TYR  14           HD1      TYR  14  -6.591  -7.664   0.902
   82    HE1  TYR  14           HE2      TYR  14  -5.780 -12.397  -0.177
   83    HE2  TYR  14           HE1      TYR  14  -8.441  -9.076   0.110
   84    HH   TYR  14           HH       TYR  14  -8.219 -12.466  -0.084
   85    HB2  TYR  14           HB2      TYR  14  -4.188  -7.342   1.013
   86    HB3  TYR  14           HB1      TYR  14  -3.080  -8.697   0.817
   87    H    SER  15           HN       SER  15  -1.673  -9.721   3.357
   88    HA   SER  15           HA       SER  15  -0.007  -7.313   3.612
   89    HG   SER  15           HG       SER  15  -0.166 -10.493   4.812
   90    HB2  SER  15           HB2      SER  15   1.122  -8.313   5.567
   91    HB3  SER  15           HB1      SER  15  -0.594  -8.045   5.873
   92    H    VAL  16           HN       VAL  16   1.903  -7.419   2.601
   93    HA   VAL  16           HA       VAL  16   2.782 -10.047   1.588
   94    HB   VAL  16           HB       VAL  16   3.404  -7.419   0.253
   95   HG11  VAL  16          HG11      VAL  16   3.466 -10.281  -0.692
   96   HG12  VAL  16          HG12      VAL  16   4.858  -9.257  -0.345
   97   HG13  VAL  16          HG13      VAL  16   3.798  -8.874  -1.702
   98   HG21  VAL  16          HG23      VAL  16   1.100  -9.274  -0.341
   99   HG22  VAL  16          HG21      VAL  16   1.589  -7.896  -1.327
  100   HG23  VAL  16          HG22      VAL  16   0.982  -7.638   0.309
  101    H    GLU  17           HN       GLU  17   5.107 -10.307   1.314
  102    HA   GLU  17           HA       GLU  17   6.605  -8.746   3.310
  103    HB2  GLU  17           HB2      GLU  17   7.189 -11.527   2.279
  104    HB3  GLU  17           HB1      GLU  17   8.056 -10.688   3.559
  105    HG2  GLU  17           HG2      GLU  17   6.036 -10.692   4.932
  106    HG3  GLU  17           HG1      GLU  17   5.169 -11.535   3.648
  107    H    LEU  18           HN       LEU  18   7.805  -7.226   2.376
  108    HA   LEU  18           HA       LEU  18   9.292  -7.925  -0.072
  109    HG   LEU  18           HG       LEU  18   7.298  -5.228  -1.606
  110    HB2  LEU  18           HB2      LEU  18   7.905  -5.407   0.746
  111    HB3  LEU  18           HB1      LEU  18   9.333  -5.294  -0.264
  112   HD11  LEU  18          HD11      LEU  18   9.308  -6.208  -2.576
  113   HD12  LEU  18          HD12      LEU  18   7.853  -6.991  -3.194
  114   HD13  LEU  18          HD13      LEU  18   8.834  -7.795  -1.970
  115   HD21  LEU  18          HD23      LEU  18   5.899  -6.578  -0.064
  116   HD22  LEU  18          HD21      LEU  18   6.754  -8.020  -0.610
  117   HD23  LEU  18          HD22      LEU  18   5.783  -7.087  -1.750
  118    H    PHE  19           HN       PHE  19  11.345  -6.596  -0.316
  119    HA   PHE  19           HA       PHE  19  12.530  -5.839   2.240
  120    HD1  PHE  19           HD2      PHE  19  11.919  -9.248   0.170
  121    HD2  PHE  19           HD1      PHE  19  15.719  -7.382  -0.248
  122    HE1  PHE  19           HE2      PHE  19  12.269 -10.447  -1.949
  123    HE2  PHE  19           HE1      PHE  19  16.077  -8.575  -2.370
  124    HZ   PHE  19           HZ       PHE  19  14.350 -10.111  -3.222
  125    HB2  PHE  19           HB2      PHE  19  14.545  -7.230   1.792
  126    HB3  PHE  19           HB1      PHE  19  13.094  -8.181   2.087
  127    H    ARG  20           HN       ARG  20  13.843  -4.132   2.096
  128    HA   ARG  20           HA       ARG  20  14.450  -3.104  -0.582
  129    HE   ARG  20           HE       ARG  20  12.764  -0.107  -0.812
  130    HB2  ARG  20           HB2      ARG  20  13.352  -1.521   0.862
  131    HB3  ARG  20           HB1      ARG  20  14.511  -1.815   2.151
  132    HG2  ARG  20           HG2      ARG  20  15.122   0.244   1.220
  133    HG3  ARG  20           HG1      ARG  20  16.282  -0.916   0.572
  134    HD2  ARG  20           HD2      ARG  20  15.608   0.481  -1.228
  135    HD3  ARG  20           HD1      ARG  20  14.825  -1.082  -1.466
  136   HH11  ARG  20          HH11      ARG  20  15.378   2.179  -1.079
  137   HH12  ARG  20          HH12      ARG  20  14.334   3.556  -1.187
  138   HH21  ARG  20          HH21      ARG  20  11.380   1.700  -0.953
  139   HH22  ARG  20          HH22      ARG  20  12.061   3.284  -1.112
  140    H    GLU  21           HN       GLU  21  16.244  -4.253  -1.224
  141    HA   GLU  21           HA       GLU  21  18.677  -3.800   0.369
  142    HB2  GLU  21           HB2      GLU  21  17.927  -6.350  -1.070
  143    HB3  GLU  21           HB1      GLU  21  19.478  -6.043  -0.303
  144    HG2  GLU  21           HG2      GLU  21  16.829  -6.095   1.125
  145    HG3  GLU  21           HG1      GLU  21  17.975  -7.433   1.061
  146    H    LYS  22           HN       LYS  22  17.233  -2.872  -2.283
  147    HA   LYS  22           HA       LYS  22  19.603  -3.111  -4.011
  148    HB2  LYS  22           HB2      LYS  22  16.772  -2.407  -4.808
  149    HB3  LYS  22           HB1      LYS  22  18.130  -2.657  -5.897
  150    HG2  LYS  22           HG2      LYS  22  16.902  -4.752  -4.113
  151    HG3  LYS  22           HG1      LYS  22  16.633  -4.585  -5.848
  152    HD2  LYS  22           HD2      LYS  22  18.997  -5.005  -6.269
  153    HD3  LYS  22           HD1      LYS  22  19.299  -5.118  -4.534
  154    HE2  LYS  22           HE2      LYS  22  17.772  -7.045  -4.416
  155    HE3  LYS  22           HE1      LYS  22  17.533  -6.944  -6.160
  156    HZ1  LYS  22           HZ3      LYS  22  19.898  -7.361  -6.466
  157    HZ2  LYS  22           HZ1      LYS  22  19.169  -8.620  -5.601
  158    HZ3  LYS  22           HZ2      LYS  22  20.115  -7.474  -4.792
  159    H    ASP  23           HN       ASP  23  20.360  -1.267  -5.120
  160    HA   ASP  23           HA       ASP  23  20.113   1.167  -3.597
  161    HB2  ASP  23           HB2      ASP  23  21.837   2.028  -5.149
  162    HB3  ASP  23           HB1      ASP  23  22.302   0.493  -4.421
  163    H    THR  24           HN       THR  24  17.913   0.019  -5.416
  164    HA   THR  24           HA       THR  24  17.536   1.875  -7.528
  165    HB   THR  24           HB       THR  24  15.278   0.988  -7.700
  166    HG1  THR  24           HG1      THR  24  15.420  -0.845  -5.695
  167   HG21  THR  24          HG23      THR  24  17.094  -0.381  -8.601
  168   HG22  THR  24          HG21      THR  24  15.795  -1.395  -7.971
  169   HG23  THR  24          HG22      THR  24  17.276  -1.179  -7.039
  170    H    SER  25           HN       SER  25  17.271   2.199  -4.199
  171    HA   SER  25           HA       SER  25  16.468   3.812  -2.816
  172    HG   SER  25           HG       SER  25  18.297   5.973  -3.620
  173    HB2  SER  25           HB2      SER  25  16.292   5.416  -5.378
  174    HB3  SER  25           HB1      SER  25  16.206   6.081  -3.748
  175    H    SER  26           HN       SER  26  14.603   1.982  -4.385
  176    HA   SER  26           HA       SER  26  12.169   3.053  -3.327
  177    HG   SER  26           HG       SER  26  12.391   3.310  -7.371
  178    HB2  SER  26           HB2      SER  26  10.940   3.205  -5.447
  179    HB3  SER  26           HB1      SER  26  12.295   4.333  -5.429
  180    H    LEU  27           HN       LEU  27  10.364   1.569  -3.552
  181    HA   LEU  27           HA       LEU  27  11.294  -1.199  -3.857
  182    HG   LEU  27           HG       LEU  27  11.164   0.048  -1.197
  183    HB2  LEU  27           HB2      LEU  27   8.944  -0.020  -2.377
  184    HB3  LEU  27           HB1      LEU  27   9.180  -1.743  -2.590
  185   HD11  LEU  27          HD11      LEU  27   9.055   0.032   0.025
  186   HD12  LEU  27          HD12      LEU  27  10.296  -0.876   0.887
  187   HD13  LEU  27          HD13      LEU  27   9.042  -1.731  -0.010
  188   HD21  LEU  27          HD23      LEU  27  12.134  -1.984  -2.102
  189   HD22  LEU  27          HD21      LEU  27  10.870  -2.950  -1.340
  190   HD23  LEU  27          HD22      LEU  27  12.040  -2.085  -0.344
  191    H    GLY  28           HN       GLY  28   9.472   1.166  -5.409
  192    HA2  GLY  28           HA2      GLY  28   8.632   0.821  -7.611
  193    HA3  GLY  28           HA1      GLY  28   8.337  -0.862  -7.205
  194    H    ILE  29           HN       ILE  29   7.429   1.632  -4.986
  195    HA   ILE  29           HA       ILE  29   4.608   1.008  -5.497
  196    HB   ILE  29           HB       ILE  29   5.879   2.300  -3.078
  197   HG12  ILE  29          HG12      ILE  29   4.736  -0.483  -3.395
  198   HG13  ILE  29          HG11      ILE  29   6.455  -0.108  -3.432
  199   HG21  ILE  29          HG21      ILE  29   3.584   3.035  -3.411
  200   HG22  ILE  29          HG22      ILE  29   3.694   1.960  -2.018
  201   HG23  ILE  29          HG23      ILE  29   3.053   1.359  -3.546
  202   HD11  ILE  29          HD13      ILE  29   6.317   0.724  -1.138
  203   HD12  ILE  29          HD11      ILE  29   5.795  -0.956  -1.262
  204   HD13  ILE  29          HD12      ILE  29   4.599   0.330  -1.105
  205    H    SER  30           HN       SER  30   3.527   2.426  -6.684
  206    HA   SER  30           HA       SER  30   4.317   5.262  -6.576
  207    HG   SER  30           HG       SER  30   3.112   5.717  -9.909
  208    HB2  SER  30           HB2      SER  30   4.547   4.275  -8.806
  209    HB3  SER  30           HB1      SER  30   2.861   3.758  -8.765
  210    H    ILE  31           HN       ILE  31   3.060   6.176  -5.052
  211    HA   ILE  31           HA       ILE  31   0.203   5.530  -4.988
  212    HB   ILE  31           HB       ILE  31   0.205   6.853  -2.857
  213   HG12  ILE  31          HG12      ILE  31   3.211   6.736  -3.207
  214   HG13  ILE  31          HG11      ILE  31   2.234   8.191  -3.374
  215   HG21  ILE  31          HG21      ILE  31   2.078   4.494  -2.995
  216   HG22  ILE  31          HG22      ILE  31   0.322   4.420  -2.864
  217   HG23  ILE  31          HG23      ILE  31   1.278   5.089  -1.541
  218   HD11  ILE  31          HD13      ILE  31   2.564   6.559  -0.868
  219   HD12  ILE  31          HD11      ILE  31   1.571   8.007  -1.029
  220   HD13  ILE  31          HD12      ILE  31   3.323   8.113  -1.213
  221    H    SER  32           HN       SER  32  -1.341   7.292  -4.696
  222    HA   SER  32           HA       SER  32  -0.533   9.930  -5.595
  223    HG   SER  32           HG       SER  32  -1.926  10.454  -8.436
  224    HB2  SER  32           HB2      SER  32  -0.924   8.762  -7.713
  225    HB3  SER  32           HB1      SER  32  -2.520   8.260  -7.157
  226    H    GLY  33           HN       GLY  33  -1.993  11.549  -5.037
  227    HA2  GLY  33           HA2      GLY  33  -3.885  10.785  -2.969
  228    HA3  GLY  33           HA1      GLY  33  -3.402  12.421  -3.389
  229    H    MET  34           HN       MET  34  -6.076  11.284  -2.929
  230    HA   MET  34           HA       MET  34  -7.310  11.413  -5.568
  231    HB2  MET  34           HB2      MET  34  -8.048   9.662  -4.010
  232    HB3  MET  34           HB1      MET  34  -8.534  10.894  -2.854
  233    HG2  MET  34           HG2      MET  34 -10.205  11.720  -4.420
  234    HG3  MET  34           HG1      MET  34  -9.708  10.506  -5.598
  235    HE1  MET  34           HE3      MET  34 -10.148   7.940  -5.369
  236    HE2  MET  34           HE1      MET  34 -10.804   7.176  -3.921
  237    HE3  MET  34           HE2      MET  34  -9.212   7.935  -3.874
  238    H    ARG  35           HN       ARG  35  -8.976  12.897  -6.083
  239    HA   ARG  35           HA       ARG  35  -8.767  15.423  -4.593
  240    HE   ARG  35           HE       ARG  35  -5.304  15.582  -8.010
  241    HB2  ARG  35           HB2      ARG  35  -9.595  14.895  -7.451
  242    HB3  ARG  35           HB1      ARG  35  -9.623  16.476  -6.686
  243    HG2  ARG  35           HG2      ARG  35  -7.640  16.475  -7.888
  244    HG3  ARG  35           HG1      ARG  35  -7.127  16.092  -6.244
  245    HD2  ARG  35           HD2      ARG  35  -6.992  13.741  -6.795
  246    HD3  ARG  35           HD1      ARG  35  -7.635  14.051  -8.407
  247   HH11  ARG  35          HH11      ARG  35  -6.321  12.282  -8.485
  248   HH12  ARG  35          HH12      ARG  35  -4.834  11.796  -9.229
  249   HH21  ARG  35          HH21      ARG  35  -3.343  14.950  -8.986
  250   HH22  ARG  35          HH22      ARG  35  -3.140  13.312  -9.511
  251    H    ASP  36           HN       ASP  36 -10.339  15.170  -3.042
  252    HA   ASP  36           HA       ASP  36 -13.057  14.535  -3.937
  253    HB2  ASP  36           HB2      ASP  36 -11.923  14.734  -1.138
  254    HB3  ASP  36           HB1      ASP  36 -13.573  14.270  -1.538
  255    H    GLN  37           HN       GLN  37 -14.638  16.021  -3.988
  256    HA   GLN  37           HA       GLN  37 -14.055  18.674  -2.846
  257    HB2  GLN  37           HB2      GLN  37 -15.647  18.099  -5.350
  258    HB3  GLN  37           HB1      GLN  37 -15.269  19.686  -4.698
  259    HG2  GLN  37           HG2      GLN  37 -12.887  19.273  -5.090
  260    HG3  GLN  37           HG1      GLN  37 -13.283  17.695  -5.771
  261   HE21  GLN  37          HE21      GLN  37 -13.391  21.136  -6.246
  262   HE22  GLN  37          HE22      GLN  37 -13.773  21.096  -7.930
  263    H    SER  38           HN       SER  38 -15.735  16.122  -2.137
  264    HA   SER  38           HA       SER  38 -17.867  17.616  -0.884
  265    HG   SER  38           HG       SER  38 -18.199  17.730  -3.598
  266    HB2  SER  38           HB2      SER  38 -18.468  15.468  -2.928
  267    HB3  SER  38           HB1      SER  38 -19.653  16.106  -1.788
  268    H    THR  39           HN       THR  39 -18.676  16.624   0.933
  269    HA   THR  39           HA       THR  39 -17.133  14.376   1.917
  270    HB   THR  39           HB       THR  39 -18.361  14.767   4.049
  271    HG1  THR  39           HG1      THR  39 -19.923  16.252   4.161
  272   HG21  THR  39          HG23      THR  39 -17.321  16.936   4.553
  273   HG22  THR  39          HG21      THR  39 -17.074  17.212   2.830
  274   HG23  THR  39          HG22      THR  39 -16.232  15.891   3.640
  275    H    THR  40           HN       THR  40 -17.834  12.339   2.192
  276    HA   THR  40           HA       THR  40 -20.653  11.690   2.155
  277    HB   THR  40           HB       THR  40 -20.166  11.783  -0.244
  278    HG1  THR  40           HG1      THR  40 -21.067   9.815  -0.688
  279   HG21  THR  40          HG23      THR  40 -17.765  11.333  -0.162
  280   HG22  THR  40          HG21      THR  40 -18.576  10.212  -1.257
  281   HG23  THR  40          HG22      THR  40 -18.084   9.676   0.350
  282    H    GLY  41           HN       GLY  41 -18.185  11.414   3.852
  283    HA2  GLY  41           HA2      GLY  41 -18.128   9.694   5.570
  284    HA3  GLY  41           HA1      GLY  41 -18.420   8.506   4.309
  285    H    GLU  42           HN       GLU  42 -16.598   9.177   2.401
  286    HA   GLU  42           HA       GLU  42 -14.057   8.704   3.791
  287    HB2  GLU  42           HB2      GLU  42 -13.315   7.659   1.663
  288    HB3  GLU  42           HB1      GLU  42 -14.678   6.839   2.414
  289    HG2  GLU  42           HG2      GLU  42 -16.187   8.058   0.893
  290    HG3  GLU  42           HG1      GLU  42 -14.774   8.735   0.091
  291    H    ALA  43           HN       ALA  43 -12.144   9.704   3.017
  292    HA   ALA  43           HA       ALA  43 -12.229  11.681   0.954
  293    HB1  ALA  43           HB3      ALA  43 -11.822  13.639   2.347
  294    HB2  ALA  43           HB1      ALA  43 -12.013  12.657   3.800
  295    HB3  ALA  43           HB2      ALA  43 -13.386  12.915   2.723
  296    H    THR  44           HN       THR  44 -10.248  12.011   0.165
  297    HA   THR  44           HA       THR  44  -8.027  11.688  -0.207
  298    HB   THR  44           HB       THR  44  -6.494  12.415   1.557
  299    HG1  THR  44           HG1      THR  44  -7.161  11.874   3.507
  300   HG21  THR  44          HG23      THR  44  -8.991  14.100   1.365
  301   HG22  THR  44          HG21      THR  44  -7.618  14.131   0.258
  302   HG23  THR  44          HG22      THR  44  -7.419  14.671   1.925
  303    H    GLY  45           HN       GLY  45  -5.931  10.691   1.214
  304    HA2  GLY  45           HA2      GLY  45  -5.596   8.697   2.730
  305    HA3  GLY  45           HA1      GLY  45  -6.791   7.910   1.710
  306    H    ILE  46           HN       ILE  46  -3.909   7.315   2.295
  307    HA   ILE  46           HA       ILE  46  -2.613   7.703  -0.275
  308    HB   ILE  46           HB       ILE  46  -1.630   6.150   2.122
  309   HG12  ILE  46          HG12      ILE  46  -2.021   8.503   2.699
  310   HG13  ILE  46          HG11      ILE  46  -0.298   8.144   2.655
  311   HG21  ILE  46          HG21      ILE  46  -0.180   7.207  -0.299
  312   HG22  ILE  46          HG22      ILE  46  -0.515   5.516   0.066
  313   HG23  ILE  46          HG23      ILE  46   0.582   6.439   1.093
  314   HD11  ILE  46          HD13      ILE  46  -0.798  10.304   1.654
  315   HD12  ILE  46          HD11      ILE  46  -1.859   9.524   0.483
  316   HD13  ILE  46          HD12      ILE  46  -0.128   9.188   0.464
  317    H    TYR  47           HN       TYR  47  -2.740   6.311  -1.910
  318    HA   TYR  47           HA       TYR  47  -3.038   3.463  -1.389
  319    HD1  TYR  47           HD1      TYR  47  -5.627   6.701  -1.989
  320    HD2  TYR  47           HD2      TYR  47  -4.858   3.974  -5.162
  321    HE1  TYR  47           HE1      TYR  47  -6.350   8.397  -3.613
  322    HE2  TYR  47           HE2      TYR  47  -5.577   5.664  -6.797
  323    HH   TYR  47           HH       TYR  47  -6.970   7.668  -6.880
  324    HB2  TYR  47           HB2      TYR  47  -4.941   3.203  -2.888
  325    HB3  TYR  47           HB1      TYR  47  -5.353   4.292  -1.569
  326    H    VAL  48           HN       VAL  48  -2.317   2.138  -3.052
  327    HA   VAL  48           HA       VAL  48  -0.491   3.404  -4.905
  328    HB   VAL  48           HB       VAL  48  -1.089   0.471  -4.494
  329   HG11  VAL  48          HG11      VAL  48  -0.105   0.909  -6.674
  330   HG12  VAL  48          HG12      VAL  48   1.057   0.101  -5.622
  331   HG13  VAL  48          HG13      VAL  48   1.193   1.834  -5.918
  332   HG21  VAL  48          HG23      VAL  48   1.122   2.188  -3.374
  333   HG22  VAL  48          HG21      VAL  48   0.982   0.439  -3.185
  334   HG23  VAL  48          HG22      VAL  48  -0.228   1.503  -2.468
  335    H    LYS  49           HN       LYS  49  -0.693   3.548  -7.071
  336    HA   LYS  49           HA       LYS  49  -3.088   2.366  -8.312
  337    HB2  LYS  49           HB2      LYS  49  -3.360   4.801  -7.953
  338    HB3  LYS  49           HB1      LYS  49  -1.911   5.088  -8.905
  339    HG2  LYS  49           HG2      LYS  49  -2.992   4.159 -10.872
  340    HG3  LYS  49           HG1      LYS  49  -4.435   3.796  -9.924
  341    HD2  LYS  49           HD2      LYS  49  -4.832   5.822 -11.135
  342    HD3  LYS  49           HD1      LYS  49  -4.637   6.235  -9.431
  343    HE2  LYS  49           HE2      LYS  49  -2.285   6.842  -9.884
  344    HE3  LYS  49           HE1      LYS  49  -2.548   6.501 -11.593
  345    HZ1  LYS  49           HZ3      LYS  49  -4.255   8.234 -11.614
  346    HZ2  LYS  49           HZ1      LYS  49  -2.746   8.851 -11.163
  347    HZ3  LYS  49           HZ2      LYS  49  -3.935   8.583  -9.991
  348    H    SER  50           HN       SER  50   0.285   3.136  -8.518
  349    HA   SER  50           HA       SER  50   0.463   1.528 -10.967
  350    HG   SER  50           HG       SER  50   1.935   2.811 -12.952
  351    HB2  SER  50           HB2      SER  50   0.619   3.880 -11.652
  352    HB3  SER  50           HB1      SER  50   1.931   4.136 -10.501
  353    H    LEU  51           HN       LEU  51   2.832   0.924 -11.397
  354    HA   LEU  51           HA       LEU  51   4.373   0.613  -8.929
  355    HG   LEU  51           HG       LEU  51   1.835  -1.011  -9.035
  356    HB2  LEU  51           HB2      LEU  51   3.578  -1.676 -10.732
  357    HB3  LEU  51           HB1      LEU  51   4.725  -1.789  -9.410
  358   HD11  LEU  51          HD11      LEU  51   1.486  -3.297  -8.239
  359   HD12  LEU  51          HD12      LEU  51   3.135  -3.712  -8.710
  360   HD13  LEU  51          HD13      LEU  51   1.952  -3.266  -9.940
  361   HD21  LEU  51          HD23      LEU  51   2.262  -1.497  -6.700
  362   HD22  LEU  51          HD21      LEU  51   3.398  -0.279  -7.281
  363   HD23  LEU  51          HD22      LEU  51   3.925  -1.951  -7.074
  364    H    ILE  52           HN       ILE  52   6.595  -0.119  -9.323
  365    HA   ILE  52           HA       ILE  52   7.553   0.811 -11.943
  366    HB   ILE  52           HB       ILE  52   9.084   0.608  -9.352
  367   HG12  ILE  52          HG12      ILE  52   7.945   3.004 -10.812
  368   HG13  ILE  52          HG11      ILE  52   7.375   2.360  -9.275
  369   HG21  ILE  52          HG21      ILE  52  10.500   0.307 -11.314
  370   HG22  ILE  52          HG22      ILE  52  10.823   1.858 -10.540
  371   HG23  ILE  52          HG23      ILE  52   9.859   1.793 -12.016
  372   HD11  ILE  52          HD13      ILE  52   9.527   2.923  -8.259
  373   HD12  ILE  52          HD11      ILE  52   8.720   4.337  -8.936
  374   HD13  ILE  52          HD12      ILE  52  10.067   3.592  -9.798
  375    HA   PRO  53           HA       PRO  53   8.221  -3.673 -12.537
  376    HB2  PRO  53           HB2      PRO  53   9.343  -2.550 -15.058
  377    HB3  PRO  53           HB1      PRO  53   8.219  -3.893 -14.826
  378    HG2  PRO  53           HG2      PRO  53   7.349  -1.541 -15.710
  379    HG3  PRO  53           HG1      PRO  53   6.390  -2.489 -14.559
  380    HD2  PRO  53           HD2      PRO  53   8.067  -0.062 -14.089
  381    HD3  PRO  53           HD1      PRO  53   6.522  -0.529 -13.348
  382    H    GLY  54           HN       GLY  54   9.984  -4.842 -12.037
  383    HA2  GLY  54           HA2      GLY  54  12.298  -5.387 -12.213
  384    HA3  GLY  54           HA1      GLY  54  12.644  -3.692 -12.519
  385    H    SER  55           HN       SER  55  10.605  -3.316 -10.135
  386    HA   SER  55           HA       SER  55  12.711  -3.192  -8.138
  387    HG   SER  55           HG       SER  55  12.270  -1.068  -8.800
  388    HB2  SER  55           HB2      SER  55   9.842  -2.228  -8.048
  389    HB3  SER  55           HB1      SER  55  11.051  -1.937  -6.798
  390    H    ALA  56           HN       ALA  56  11.750  -3.628  -5.778
  391    HA   ALA  56           HA       ALA  56  11.505  -6.422  -5.563
  392    HB1  ALA  56           HB3      ALA  56  10.908  -4.314  -3.492
  393    HB2  ALA  56           HB1      ALA  56  12.483  -5.043  -3.804
  394    HB3  ALA  56           HB2      ALA  56  11.163  -6.031  -3.179
  395    H    ALA  57           HN       ALA  57   9.104  -3.874  -4.895
  396    HA   ALA  57           HA       ALA  57   6.951  -5.489  -4.256
  397    HB1  ALA  57           HB3      ALA  57   6.974  -3.065  -3.946
  398    HB2  ALA  57           HB1      ALA  57   5.534  -3.593  -4.819
  399    HB3  ALA  57           HB2      ALA  57   6.869  -2.840  -5.693
  400    H    ALA  58           HN       ALA  58   7.877  -4.250  -7.465
  401    HA   ALA  58           HA       ALA  58   5.725  -5.391  -8.878
  402    HB1  ALA  58           HB3      ALA  58   8.475  -4.703  -9.905
  403    HB2  ALA  58           HB1      ALA  58   7.117  -3.585  -9.773
  404    HB3  ALA  58           HB2      ALA  58   7.028  -4.954 -10.882
  405    H    LEU  59           HN       LEU  59   9.111  -6.505  -8.665
  406    HA   LEU  59           HA       LEU  59   8.744  -8.905 -10.052
  407    HG   LEU  59           HG       LEU  59  10.884  -6.768  -9.930
  408    HB2  LEU  59           HB2      LEU  59  10.755  -8.240  -7.903
  409    HB3  LEU  59           HB1      LEU  59  10.849  -9.628  -8.970
  410   HD11  LEU  59          HD11      LEU  59  13.180  -8.671  -9.491
  411   HD12  LEU  59          HD12      LEU  59  12.841  -7.215  -8.555
  412   HD13  LEU  59          HD13      LEU  59  13.285  -7.086 -10.258
  413   HD21  LEU  59          HD23      LEU  59  10.096  -8.365 -11.590
  414   HD22  LEU  59          HD21      LEU  59  11.517  -9.374 -11.312
  415   HD23  LEU  59          HD22      LEU  59  11.700  -7.766 -12.014
  416    H    ASP  60           HN       ASP  60   7.835  -8.035  -6.857
  417    HA   ASP  60           HA       ASP  60   7.921 -10.509  -5.559
  418    HB2  ASP  60           HB2      ASP  60   7.477  -8.362  -4.415
  419    HB3  ASP  60           HB1      ASP  60   5.891  -8.299  -5.178
  420    H    GLY  61           HN       GLY  61   5.294  -9.012  -7.430
  421    HA2  GLY  61           HA2      GLY  61   3.925 -10.288  -8.915
  422    HA3  GLY  61           HA1      GLY  61   4.239 -11.708  -7.932
  423    H    ARG  62           HN       ARG  62   3.612 -10.865  -5.414
  424    HA   ARG  62           HA       ARG  62   0.794 -11.011  -5.424
  425    HE   ARG  62           HE       ARG  62   0.533 -12.272  -1.628
  426    HB2  ARG  62           HB2      ARG  62   2.637 -10.232  -3.155
  427    HB3  ARG  62           HB1      ARG  62   0.958 -10.727  -2.992
  428    HG2  ARG  62           HG2      ARG  62   1.519 -12.937  -3.864
  429    HG3  ARG  62           HG1      ARG  62   3.205 -12.442  -4.032
  430    HD2  ARG  62           HD2      ARG  62   2.870 -13.735  -1.993
  431    HD3  ARG  62           HD1      ARG  62   3.341 -12.078  -1.622
  432   HH11  ARG  62          HH11      ARG  62   3.305 -13.257   0.246
  433   HH12  ARG  62          HH12      ARG  62   2.433 -13.313   1.741
  434   HH21  ARG  62          HH21      ARG  62  -0.619 -12.349   0.339
  435   HH22  ARG  62          HH22      ARG  62   0.205 -12.802   1.794
  436    H    ILE  63           HN       ILE  63   2.991  -8.351  -5.505
  437    HA   ILE  63           HA       ILE  63   1.148  -6.380  -4.526
  438    HB   ILE  63           HB       ILE  63   3.645  -5.944  -6.167
  439   HG12  ILE  63          HG12      ILE  63   4.138  -7.225  -4.125
  440   HG13  ILE  63          HG11      ILE  63   4.802  -5.598  -4.035
  441   HG21  ILE  63          HG21      ILE  63   2.198  -4.008  -6.130
  442   HG22  ILE  63          HG22      ILE  63   3.621  -3.709  -5.131
  443   HG23  ILE  63          HG23      ILE  63   2.077  -4.098  -4.373
  444   HD11  ILE  63          HD13      ILE  63   2.270  -6.544  -2.712
  445   HD12  ILE  63          HD11      ILE  63   2.944  -4.918  -2.612
  446   HD13  ILE  63          HD12      ILE  63   3.824  -6.279  -1.920
  447    H    GLU  64           HN       GLU  64  -0.713  -6.298  -5.700
  448    HA   GLU  64           HA       GLU  64  -0.470  -5.895  -8.602
  449    HB2  GLU  64           HB2      GLU  64  -2.702  -6.695  -8.835
  450    HB3  GLU  64           HB1      GLU  64  -1.874  -7.815  -7.764
  451    HG2  GLU  64           HG2      GLU  64  -2.904  -6.681  -5.833
  452    HG3  GLU  64           HG1      GLU  64  -3.785  -5.639  -6.949
  453    HA   PRO  65           HA       PRO  65  -1.788  -1.696  -8.340
  454    HB2  PRO  65           HB2      PRO  65  -3.540  -1.500 -10.430
  455    HB3  PRO  65           HB1      PRO  65  -1.784  -1.553 -10.630
  456    HG2  PRO  65           HG2      PRO  65  -3.784  -3.774 -10.874
  457    HG3  PRO  65           HG1      PRO  65  -2.420  -3.377 -11.939
  458    HD2  PRO  65           HD2      PRO  65  -2.247  -5.348 -10.137
  459    HD3  PRO  65           HD1      PRO  65  -0.858  -4.293 -10.482
  460    H    ASN  66           HN       ASN  66  -3.782  -0.287  -8.241
  461    HA   ASN  66           HA       ASN  66  -5.715   0.279  -7.192
  462    HB2  ASN  66           HB2      ASN  66  -6.597  -2.460  -8.129
  463    HB3  ASN  66           HB1      ASN  66  -7.665  -1.180  -7.564
  464   HD21  ASN  66          HD21      ASN  66  -7.549  -2.538 -10.146
  465   HD22  ASN  66          HD22      ASN  66  -7.325  -1.296 -11.325
  466    H    ASP  67           HN       ASP  67  -4.410   0.123  -5.196
  467    HA   ASP  67           HA       ASP  67  -5.767  -1.603  -3.291
  468    HB2  ASP  67           HB2      ASP  67  -3.661  -2.399  -2.282
  469    HB3  ASP  67           HB1      ASP  67  -3.852  -2.973  -3.936
  470    H    LYS  68           HN       LYS  68  -5.604  -0.865  -1.122
  471    HA   LYS  68           HA       LYS  68  -4.702   1.932  -0.938
  472    HB2  LYS  68           HB2      LYS  68  -7.104   1.672  -0.634
  473    HB3  LYS  68           HB1      LYS  68  -6.839   0.477   0.628
  474    HG2  LYS  68           HG2      LYS  68  -5.751   2.201   2.002
  475    HG3  LYS  68           HG1      LYS  68  -6.087   3.391   0.743
  476    HD2  LYS  68           HD2      LYS  68  -8.476   3.036   1.015
  477    HD3  LYS  68           HD1      LYS  68  -8.172   1.783   2.219
  478    HE2  LYS  68           HE2      LYS  68  -7.083   3.454   3.657
  479    HE3  LYS  68           HE1      LYS  68  -7.437   4.699   2.459
  480    HZ1  LYS  68           HZ3      LYS  68  -9.057   4.688   4.257
  481    HZ2  LYS  68           HZ1      LYS  68  -9.466   3.084   3.907
  482    HZ3  LYS  68           HZ2      LYS  68  -9.791   4.306   2.783
  483    H    ILE  69           HN       ILE  69  -2.859   2.180   0.117
  484    HA   ILE  69           HA       ILE  69  -1.746   0.196   1.828
  485    HB   ILE  69           HB       ILE  69  -0.928   3.090   1.527
  486   HG12  ILE  69          HG12      ILE  69  -0.909   1.867  -0.619
  487   HG13  ILE  69          HG11      ILE  69   0.715   2.289  -0.090
  488   HG21  ILE  69          HG21      ILE  69   0.569   0.712   2.620
  489   HG22  ILE  69          HG22      ILE  69  -0.022   2.097   3.539
  490   HG23  ILE  69          HG23      ILE  69   1.259   2.313   2.347
  491   HD11  ILE  69          HD13      ILE  69  -0.585  -0.414   0.153
  492   HD12  ILE  69          HD11      ILE  69   1.033   0.000   0.717
  493   HD13  ILE  69          HD12      ILE  69   0.660   0.052  -1.005
  494    H    LEU  70           HN       LEU  70  -1.641   0.095   4.037
  495    HA   LEU  70           HA       LEU  70  -3.260   2.070   5.504
  496    HG   LEU  70           HG       LEU  70  -4.466  -0.528   4.275
  497    HB2  LEU  70           HB2      LEU  70  -2.859  -0.856   6.126
  498    HB3  LEU  70           HB1      LEU  70  -3.777   0.272   7.106
  499   HD11  LEU  70          HD11      LEU  70  -5.717  -1.320   6.900
  500   HD12  LEU  70          HD12      LEU  70  -4.781  -2.368   5.835
  501   HD13  LEU  70          HD13      LEU  70  -6.334  -1.728   5.299
  502   HD21  LEU  70          HD23      LEU  70  -5.949   1.166   6.281
  503   HD22  LEU  70          HD21      LEU  70  -6.578   0.642   4.720
  504   HD23  LEU  70          HD22      LEU  70  -5.193   1.731   4.791
  505    H    ARG  71           HN       ARG  71  -0.809  -0.421   6.269
  506    HA   ARG  71           HA       ARG  71   0.759   1.632   7.648
  507    HE   ARG  71           HE       ARG  71   0.423   0.744  11.710
  508    HB2  ARG  71           HB2      ARG  71  -0.035  -0.994   8.918
  509    HB3  ARG  71           HB1      ARG  71   1.033   0.211   9.624
  510    HG2  ARG  71           HG2      ARG  71  -0.766   1.783   9.809
  511    HG3  ARG  71           HG1      ARG  71  -1.854   0.705   8.933
  512    HD2  ARG  71           HD2      ARG  71  -2.320   0.547  11.290
  513    HD3  ARG  71           HD1      ARG  71  -1.591  -0.962  10.743
  514   HH11  ARG  71          HH11      ARG  71  -2.256  -1.176  12.842
  515   HH12  ARG  71          HH12      ARG  71  -1.571  -1.440  14.411
  516   HH21  ARG  71          HH21      ARG  71   1.331   0.403  13.775
  517   HH22  ARG  71          HH22      ARG  71   0.469  -0.545  14.940
  518    H    VAL  72           HN       VAL  72   2.898   1.407   7.421
  519    HA   VAL  72           HA       VAL  72   3.900  -0.838   5.857
  520    HB   VAL  72           HB       VAL  72   5.503   1.526   6.837
  521   HG11  VAL  72          HG11      VAL  72   6.787   1.078   4.739
  522   HG12  VAL  72          HG12      VAL  72   5.823  -0.385   4.529
  523   HG13  VAL  72          HG13      VAL  72   6.871  -0.213   5.937
  524   HG21  VAL  72          HG23      VAL  72   3.851   1.360   4.321
  525   HG22  VAL  72          HG21      VAL  72   4.979   2.653   4.726
  526   HG23  VAL  72          HG22      VAL  72   3.535   2.402   5.709
  527    H    ASP  73           HN       ASP  73   6.236  -1.562   6.596
  528    HA   ASP  73           HA       ASP  73   6.095  -3.063   8.868
  529    HB2  ASP  73           HB2      ASP  73   7.862  -3.190   7.089
  530    HB3  ASP  73           HB1      ASP  73   8.649  -1.812   7.848
  531    H    ASP  74           HN       ASP  74   5.593  -2.386  10.853
  532    HA   ASP  74           HA       ASP  74   5.593  -1.244  12.819
  533    HB2  ASP  74           HB2      ASP  74   8.474  -0.744  12.047
  534    HB3  ASP  74           HB1      ASP  74   7.800  -0.521  13.659
  535    H    VAL  75           HN       VAL  75   4.944   0.242  10.333
  536    HA   VAL  75           HA       VAL  75   5.111   2.924  11.477
  537    HB   VAL  75           HB       VAL  75   5.830   2.335   8.598
  538   HG11  VAL  75          HG11      VAL  75   6.322   4.746   8.466
  539   HG12  VAL  75          HG12      VAL  75   5.677   4.948  10.096
  540   HG13  VAL  75          HG13      VAL  75   4.618   4.422   8.787
  541   HG21  VAL  75          HG23      VAL  75   7.628   1.749  10.153
  542   HG22  VAL  75          HG21      VAL  75   7.551   3.367  10.850
  543   HG23  VAL  75          HG22      VAL  75   8.053   3.152   9.173
  544    H    ASN  76           HN       ASN  76   3.453   4.344  10.759
  545    HA   ASN  76           HA       ASN  76   1.235   2.999   9.362
  546    HB2  ASN  76           HB2      ASN  76   0.612   3.229  11.669
  547    HB3  ASN  76           HB1      ASN  76   1.145   4.907  11.702
  548   HD21  ASN  76          HD21      ASN  76  -0.125   6.491  10.745
  549   HD22  ASN  76          HD22      ASN  76  -1.781   6.216  10.334
  550    H    VAL  77           HN       VAL  77   0.407   4.015   7.627
  551    HA   VAL  77           HA       VAL  77   1.383   6.739   7.067
  552    HB   VAL  77           HB       VAL  77   1.048   6.265   4.698
  553   HG11  VAL  77          HG11      VAL  77   2.797   4.530   4.421
  554   HG12  VAL  77          HG12      VAL  77   2.678   4.185   6.146
  555   HG13  VAL  77          HG13      VAL  77   3.222   5.770   5.599
  556   HG21  VAL  77          HG23      VAL  77   0.466   4.018   3.930
  557   HG22  VAL  77          HG21      VAL  77  -0.833   4.726   4.888
  558   HG23  VAL  77          HG22      VAL  77   0.224   3.507   5.601
  559    H    GLN  78           HN       GLN  78  -1.127   5.684   8.509
  560    HA   GLN  78           HA       GLN  78  -3.256   6.674   6.812
  561    HB2  GLN  78           HB2      GLN  78  -3.300   5.687   9.669
  562    HB3  GLN  78           HB1      GLN  78  -4.722   6.094   8.719
  563    HG2  GLN  78           HG2      GLN  78  -2.751   3.902   8.113
  564    HG3  GLN  78           HG1      GLN  78  -4.369   3.696   8.783
  565   HE21  GLN  78          HE21      GLN  78  -6.160   3.985   7.453
  566   HE22  GLN  78          HE22      GLN  78  -6.031   4.001   5.730
  567    H    GLY  79           HN       GLY  79  -1.124   8.514   7.678
  568    HA2  GLY  79           HA2      GLY  79  -2.718  10.763   8.254
  569    HA3  GLY  79           HA1      GLY  79  -1.963  10.213   9.742
  570    H    MET  80           HN       MET  80  -0.203   9.665   6.835
  571    HA   MET  80           HA       MET  80   1.522  11.971   7.470
  572    HB2  MET  80           HB2      MET  80   2.389   9.318   6.308
  573    HB3  MET  80           HB1      MET  80   3.437  10.663   6.736
  574    HG2  MET  80           HG2      MET  80   2.629  10.391   9.104
  575    HG3  MET  80           HG1      MET  80   1.868   8.889   8.583
  576    HE1  MET  80           HE3      MET  80   5.044   6.871   7.345
  577    HE2  MET  80           HE1      MET  80   4.146   8.019   6.352
  578    HE3  MET  80           HE2      MET  80   3.281   6.903   7.409
  579    H    ALA  81           HN       ALA  81   2.403  13.143   5.769
  580    HA   ALA  81           HA       ALA  81   0.819  13.403   3.464
  581    HB1  ALA  81           HB3      ALA  81   3.633  14.404   3.879
  582    HB2  ALA  81           HB1      ALA  81   2.171  15.226   4.426
  583    HB3  ALA  81           HB2      ALA  81   2.465  15.003   2.701
  584    H    GLN  82           HN       GLN  82   1.419  13.081   1.230
  585    HA   GLN  82           HA       GLN  82   2.186  10.507   0.600
  586    HB2  GLN  82           HB2      GLN  82   0.973  11.972  -0.943
  587    HB3  GLN  82           HB1      GLN  82   2.406  12.973  -1.136
  588    HG2  GLN  82           HG2      GLN  82   3.586  11.102  -2.156
  589    HG3  GLN  82           HG1      GLN  82   2.164  10.083  -1.941
  590   HE21  GLN  82          HE21      GLN  82   0.368  10.403  -3.248
  591   HE22  GLN  82          HE22      GLN  82   0.437  11.338  -4.699
  592    H    SER  83           HN       SER  83   4.176  13.434   0.164
  593    HA   SER  83           HA       SER  83   6.522  12.193  -0.632
  594    HG   SER  83           HG       SER  83   8.401  13.466   0.356
  595    HB2  SER  83           HB2      SER  83   6.203  14.609  -0.772
  596    HB3  SER  83           HB1      SER  83   6.198  14.731   0.987
  597    H    ASP  84           HN       ASP  84   5.292  12.774   2.622
  598    HA   ASP  84           HA       ASP  84   7.600  12.087   4.058
  599    HB2  ASP  84           HB2      ASP  84   5.659  13.191   5.088
  600    HB3  ASP  84           HB1      ASP  84   4.704  11.729   4.862
  601    H    VAL  85           HN       VAL  85   4.876  10.095   2.958
  602    HA   VAL  85           HA       VAL  85   5.689   7.679   4.118
  603    HB   VAL  85           HB       VAL  85   4.181   8.016   1.519
  604   HG11  VAL  85          HG11      VAL  85   3.229   5.817   2.082
  605   HG12  VAL  85          HG12      VAL  85   4.306   5.724   3.475
  606   HG13  VAL  85          HG13      VAL  85   4.974   5.750   1.843
  607   HG21  VAL  85          HG23      VAL  85   3.125   7.834   4.340
  608   HG22  VAL  85          HG21      VAL  85   2.153   7.894   2.869
  609   HG23  VAL  85          HG22      VAL  85   3.136   9.282   3.334
  610    H    VAL  86           HN       VAL  86   6.632   9.265   1.131
  611    HA   VAL  86           HA       VAL  86   7.961   7.092  -0.071
  612    HB   VAL  86           HB       VAL  86   8.579  10.036  -0.375
  613   HG11  VAL  86          HG11      VAL  86   9.202   7.684  -2.159
  614   HG12  VAL  86          HG12      VAL  86  10.362   8.636  -1.233
  615   HG13  VAL  86          HG13      VAL  86   9.480   9.377  -2.567
  616   HG21  VAL  86          HG23      VAL  86   6.237   9.579  -0.845
  617   HG22  VAL  86          HG21      VAL  86   6.695   8.269  -1.933
  618   HG23  VAL  86          HG22      VAL  86   7.105   9.936  -2.338
  619    H    GLU  87           HN       GLU  87   9.086   9.669   2.089
  620    HA   GLU  87           HA       GLU  87  11.808   9.050   2.082
  621    HB2  GLU  87           HB2      GLU  87  10.100  10.211   4.292
  622    HB3  GLU  87           HB1      GLU  87  11.858  10.175   4.313
  623    HG2  GLU  87           HG2      GLU  87  11.911  11.562   2.303
  624    HG3  GLU  87           HG1      GLU  87  10.148  11.600   2.288
  625    H    VAL  88           HN       VAL  88   9.165   7.794   4.064
  626    HA   VAL  88           HA       VAL  88  10.635   6.254   5.857
  627    HB   VAL  88           HB       VAL  88   7.882   5.817   4.703
  628   HG11  VAL  88          HG11      VAL  88   8.690   3.655   5.386
  629   HG12  VAL  88          HG12      VAL  88   7.523   4.234   6.577
  630   HG13  VAL  88          HG13      VAL  88   9.250   4.309   6.926
  631   HG21  VAL  88          HG23      VAL  88   7.142   6.616   6.903
  632   HG22  VAL  88          HG21      VAL  88   8.137   7.813   6.071
  633   HG23  VAL  88          HG22      VAL  88   8.825   6.848   7.376
  634    H    LEU  89           HN       LEU  89   9.189   5.260   2.757
  635    HA   LEU  89           HA       LEU  89  10.037   2.624   2.742
  636    HG   LEU  89           HG       LEU  89   7.674   4.319   1.715
  637    HB2  LEU  89           HB2      LEU  89   9.775   4.476   0.370
  638    HB3  LEU  89           HB1      LEU  89   9.810   2.725   0.297
  639   HD11  LEU  89          HD11      LEU  89   7.598   4.748  -0.677
  640   HD12  LEU  89          HD12      LEU  89   6.240   3.738  -0.179
  641   HD13  LEU  89          HD13      LEU  89   7.622   3.014  -1.002
  642   HD21  LEU  89          HD23      LEU  89   7.852   1.399   0.979
  643   HD22  LEU  89          HD21      LEU  89   6.461   2.191   1.718
  644   HD23  LEU  89          HD22      LEU  89   7.982   2.072   2.604
  645    H    ARG  90           HN       ARG  90  11.774   5.549   1.851
  646    HA   ARG  90           HA       ARG  90  14.040   4.182   0.759
  647    HE   ARG  90           HE       ARG  90  11.751   8.077  -1.846
  648    HB2  ARG  90           HB2      ARG  90  13.822   7.030   1.748
  649    HB3  ARG  90           HB1      ARG  90  15.098   6.382   0.728
  650    HG2  ARG  90           HG2      ARG  90  13.499   5.982  -1.055
  651    HG3  ARG  90           HG1      ARG  90  12.191   6.573  -0.030
  652    HD2  ARG  90           HD2      ARG  90  13.396   8.754   0.119
  653    HD3  ARG  90           HD1      ARG  90  14.547   8.140  -1.067
  654   HH11  ARG  90          HH11      ARG  90  14.798   9.768  -1.955
  655   HH12  ARG  90          HH12      ARG  90  14.377  10.700  -3.353
  656   HH21  ARG  90          HH21      ARG  90  11.190   9.300  -3.687
  657   HH22  ARG  90          HH22      ARG  90  12.328  10.433  -4.337
  658    H    ASN  91           HN       ASN  91  13.088   5.314   3.915
  659    HA   ASN  91           HA       ASN  91  15.686   5.127   5.096
  660    HB2  ASN  91           HB2      ASN  91  12.941   5.227   6.363
  661    HB3  ASN  91           HB1      ASN  91  14.462   5.364   7.242
  662   HD21  ASN  91          HD21      ASN  91  12.266   7.260   7.016
  663   HD22  ASN  91          HD22      ASN  91  12.945   8.709   6.366
  664    H    ALA  92           HN       ALA  92  13.260   2.874   4.270
  665    HA   ALA  92           HA       ALA  92  13.465   0.912   6.202
  666    HB1  ALA  92           HB3      ALA  92  12.756  -0.667   4.483
  667    HB2  ALA  92           HB1      ALA  92  13.153   0.509   3.230
  668    HB3  ALA  92           HB2      ALA  92  11.850   0.843   4.370
  669    H    GLY  93           HN       GLY  93  14.985   0.273   3.066
  670    HA2  GLY  93           HA2      GLY  93  17.035  -0.623   2.528
  671    HA3  GLY  93           HA1      GLY  93  17.639   0.073   4.025
  672    H    ASN  94           HN       ASN  94  14.976  -1.936   4.519
  673    HA   ASN  94           HA       ASN  94  16.553  -4.367   4.856
  674    HB2  ASN  94           HB2      ASN  94  15.871  -4.635   7.198
  675    HB3  ASN  94           HB1      ASN  94  16.792  -3.149   6.992
  676   HD21  ASN  94          HD21      ASN  94  13.561  -4.471   7.331
  677   HD22  ASN  94          HD22      ASN  94  12.835  -3.034   7.954
  678    HA   PRO  95           HA       PRO  95  12.851  -6.570   3.799
  679    HB2  PRO  95           HB2      PRO  95  12.962  -8.050   6.373
  680    HB3  PRO  95           HB1      PRO  95  12.919  -8.674   4.722
  681    HG2  PRO  95           HG2      PRO  95  15.171  -8.730   6.147
  682    HG3  PRO  95           HG1      PRO  95  15.196  -8.374   4.408
  683    HD2  PRO  95           HD2      PRO  95  15.476  -6.516   6.732
  684    HD3  PRO  95           HD1      PRO  95  16.296  -6.488   5.158
  685    H    VAL  96           HN       VAL  96  11.161  -5.146   3.898
  686    HA   VAL  96           HA       VAL  96   9.978  -4.609   6.538
  687    HB   VAL  96           HB       VAL  96   8.813  -2.712   5.416
  688   HG11  VAL  96          HG11      VAL  96  11.824  -2.710   5.279
  689   HG12  VAL  96          HG12      VAL  96  10.837  -2.323   6.687
  690   HG13  VAL  96          HG13      VAL  96  10.803  -1.273   5.270
  691   HG21  VAL  96          HG23      VAL  96   9.625  -1.963   3.229
  692   HG22  VAL  96          HG21      VAL  96   8.868  -3.552   3.127
  693   HG23  VAL  96          HG22      VAL  96  10.625  -3.410   3.105
  694    H    ARG  97           HN       ARG  97   7.705  -4.612   6.775
  695    HA   ARG  97           HA       ARG  97   6.356  -6.524   5.014
  696    HE   ARG  97           HE       ARG  97   2.282  -8.435   7.276
  697    HB2  ARG  97           HB2      ARG  97   6.504  -7.132   7.400
  698    HB3  ARG  97           HB1      ARG  97   5.675  -5.643   7.830
  699    HG2  ARG  97           HG2      ARG  97   3.685  -6.402   6.636
  700    HG3  ARG  97           HG1      ARG  97   4.517  -7.897   6.201
  701    HD2  ARG  97           HD2      ARG  97   4.748  -8.456   8.570
  702    HD3  ARG  97           HD1      ARG  97   3.926  -6.959   9.007
  703   HH11  ARG  97          HH11      ARG  97   3.541  -8.556  10.523
  704   HH12  ARG  97          HH12      ARG  97   2.189  -9.439  11.152
  705   HH21  ARG  97          HH21      ARG  97   0.500  -9.598   8.097
  706   HH22  ARG  97          HH22      ARG  97   0.465 -10.034   9.774
  707    H    LEU  98           HN       LEU  98   4.375  -6.046   4.103
  708    HA   LEU  98           HA       LEU  98   3.559  -3.220   4.269
  709    HG   LEU  98           HG       LEU  98   5.485  -4.828   2.164
  710    HB2  LEU  98           HB2      LEU  98   3.020  -5.064   1.956
  711    HB3  LEU  98           HB1      LEU  98   2.876  -3.318   1.999
  712   HD11  LEU  98          HD11      LEU  98   4.239  -3.344  -0.145
  713   HD12  LEU  98          HD12      LEU  98   4.432  -5.092  -0.021
  714   HD13  LEU  98          HD13      LEU  98   5.854  -4.053  -0.121
  715   HD21  LEU  98          HD23      LEU  98   4.885  -1.889   1.866
  716   HD22  LEU  98          HD21      LEU  98   6.486  -2.622   1.766
  717   HD23  LEU  98          HD22      LEU  98   5.583  -2.676   3.281
  718    H    LEU  99           HN       LEU  99   1.537  -2.774   4.895
  719    HA   LEU  99           HA       LEU  99  -0.397  -4.994   5.011
  720    HG   LEU  99           HG       LEU  99  -2.460  -3.396   6.744
  721    HB2  LEU  99           HB2      LEU  99   0.362  -4.352   7.248
  722    HB3  LEU  99           HB1      LEU  99  -0.087  -2.687   6.935
  723   HD11  LEU  99          HD11      LEU  99  -1.386  -6.062   7.652
  724   HD12  LEU  99          HD12      LEU  99  -2.121  -5.709   6.088
  725   HD13  LEU  99          HD13      LEU  99  -3.090  -5.620   7.559
  726   HD21  LEU  99          HD23      LEU  99  -2.801  -3.760   9.137
  727   HD22  LEU  99          HD21      LEU  99  -1.589  -2.514   8.842
  728   HD23  LEU  99          HD22      LEU  99  -1.089  -4.134   9.326
  729    H    LEU 100           HN       LEU 100  -1.593  -4.610   3.227
  730    HA   LEU 100           HA       LEU 100  -2.946  -2.004   3.079
  731    HG   LEU 100           HG       LEU 100  -0.357  -3.850   1.465
  732    HB2  LEU 100           HB2      LEU 100  -2.936  -2.604   0.499
  733    HB3  LEU 100           HB1      LEU 100  -1.628  -1.714   1.254
  734   HD11  LEU 100          HD11      LEU 100  -1.078  -5.772   0.129
  735   HD12  LEU 100          HD12      LEU 100  -2.598  -4.949  -0.225
  736   HD13  LEU 100          HD13      LEU 100  -2.212  -5.413   1.431
  737   HD21  LEU 100          HD23      LEU 100   0.177  -4.024  -0.950
  738   HD22  LEU 100          HD21      LEU 100   0.138  -2.364  -0.356
  739   HD23  LEU 100          HD22      LEU 100  -1.213  -2.995  -1.295
  740    H    ILE 101           HN       ILE 101  -5.049  -2.016   2.152
  741    HA   ILE 101           HA       ILE 101  -6.395  -4.604   2.463
  742    HB   ILE 101           HB       ILE 101  -7.229  -2.731   3.840
  743   HG12  ILE 101          HG12      ILE 101  -9.205  -3.603   1.719
  744   HG13  ILE 101          HG11      ILE 101  -8.729  -4.573   3.108
  745   HG21  ILE 101          HG21      ILE 101  -8.419  -0.870   2.795
  746   HG22  ILE 101          HG22      ILE 101  -7.973  -1.476   1.200
  747   HG23  ILE 101          HG23      ILE 101  -6.725  -0.903   2.306
  748   HD11  ILE 101          HD13      ILE 101 -10.851  -3.542   3.537
  749   HD12  ILE 101          HD11      ILE 101 -10.195  -1.947   3.164
  750   HD13  ILE 101          HD12      ILE 101  -9.635  -2.821   4.590
  751    H    ARG 102           HN       ARG 102  -7.563  -5.533   0.845
  752    HA   ARG 102           HA       ARG 102  -7.721  -4.089  -1.714
  753    HE   ARG 102           HE       ARG 102  -7.177  -6.304  -5.939
  754    HB2  ARG 102           HB2      ARG 102  -5.861  -5.642  -1.880
  755    HB3  ARG 102           HB1      ARG 102  -6.873  -6.961  -1.311
  756    HG2  ARG 102           HG2      ARG 102  -6.541  -7.084  -3.712
  757    HG3  ARG 102           HG1      ARG 102  -8.238  -6.796  -3.325
  758    HD2  ARG 102           HD2      ARG 102  -7.986  -4.442  -3.841
  759    HD3  ARG 102           HD1      ARG 102  -6.263  -4.665  -4.135
  760   HH11  ARG 102          HH11      ARG 102  -8.522  -3.218  -5.035
  761   HH12  ARG 102          HH12      ARG 102  -9.195  -2.909  -6.601
  762   HH21  ARG 102          HH21      ARG 102  -8.061  -5.906  -8.000
  763   HH22  ARG 102          HH22      ARG 102  -8.932  -4.437  -8.285
  764    H    ARG 103           HN       ARG 103  -9.628  -4.198  -2.729
  765    HA   ARG 103           HA       ARG 103 -11.807  -5.532  -1.384
  766    HE   ARG 103           HE       ARG 103 -14.582  -2.654  -1.991
  767    HB2  ARG 103           HB2      ARG 103 -11.857  -3.904  -3.930
  768    HB3  ARG 103           HB1      ARG 103 -13.242  -4.348  -2.942
  769    HG2  ARG 103           HG2      ARG 103 -12.345  -2.996  -1.101
  770    HG3  ARG 103           HG1      ARG 103 -10.987  -2.527  -2.124
  771    HD2  ARG 103           HD2      ARG 103 -12.645  -0.777  -2.145
  772    HD3  ARG 103           HD1      ARG 103 -12.583  -1.545  -3.732
  773   HH11  ARG 103          HH11      ARG 103 -13.878  -0.138  -4.299
  774   HH12  ARG 103          HH12      ARG 103 -15.536   0.094  -4.744
  775   HH21  ARG 103          HH21      ARG 103 -16.764  -2.356  -2.574
  776   HH22  ARG 103          HH22      ARG 103 -17.176  -1.165  -3.763
  777    H    LEU 104           HN       LEU 104 -12.795  -7.360  -1.985
  778    HA   LEU 104           HA       LEU 104 -11.755  -8.750  -4.344
  779    HG   LEU 104           HG       LEU 104 -11.272  -9.169  -1.172
  780    HB2  LEU 104           HB2      LEU 104 -13.440  -9.856  -2.096
  781    HB3  LEU 104           HB1      LEU 104 -12.622 -10.778  -3.343
  782   HD11  LEU 104          HD11      LEU 104 -12.359 -11.207  -0.353
  783   HD12  LEU 104          HD12      LEU 104 -10.601 -11.325  -0.278
  784   HD13  LEU 104          HD13      LEU 104 -11.486 -12.152  -1.561
  785   HD21  LEU 104          HD23      LEU 104  -9.202 -10.152  -1.990
  786   HD22  LEU 104          HD21      LEU 104  -9.981  -9.203  -3.254
  787   HD23  LEU 104          HD22      LEU 104 -10.082 -10.963  -3.285
  788    HA   PRO 105           HA       PRO 105 -15.626  -8.205  -6.432
  789    HB2  PRO 105           HB2      PRO 105 -15.429 -10.060  -8.348
  790    HB3  PRO 105           HB1      PRO 105 -14.355  -8.656  -8.314
  791    HG2  PRO 105           HG2      PRO 105 -13.828 -11.466  -7.438
  792    HG3  PRO 105           HG1      PRO 105 -12.772 -10.354  -8.326
  793    HD2  PRO 105           HD2      PRO 105 -12.613 -10.828  -5.616
  794    HD3  PRO 105           HD1      PRO 105 -12.024  -9.357  -6.413
  795    H    LEU 106           HN       LEU 106 -17.628  -9.268  -6.981
  796    HA   LEU 106           HA       LEU 106 -18.112 -11.785  -5.539
  797    HG   LEU 106           HG       LEU 106 -17.994  -9.095  -3.977
  798    HB2  LEU 106           HB2      LEU 106 -19.916  -9.363  -5.534
  799    HB3  LEU 106           HB1      LEU 106 -20.276 -10.905  -4.780
  800   HD11  LEU 106          HD11      LEU 106 -20.143  -8.068  -3.477
  801   HD12  LEU 106          HD12      LEU 106 -19.344  -8.603  -1.997
  802   HD13  LEU 106          HD13      LEU 106 -20.675  -9.544  -2.671
  803   HD21  LEU 106          HD23      LEU 106 -17.553 -11.440  -3.510
  804   HD22  LEU 106          HD21      LEU 106 -19.115 -11.592  -2.706
  805   HD23  LEU 106          HD22      LEU 106 -17.864 -10.560  -2.013
  806    H    LEU 107           HN       LEU 107 -18.182 -13.011  -7.394
  807    HA   LEU 107           HA       LEU 107 -19.983 -12.222  -9.546
  808    HG   LEU 107           HG       LEU 107 -16.802 -12.592  -9.399
  809    HB2  LEU 107           HB2      LEU 107 -18.167 -14.621  -9.341
  810    HB3  LEU 107           HB1      LEU 107 -19.032 -14.095 -10.773
  811   HD11  LEU 107          HD11      LEU 107 -16.898 -14.020 -12.049
  812   HD12  LEU 107          HD12      LEU 107 -16.038 -14.563 -10.608
  813   HD13  LEU 107          HD13      LEU 107 -15.540 -13.082 -11.427
  814   HD21  LEU 107          HD23      LEU 107 -16.938 -11.063 -11.314
  815   HD22  LEU 107          HD21      LEU 107 -18.422 -11.055 -10.361
  816   HD23  LEU 107          HD22      LEU 107 -18.363 -11.925 -11.893
  817    H    GLU 108           HN       GLU 108 -21.992 -12.947  -9.707
  818    HA   GLU 108           HA       GLU 108 -23.915 -14.093  -9.307
  819    HB2  GLU 108           HB2      GLU 108 -21.905 -16.338  -9.250
  820    HB3  GLU 108           HB1      GLU 108 -23.634 -16.621  -9.109
  821    HG2  GLU 108           HG2      GLU 108 -22.915 -16.963 -11.383
  822    HG3  GLU 108           HG1      GLU 108 -23.980 -15.562 -11.288
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1  -7.794 -16.972  14.272
    2    H2   GLY   1           HT2      GLY   1  -7.937 -17.348  15.915
    3    H3   GLY   1           HT3      GLY   1  -6.423 -17.406  15.163
    4    HA2  GLY   1           HA1      GLY   1  -6.598 -15.417  16.500
    5    HA3  GLY   1           HA2      GLY   1  -6.470 -15.023  14.793
    6    H    SER   2           HN       SER   2  -7.415 -13.099  16.369
    7    HA   SER   2           HA       SER   2 -10.342 -13.196  16.159
    8    HG   SER   2           HG       SER   2  -8.358 -10.458  18.370
    9    HB2  SER   2           HB2      SER   2 -10.238 -11.138  17.620
   10    HB3  SER   2           HB1      SER   2  -9.634 -12.615  18.372
   11    H    HIS   3           HN       HIS   3  -7.837 -10.677  15.834
   12    HA   HIS   3           HA       HIS   3  -9.354  -9.008  14.181
   13    HD1  HIS   3           HD1      HIS   3  -6.474  -9.382  17.011
   14    HD2  HIS   3           HD2      HIS   3  -8.294  -6.027  15.369
   15    HE1  HIS   3           HE1      HIS   3  -6.849  -7.809  18.939
   16    HE2  HIS   3           HE2      HIS   3  -7.988  -5.801  17.927
   17    HB2  HIS   3           HB2      HIS   3  -6.348  -9.242  14.415
   18    HB3  HIS   3           HB1      HIS   3  -7.196  -7.909  13.639
   19    H    GLY   4           HN       GLY   4  -9.783  -8.993  12.060
   20    HA2  GLY   4           HA2      GLY   4  -8.634  -9.442   9.817
   21    HA3  GLY   4           HA1      GLY   4  -8.524 -11.090  10.415
   22    H    TYR   5           HN       TYR   5 -10.063  -9.522   8.195
   23    HA   TYR   5           HA       TYR   5 -12.746 -10.546   8.814
   24    HD1  TYR   5           HD1      TYR   5 -14.627  -8.631   9.169
   25    HD2  TYR   5           HD2      TYR   5 -11.006  -6.760   7.947
   26    HE1  TYR   5           HE1      TYR   5 -15.002  -6.842  10.814
   27    HE2  TYR   5           HE2      TYR   5 -11.372  -4.967   9.589
   28    HH   TYR   5           HH       TYR   5 -13.189  -3.949  10.829
   29    HB2  TYR   5           HB2      TYR   5 -11.840  -8.568   6.712
   30    HB3  TYR   5           HB1      TYR   5 -13.500  -9.115   6.930
   31    H    SER   6           HN       SER   6 -13.967 -11.464   6.962
   32    HA   SER   6           HA       SER   6 -12.261 -12.876   5.036
   33    HG   SER   6           HG       SER   6 -11.909 -13.789   7.262
   34    HB2  SER   6           HB2      SER   6 -14.436 -14.166   6.705
   35    HB3  SER   6           HB1      SER   6 -13.535 -14.957   5.412
   36    H    ASP   7           HN       ASP   7 -13.031 -11.321   3.532
   37    HA   ASP   7           HA       ASP   7 -14.384 -10.539   1.883
   38    HB2  ASP   7           HB2      ASP   7 -14.419 -12.949   1.283
   39    HB3  ASP   7           HB1      ASP   7 -15.857 -13.153   2.278
   40    H    ALA   8           HN       ALA   8 -15.083  -8.917   3.461
   41    HA   ALA   8           HA       ALA   8 -17.888  -9.277   4.289
   42    HB1  ALA   8           HB3      ALA   8 -17.481  -7.602   6.011
   43    HB2  ALA   8           HB1      ALA   8 -15.818  -7.418   5.455
   44    HB3  ALA   8           HB2      ALA   8 -16.348  -8.945   6.161
   45    H    SER   9           HN       SER   9 -19.116  -8.435   2.718
   46    HA   SER   9           HA       SER   9 -20.048  -6.946   1.277
   47    HG   SER   9           HG       SER   9 -20.657  -4.804   1.040
   48    HB2  SER   9           HB2      SER   9 -20.183  -5.598   3.367
   49    HB3  SER   9           HB1      SER   9 -18.630  -4.868   2.960
   50    H    GLY  10           HN       GLY  10 -17.227  -7.948   0.856
   51    HA2  GLY  10           HA2      GLY  10 -15.953  -7.790  -1.107
   52    HA3  GLY  10           HA1      GLY  10 -16.665  -6.214  -1.415
   53    H    PHE  11           HN       PHE  11 -15.204  -7.123   1.641
   54    HA   PHE  11           HA       PHE  11 -12.814  -5.548   1.007
   55    HD1  PHE  11           HD1      PHE  11 -16.503  -4.409   2.162
   56    HD2  PHE  11           HD2      PHE  11 -12.707  -2.569   1.601
   57    HE1  PHE  11           HE1      PHE  11 -17.586  -2.550   0.970
   58    HE2  PHE  11           HE2      PHE  11 -13.784  -0.704   0.408
   59    HZ   PHE  11           HZ       PHE  11 -16.225  -0.694   0.091
   60    HB2  PHE  11           HB2      PHE  11 -14.563  -5.109   3.439
   61    HB3  PHE  11           HB1      PHE  11 -12.990  -4.366   3.180
   62    H    SER  12           HN       SER  12 -10.975  -6.307   1.894
   63    HA   SER  12           HA       SER  12 -11.034  -8.112   4.154
   64    HG   SER  12           HG       SER  12  -9.623 -10.992   2.596
   65    HB2  SER  12           HB2      SER  12 -11.467  -9.660   2.312
   66    HB3  SER  12           HB1      SER  12 -10.060  -9.048   1.443
   67    H    LEU  13           HN       LEU  13  -9.134  -8.146   5.268
   68    HA   LEU  13           HA       LEU  13  -7.187  -6.142   4.574
   69    HG   LEU  13           HG       LEU  13  -9.031  -6.219   6.902
   70    HB2  LEU  13           HB2      LEU  13  -7.348  -8.087   6.875
   71    HB3  LEU  13           HB1      LEU  13  -6.095  -6.874   6.703
   72   HD11  LEU  13          HD11      LEU  13  -8.548  -5.567   9.213
   73   HD12  LEU  13          HD12      LEU  13  -6.912  -6.202   9.046
   74   HD13  LEU  13          HD13      LEU  13  -8.295  -7.293   8.954
   75   HD21  LEU  13          HD23      LEU  13  -8.124  -3.967   7.466
   76   HD22  LEU  13          HD21      LEU  13  -7.791  -4.485   5.813
   77   HD23  LEU  13          HD22      LEU  13  -6.520  -4.562   7.033
   78    H    TYR  14           HN       TYR  14  -5.449  -6.463   3.382
   79    HA   TYR  14           HA       TYR  14  -4.410  -9.205   3.110
   80    HD1  TYR  14           HD1      TYR  14  -7.032  -7.545   1.154
   81    HD2  TYR  14           HD2      TYR  14  -4.009 -10.354   0.095
   82    HE1  TYR  14           HE1      TYR  14  -8.729  -8.957   0.072
   83    HE2  TYR  14           HE2      TYR  14  -5.701 -11.768  -0.989
   84    HH   TYR  14           HH       TYR  14  -8.835 -10.692  -1.677
   85    HB2  TYR  14           HB2      TYR  14  -4.617  -6.936   1.154
   86    HB3  TYR  14           HB1      TYR  14  -3.405  -8.194   0.931
   87    H    SER  15           HN       SER  15  -2.143  -9.504   3.013
   88    HA   SER  15           HA       SER  15  -0.421  -7.255   3.652
   89    HG   SER  15           HG       SER  15   1.214  -7.622   5.261
   90    HB2  SER  15           HB2      SER  15  -1.201  -7.948   5.864
   91    HB3  SER  15           HB1      SER  15  -0.722  -9.612   5.530
   92    H    VAL  16           HN       VAL  16   1.600  -7.506   2.879
   93    HA   VAL  16           HA       VAL  16   2.438 -10.192   2.009
   94    HB   VAL  16           HB       VAL  16   2.950  -7.675   0.420
   95   HG11  VAL  16          HG11      VAL  16   3.673  -9.212  -1.324
   96   HG12  VAL  16          HG12      VAL  16   3.332 -10.585  -0.272
   97   HG13  VAL  16          HG13      VAL  16   4.613  -9.448   0.148
   98   HG21  VAL  16          HG23      VAL  16   1.298  -8.542  -1.186
   99   HG22  VAL  16          HG21      VAL  16   0.574  -8.144   0.372
  100   HG23  VAL  16          HG22      VAL  16   0.889  -9.828  -0.048
  101    H    GLU  17           HN       GLU  17   4.661 -10.610   2.098
  102    HA   GLU  17           HA       GLU  17   6.144  -8.763   3.820
  103    HB2  GLU  17           HB2      GLU  17   6.622 -11.668   3.143
  104    HB3  GLU  17           HB1      GLU  17   7.681 -10.704   4.162
  105    HG2  GLU  17           HG2      GLU  17   6.313 -11.954   5.614
  106    HG3  GLU  17           HG1      GLU  17   5.703 -10.300   5.656
  107    H    LEU  18           HN       LEU  18   7.562  -7.445   2.936
  108    HA   LEU  18           HA       LEU  18   8.895  -8.257   0.437
  109    HG   LEU  18           HG       LEU  18   7.178  -5.352  -1.006
  110    HB2  LEU  18           HB2      LEU  18   7.723  -5.676   1.322
  111    HB3  LEU  18           HB1      LEU  18   9.200  -5.599   0.382
  112   HD11  LEU  18          HD11      LEU  18   7.796  -6.944  -2.727
  113   HD12  LEU  18          HD12      LEU  18   8.693  -7.901  -1.548
  114   HD13  LEU  18          HD13      LEU  18   9.238  -6.275  -1.961
  115   HD21  LEU  18          HD23      LEU  18   5.713  -6.807   0.356
  116   HD22  LEU  18          HD21      LEU  18   6.594  -8.211  -0.246
  117   HD23  LEU  18          HD22      LEU  18   5.675  -7.200  -1.364
  118    H    PHE  19           HN       PHE  19  11.046  -7.141   0.116
  119    HA   PHE  19           HA       PHE  19  12.459  -6.292   2.465
  120    HD1  PHE  19           HD2      PHE  19  11.082  -9.895   1.321
  121    HD2  PHE  19           HD1      PHE  19  15.156  -9.031   0.443
  122    HE1  PHE  19           HE2      PHE  19  11.070 -11.629  -0.425
  123    HE2  PHE  19           HE1      PHE  19  15.149 -10.762  -1.305
  124    HZ   PHE  19           HZ       PHE  19  13.109 -12.069  -1.735
  125    HB2  PHE  19           HB2      PHE  19  14.148  -8.130   2.373
  126    HB3  PHE  19           HB1      PHE  19  12.556  -8.656   2.906
  127    H    ARG  20           HN       ARG  20  14.043  -4.926   1.902
  128    HA   ARG  20           HA       ARG  20  14.927  -4.991  -0.910
  129    HE   ARG  20           HE       ARG  20  15.702  -0.419   0.646
  130    HB2  ARG  20           HB2      ARG  20  13.658  -2.958  -0.259
  131    HB3  ARG  20           HB1      ARG  20  14.882  -2.612   0.954
  132    HG2  ARG  20           HG2      ARG  20  16.545  -2.252  -0.712
  133    HG3  ARG  20           HG1      ARG  20  15.479  -2.853  -1.983
  134    HD2  ARG  20           HD2      ARG  20  15.517  -0.466  -2.109
  135    HD3  ARG  20           HD1      ARG  20  13.941  -0.957  -1.496
  136   HH11  ARG  20          HH11      ARG  20  13.817   1.173  -1.814
  137   HH12  ARG  20          HH12      ARG  20  13.642   2.641  -0.912
  138   HH21  ARG  20          HH21      ARG  20  15.483   1.512   1.836
  139   HH22  ARG  20          HH22      ARG  20  14.590   2.832   1.162
  140    H    GLU  21           HN       GLU  21  16.732  -6.227  -0.807
  141    HA   GLU  21           HA       GLU  21  18.761  -5.619   1.207
  142    HB2  GLU  21           HB2      GLU  21  18.700  -7.821  -0.865
  143    HB3  GLU  21           HB1      GLU  21  19.864  -7.663   0.443
  144    HG2  GLU  21           HG2      GLU  21  16.911  -8.160   0.733
  145    HG3  GLU  21           HG1      GLU  21  18.201  -9.336   0.972
  146    H    LYS  22           HN       LYS  22  18.028  -5.069  -2.089
  147    HA   LYS  22           HA       LYS  22  20.756  -4.556  -2.899
  148    HB2  LYS  22           HB2      LYS  22  18.140  -4.048  -4.329
  149    HB3  LYS  22           HB1      LYS  22  19.735  -3.855  -5.041
  150    HG2  LYS  22           HG2      LYS  22  18.625  -6.444  -3.976
  151    HG3  LYS  22           HG1      LYS  22  18.644  -5.966  -5.676
  152    HD2  LYS  22           HD2      LYS  22  21.099  -5.829  -5.592
  153    HD3  LYS  22           HD1      LYS  22  21.058  -6.349  -3.905
  154    HE2  LYS  22           HE2      LYS  22  20.015  -8.455  -4.585
  155    HE3  LYS  22           HE1      LYS  22  20.060  -7.935  -6.269
  156    HZ1  LYS  22           HZ3      LYS  22  21.899  -9.406  -5.757
  157    HZ2  LYS  22           HZ1      LYS  22  22.427  -8.371  -4.528
  158    HZ3  LYS  22           HZ2      LYS  22  22.475  -7.862  -6.139
  159    H    ASP  23           HN       ASP  23  21.405  -2.469  -3.805
  160    HA   ASP  23           HA       ASP  23  20.472  -0.293  -2.095
  161    HB2  ASP  23           HB2      ASP  23  22.895  -0.475  -3.899
  162    HB3  ASP  23           HB1      ASP  23  22.523   0.870  -2.823
  163    H    THR  24           HN       THR  24  18.708  -1.037  -4.133
  164    HA   THR  24           HA       THR  24  19.010   0.606  -6.443
  165    HB   THR  24           HB       THR  24  16.667   0.044  -6.928
  166    HG1  THR  24           HG1      THR  24  16.370  -0.110  -4.386
  167   HG21  THR  24          HG23      THR  24  18.431  -1.564  -7.506
  168   HG22  THR  24          HG21      THR  24  16.927  -2.382  -7.085
  169   HG23  THR  24          HG22      THR  24  18.253  -2.324  -5.924
  170    H    SER  25           HN       SER  25  18.124   1.251  -3.250
  171    HA   SER  25           HA       SER  25  17.298   3.065  -2.162
  172    HG   SER  25           HG       SER  25  19.717   4.979  -2.795
  173    HB2  SER  25           HB2      SER  25  18.010   4.488  -4.738
  174    HB3  SER  25           HB1      SER  25  17.683   5.266  -3.190
  175    H    SER  26           HN       SER  26  15.567   1.463  -4.109
  176    HA   SER  26           HA       SER  26  13.216   3.113  -3.787
  177    HG   SER  26           HG       SER  26  13.956   4.556  -6.885
  178    HB2  SER  26           HB2      SER  26  14.092   2.224  -6.546
  179    HB3  SER  26           HB1      SER  26  12.545   2.977  -6.158
  180    H    LEU  27           HN       LEU  27  11.237   1.947  -4.101
  181    HA   LEU  27           HA       LEU  27  11.603  -0.973  -3.967
  182    HG   LEU  27           HG       LEU  27  11.781   0.293  -1.378
  183    HB2  LEU  27           HB2      LEU  27   9.665   0.854  -2.574
  184    HB3  LEU  27           HB1      LEU  27   9.344  -0.862  -2.737
  185   HD11  LEU  27          HD11      LEU  27  10.631  -0.568   0.692
  186   HD12  LEU  27          HD12      LEU  27   9.163  -0.702  -0.277
  187   HD13  LEU  27          HD13      LEU  27   9.920   0.872  -0.036
  188   HD21  LEU  27          HD23      LEU  27  12.147  -1.928  -2.306
  189   HD22  LEU  27          HD21      LEU  27  10.695  -2.519  -1.498
  190   HD23  LEU  27          HD22      LEU  27  12.080  -1.989  -0.545
  191    H    GLY  28           HN       GLY  28   9.956   1.643  -5.523
  192    HA2  GLY  28           HA2      GLY  28   9.073   1.372  -7.727
  193    HA3  GLY  28           HA1      GLY  28   8.710  -0.302  -7.342
  194    H    ILE  29           HN       ILE  29   7.622   0.757  -4.669
  195    HA   ILE  29           HA       ILE  29   4.906   0.755  -5.379
  196    HB   ILE  29           HB       ILE  29   6.134   1.828  -2.836
  197   HG12  ILE  29          HG12      ILE  29   5.097  -0.952  -3.431
  198   HG13  ILE  29          HG11      ILE  29   6.802  -0.512  -3.413
  199   HG21  ILE  29          HG21      ILE  29   3.811   2.505  -3.135
  200   HG22  ILE  29          HG22      ILE  29   3.956   1.320  -1.836
  201   HG23  ILE  29          HG23      ILE  29   3.349   0.826  -3.416
  202   HD11  ILE  29          HD13      ILE  29   4.907  -0.391  -1.080
  203   HD12  ILE  29          HD11      ILE  29   6.600   0.102  -1.049
  204   HD13  ILE  29          HD12      ILE  29   6.178  -1.584  -1.344
  205    H    SER  30           HN       SER  30   3.948   2.280  -6.559
  206    HA   SER  30           HA       SER  30   4.625   5.099  -6.025
  207    HG   SER  30           HG       SER  30   3.063   5.833  -9.098
  208    HB2  SER  30           HB2      SER  30   5.152   4.395  -8.317
  209    HB3  SER  30           HB1      SER  30   3.486   3.862  -8.544
  210    H    ILE  31           HN       ILE  31   3.170   5.900  -4.655
  211    HA   ILE  31           HA       ILE  31   0.403   5.029  -4.728
  212    HB   ILE  31           HB       ILE  31   0.101   6.491  -2.768
  213   HG12  ILE  31          HG12      ILE  31   3.061   7.070  -3.041
  214   HG13  ILE  31          HG11      ILE  31   1.785   8.207  -3.463
  215   HG21  ILE  31          HG21      ILE  31   1.512   5.220  -1.233
  216   HG22  ILE  31          HG22      ILE  31   2.515   4.692  -2.583
  217   HG23  ILE  31          HG23      ILE  31   0.832   4.177  -2.481
  218   HD11  ILE  31          HD13      ILE  31   1.023   8.188  -1.133
  219   HD12  ILE  31          HD11      ILE  31   2.697   8.717  -1.286
  220   HD13  ILE  31          HD12      ILE  31   2.337   7.084  -0.726
  221    H    SER  32           HN       SER  32  -1.150   7.071  -4.200
  222    HA   SER  32           HA       SER  32  -0.592   9.352  -5.882
  223    HG   SER  32           HG       SER  32  -3.347   8.921  -8.159
  224    HB2  SER  32           HB2      SER  32  -1.361   7.714  -7.542
  225    HB3  SER  32           HB1      SER  32  -2.832   7.447  -6.605
  226    H    GLY  33           HN       GLY  33  -1.939  11.103  -5.481
  227    HA2  GLY  33           HA2      GLY  33  -3.368  10.986  -2.972
  228    HA3  GLY  33           HA1      GLY  33  -3.092  12.419  -3.952
  229    H    MET  34           HN       MET  34  -5.501  10.874  -2.657
  230    HA   MET  34           HA       MET  34  -7.262  10.119  -4.684
  231    HB2  MET  34           HB2      MET  34  -7.592   9.693  -2.253
  232    HB3  MET  34           HB1      MET  34  -7.986  11.394  -2.041
  233    HG2  MET  34           HG2      MET  34  -9.927  11.169  -3.440
  234    HG3  MET  34           HG1      MET  34  -9.501   9.502  -3.822
  235    HE1  MET  34           HE3      MET  34 -12.667   8.969  -1.635
  236    HE2  MET  34           HE1      MET  34 -11.876   8.662  -3.181
  237    HE3  MET  34           HE2      MET  34 -12.408  10.293  -2.770
  238    H    ARG  35           HN       ARG  35  -9.009  11.200  -5.679
  239    HA   ARG  35           HA       ARG  35  -9.183  14.086  -5.460
  240    HE   ARG  35           HE       ARG  35  -7.964  11.026 -10.482
  241    HB2  ARG  35           HB2      ARG  35  -8.860  14.443  -7.884
  242    HB3  ARG  35           HB1      ARG  35  -7.405  13.861  -7.089
  243    HG2  ARG  35           HG2      ARG  35  -7.999  11.562  -7.877
  244    HG3  ARG  35           HG1      ARG  35  -9.291  12.296  -8.829
  245    HD2  ARG  35           HD2      ARG  35  -7.621  13.686  -9.984
  246    HD3  ARG  35           HD1      ARG  35  -6.345  12.897  -9.058
  247   HH11  ARG  35          HH11      ARG  35  -5.315  13.267 -10.801
  248   HH12  ARG  35          HH12      ARG  35  -4.609  12.440 -12.148
  249   HH21  ARG  35          HH21      ARG  35  -7.042   9.933 -12.257
  250   HH22  ARG  35          HH22      ARG  35  -5.591  10.547 -12.976
  251    H    ASP  36           HN       ASP  36 -11.021  14.979  -6.588
  252    HA   ASP  36           HA       ASP  36 -12.947  13.202  -7.784
  253    HB2  ASP  36           HB2      ASP  36 -13.251  12.872  -5.307
  254    HB3  ASP  36           HB1      ASP  36 -13.697  14.573  -5.195
  255    H    GLN  37           HN       GLN  37 -14.903  14.387  -8.502
  256    HA   GLN  37           HA       GLN  37 -14.155  17.089  -9.315
  257    HB2  GLN  37           HB2      GLN  37 -16.418  15.315 -10.245
  258    HB3  GLN  37           HB1      GLN  37 -16.014  16.887 -10.922
  259    HG2  GLN  37           HG2      GLN  37 -14.266  14.438 -10.954
  260    HG3  GLN  37           HG1      GLN  37 -15.169  15.097 -12.317
  261   HE21  GLN  37          HE21      GLN  37 -14.466  16.996 -13.294
  262   HE22  GLN  37          HE22      GLN  37 -12.871  17.614 -13.055
  263    H    SER  38           HN       SER  38 -15.169  16.399  -6.583
  264    HA   SER  38           HA       SER  38 -16.899  18.647  -6.292
  265    HG   SER  38           HG       SER  38 -18.724  15.075  -6.211
  266    HB2  SER  38           HB2      SER  38 -18.865  17.478  -5.412
  267    HB3  SER  38           HB1      SER  38 -18.556  17.001  -7.081
  268    H    THR  39           HN       THR  39 -15.695  19.467  -4.686
  269    HA   THR  39           HA       THR  39 -15.083  17.756  -2.373
  270    HB   THR  39           HB       THR  39 -13.410  19.455  -1.750
  271    HG1  THR  39           HG1      THR  39 -12.954  21.008  -3.568
  272   HG21  THR  39          HG23      THR  39 -13.140  18.493  -4.601
  273   HG22  THR  39          HG21      THR  39 -12.731  17.569  -3.156
  274   HG23  THR  39          HG22      THR  39 -11.818  19.023  -3.562
  275    H    THR  40           HN       THR  40 -15.869  18.211  -0.391
  276    HA   THR  40           HA       THR  40 -16.951  20.794   0.274
  277    HB   THR  40           HB       THR  40 -18.847  19.850  -0.963
  278    HG1  THR  40           HG1      THR  40 -20.251  20.512   0.533
  279   HG21  THR  40          HG23      THR  40 -20.004  17.860  -0.172
  280   HG22  THR  40          HG21      THR  40 -18.805  17.647   1.105
  281   HG23  THR  40          HG22      THR  40 -18.335  17.468  -0.586
  282    H    GLY  41           HN       GLY  41 -15.050  18.574   1.166
  283    HA2  GLY  41           HA2      GLY  41 -15.408  18.967   3.966
  284    HA3  GLY  41           HA1      GLY  41 -15.871  17.337   3.498
  285    H    GLU  42           HN       GLU  42 -13.636  18.044   1.302
  286    HA   GLU  42           HA       GLU  42 -11.487  17.402   0.954
  287    HB2  GLU  42           HB2      GLU  42 -11.162  18.381   3.794
  288    HB3  GLU  42           HB1      GLU  42  -9.840  18.040   2.686
  289    HG2  GLU  42           HG2      GLU  42 -10.684  19.784   1.175
  290    HG3  GLU  42           HG1      GLU  42 -11.960  20.148   2.337
  291    H    ALA  43           HN       ALA  43 -11.858  15.205   0.713
  292    HA   ALA  43           HA       ALA  43 -11.034  13.562   3.012
  293    HB1  ALA  43           HB3      ALA  43 -12.640  11.847   2.380
  294    HB2  ALA  43           HB1      ALA  43 -13.213  12.852   1.050
  295    HB3  ALA  43           HB2      ALA  43 -13.461  13.372   2.716
  296    H    THR  44           HN       THR  44  -8.939  13.348   2.239
  297    HA   THR  44           HA       THR  44  -8.670  11.840  -0.281
  298    HB   THR  44           HB       THR  44  -6.421  12.793  -0.532
  299    HG1  THR  44           HG1      THR  44  -5.764  13.336   1.488
  300   HG21  THR  44          HG23      THR  44  -8.524  14.927  -0.146
  301   HG22  THR  44          HG21      THR  44  -8.337  13.926  -1.586
  302   HG23  THR  44          HG22      THR  44  -7.069  15.064  -1.132
  303    H    GLY  45           HN       GLY  45  -6.965  10.255  -0.362
  304    HA2  GLY  45           HA2      GLY  45  -5.824   9.451   2.209
  305    HA3  GLY  45           HA1      GLY  45  -6.879   8.302   1.402
  306    H    ILE  46           HN       ILE  46  -4.448   7.419   1.916
  307    HA   ILE  46           HA       ILE  46  -2.801   7.818  -0.477
  308    HB   ILE  46           HB       ILE  46  -2.131   6.349   2.077
  309   HG12  ILE  46          HG12      ILE  46  -2.404   8.743   2.485
  310   HG13  ILE  46          HG11      ILE  46  -0.704   8.298   2.581
  311   HG21  ILE  46          HG21      ILE  46  -0.865   5.487   0.217
  312   HG22  ILE  46          HG22      ILE  46   0.190   6.462   1.240
  313   HG23  ILE  46          HG23      ILE  46  -0.418   7.119  -0.280
  314   HD11  ILE  46          HD13      ILE  46  -0.343   9.182   0.338
  315   HD12  ILE  46          HD11      ILE  46  -1.004  10.407   1.421
  316   HD13  ILE  46          HD12      ILE  46  -2.049   9.621   0.237
  317    H    TYR  47           HN       TYR  47  -2.657   6.312  -2.027
  318    HA   TYR  47           HA       TYR  47  -3.119   3.519  -1.480
  319    HD1  TYR  47           HD1      TYR  47  -5.470   6.842  -2.332
  320    HD2  TYR  47           HD2      TYR  47  -4.989   3.818  -5.287
  321    HE1  TYR  47           HE1      TYR  47  -6.106   8.453  -4.078
  322    HE2  TYR  47           HE2      TYR  47  -5.622   5.422  -7.039
  323    HH   TYR  47           HH       TYR  47  -6.865   7.514  -7.260
  324    HB2  TYR  47           HB2      TYR  47  -4.995   3.232  -2.992
  325    HB3  TYR  47           HB1      TYR  47  -5.423   4.404  -1.750
  326    H    VAL  48           HN       VAL  48  -2.217   2.182  -3.009
  327    HA   VAL  48           HA       VAL  48  -0.377   3.405  -4.847
  328    HB   VAL  48           HB       VAL  48  -1.027   0.490  -4.379
  329   HG11  VAL  48          HG11      VAL  48   1.100   0.054  -5.566
  330   HG12  VAL  48          HG12      VAL  48   1.187   1.765  -5.984
  331   HG13  VAL  48          HG13      VAL  48  -0.130   0.771  -6.605
  332   HG21  VAL  48          HG23      VAL  48   1.332   2.131  -3.464
  333   HG22  VAL  48          HG21      VAL  48   1.031   0.430  -3.110
  334   HG23  VAL  48          HG22      VAL  48  -0.035   1.670  -2.451
  335    H    LYS  49           HN       LYS  49  -0.677   3.812  -6.933
  336    HA   LYS  49           HA       LYS  49  -3.029   2.630  -8.255
  337    HB2  LYS  49           HB2      LYS  49  -3.153   5.083  -7.898
  338    HB3  LYS  49           HB1      LYS  49  -1.693   5.273  -8.858
  339    HG2  LYS  49           HG2      LYS  49  -2.849   4.345 -10.803
  340    HG3  LYS  49           HG1      LYS  49  -4.314   4.159  -9.838
  341    HD2  LYS  49           HD2      LYS  49  -4.544   6.171 -11.099
  342    HD3  LYS  49           HD1      LYS  49  -4.242   6.633  -9.423
  343    HE2  LYS  49           HE2      LYS  49  -2.931   8.023 -10.904
  344    HE3  LYS  49           HE1      LYS  49  -1.865   6.972  -9.971
  345    HZ1  LYS  49           HZ3      LYS  49  -1.185   7.041 -12.273
  346    HZ2  LYS  49           HZ1      LYS  49  -2.720   6.539 -12.783
  347    HZ3  LYS  49           HZ2      LYS  49  -1.738   5.489 -11.891
  348    H    SER  50           HN       SER  50   0.393   3.107  -8.382
  349    HA   SER  50           HA       SER  50   0.508   1.431 -10.765
  350    HG   SER  50           HG       SER  50   1.390   4.811  -9.888
  351    HB2  SER  50           HB2      SER  50   2.159   2.918 -11.856
  352    HB3  SER  50           HB1      SER  50   0.582   3.687 -11.681
  353    H    LEU  51           HN       LEU  51   2.678   0.600 -11.201
  354    HA   LEU  51           HA       LEU  51   4.451   0.605  -8.857
  355    HG   LEU  51           HG       LEU  51   1.930  -1.096  -8.653
  356    HB2  LEU  51           HB2      LEU  51   3.552  -1.827 -10.407
  357    HB3  LEU  51           HB1      LEU  51   4.809  -1.829  -9.185
  358   HD11  LEU  51          HD11      LEU  51   3.404  -3.680  -8.155
  359   HD12  LEU  51          HD12      LEU  51   2.080  -3.428  -9.294
  360   HD13  LEU  51          HD13      LEU  51   1.789  -3.293  -7.559
  361   HD21  LEU  51          HD23      LEU  51   3.522  -0.082  -7.105
  362   HD22  LEU  51          HD21      LEU  51   4.235  -1.665  -6.792
  363   HD23  LEU  51          HD22      LEU  51   2.572  -1.335  -6.307
  364    H    ILE  52           HN       ILE  52   6.657   0.068  -9.323
  365    HA   ILE  52           HA       ILE  52   7.407   0.780 -12.058
  366    HB   ILE  52           HB       ILE  52   9.097   0.633  -9.560
  367   HG12  ILE  52          HG12      ILE  52   7.464   2.472  -9.530
  368   HG13  ILE  52          HG11      ILE  52   9.108   3.080  -9.679
  369   HG21  ILE  52          HG21      ILE  52   9.786   1.549 -12.347
  370   HG22  ILE  52          HG22      ILE  52  10.458   0.165 -11.486
  371   HG23  ILE  52          HG23      ILE  52  10.801   1.801 -10.926
  372   HD11  ILE  52          HD13      ILE  52   8.771   3.429 -12.064
  373   HD12  ILE  52          HD11      ILE  52   7.564   4.295 -11.113
  374   HD13  ILE  52          HD12      ILE  52   7.131   2.794 -11.930
  375    HA   PRO  53           HA       PRO  53   8.142  -3.625 -12.723
  376    HB2  PRO  53           HB2      PRO  53   9.194  -3.307 -15.242
  377    HB3  PRO  53           HB1      PRO  53   7.467  -3.409 -14.893
  378    HG2  PRO  53           HG2      PRO  53   9.169  -0.994 -15.352
  379    HG3  PRO  53           HG1      PRO  53   7.531  -1.338 -15.940
  380    HD2  PRO  53           HD2      PRO  53   7.962   0.297 -13.855
  381    HD3  PRO  53           HD1      PRO  53   6.553  -0.784 -13.912
  382    H    GLY  54           HN       GLY  54   9.885  -4.839 -12.269
  383    HA2  GLY  54           HA2      GLY  54  12.178  -5.438 -12.437
  384    HA3  GLY  54           HA1      GLY  54  12.562  -3.760 -12.793
  385    H    SER  55           HN       SER  55  10.747  -2.951 -10.509
  386    HA   SER  55           HA       SER  55  12.785  -2.846  -8.512
  387    HG   SER  55           HG       SER  55  11.573  -0.947  -9.847
  388    HB2  SER  55           HB2      SER  55   9.877  -2.014  -8.406
  389    HB3  SER  55           HB1      SER  55  11.080  -1.640  -7.172
  390    H    ALA  56           HN       ALA  56  12.160  -3.352  -6.158
  391    HA   ALA  56           HA       ALA  56  11.897  -6.128  -5.888
  392    HB1  ALA  56           HB3      ALA  56  11.469  -4.045  -3.752
  393    HB2  ALA  56           HB1      ALA  56  13.039  -4.665  -4.263
  394    HB3  ALA  56           HB2      ALA  56  11.868  -5.746  -3.506
  395    H    ALA  57           HN       ALA  57   9.580  -3.574  -4.965
  396    HA   ALA  57           HA       ALA  57   7.496  -5.164  -4.104
  397    HB1  ALA  57           HB3      ALA  57   7.275  -2.558  -5.608
  398    HB2  ALA  57           HB1      ALA  57   7.524  -2.734  -3.870
  399    HB3  ALA  57           HB2      ALA  57   6.021  -3.289  -4.607
  400    H    ALA  58           HN       ALA  58   8.330  -4.227  -7.405
  401    HA   ALA  58           HA       ALA  58   6.011  -5.305  -8.632
  402    HB1  ALA  58           HB3      ALA  58   7.237  -5.046 -10.726
  403    HB2  ALA  58           HB1      ALA  58   8.728  -4.767  -9.828
  404    HB3  ALA  58           HB2      ALA  58   7.400  -3.612  -9.714
  405    H    LEU  59           HN       LEU  59   9.305  -6.573  -8.196
  406    HA   LEU  59           HA       LEU  59   8.905  -8.999  -9.562
  407    HG   LEU  59           HG       LEU  59  11.179  -6.987  -9.414
  408    HB2  LEU  59           HB2      LEU  59  10.832  -8.325  -7.338
  409    HB3  LEU  59           HB1      LEU  59  10.904  -9.783  -8.309
  410   HD11  LEU  59          HD11      LEU  59  13.299  -9.046  -8.819
  411   HD12  LEU  59          HD12      LEU  59  13.046  -7.536  -7.944
  412   HD13  LEU  59          HD13      LEU  59  13.554  -7.503  -9.632
  413   HD21  LEU  59          HD23      LEU  59  10.320  -8.592 -11.031
  414   HD22  LEU  59          HD21      LEU  59  11.649  -9.692 -10.663
  415   HD23  LEU  59          HD22      LEU  59  11.979  -8.135 -11.423
  416    H    ASP  60           HN       ASP  60   7.852  -7.936  -6.484
  417    HA   ASP  60           HA       ASP  60   7.714 -10.382  -5.106
  418    HB2  ASP  60           HB2      ASP  60   7.437  -8.164  -4.035
  419    HB3  ASP  60           HB1      ASP  60   5.878  -7.992  -4.836
  420    H    GLY  61           HN       GLY  61   5.243  -8.674  -7.028
  421    HA2  GLY  61           HA2      GLY  61   3.765  -9.767  -8.523
  422    HA3  GLY  61           HA1      GLY  61   4.049 -11.272  -7.665
  423    H    ARG  62           HN       ARG  62   3.487 -10.614  -5.075
  424    HA   ARG  62           HA       ARG  62   0.695 -10.770  -4.995
  425    HE   ARG  62           HE       ARG  62  -0.021 -12.034  -1.957
  426    HB2  ARG  62           HB2      ARG  62   2.589  -9.958  -2.784
  427    HB3  ARG  62           HB1      ARG  62   0.924 -10.473  -2.565
  428    HG2  ARG  62           HG2      ARG  62   3.079 -12.190  -3.771
  429    HG3  ARG  62           HG1      ARG  62   2.602 -12.229  -2.073
  430    HD2  ARG  62           HD2      ARG  62   0.838 -12.834  -4.443
  431    HD3  ARG  62           HD1      ARG  62   1.504 -14.010  -3.312
  432   HH11  ARG  62          HH11      ARG  62  -0.323 -14.894  -3.925
  433   HH12  ARG  62          HH12      ARG  62  -1.866 -15.335  -3.273
  434   HH21  ARG  62          HH21      ARG  62  -2.052 -12.606  -1.095
  435   HH22  ARG  62          HH22      ARG  62  -2.851 -14.032  -1.668
  436    H    ILE  63           HN       ILE  63   2.836  -8.018  -4.928
  437    HA   ILE  63           HA       ILE  63   0.857  -6.168  -3.982
  438    HB   ILE  63           HB       ILE  63   3.475  -5.596  -5.380
  439   HG12  ILE  63          HG12      ILE  63   2.830  -5.644  -2.421
  440   HG13  ILE  63          HG11      ILE  63   3.698  -6.914  -3.277
  441   HG21  ILE  63          HG21      ILE  63   1.928  -3.712  -5.456
  442   HG22  ILE  63          HG22      ILE  63   3.274  -3.375  -4.369
  443   HG23  ILE  63          HG23      ILE  63   1.699  -3.816  -3.712
  444   HD11  ILE  63          HD13      ILE  63   5.480  -5.342  -3.807
  445   HD12  ILE  63          HD11      ILE  63   5.216  -5.457  -2.068
  446   HD13  ILE  63          HD12      ILE  63   4.607  -4.063  -2.962
  447    H    GLU  64           HN       GLU  64  -0.850  -5.652  -5.163
  448    HA   GLU  64           HA       GLU  64  -0.662  -5.610  -8.079
  449    HB2  GLU  64           HB2      GLU  64  -2.529  -6.835  -7.004
  450    HB3  GLU  64           HB1      GLU  64  -3.079  -5.334  -6.276
  451    HG2  GLU  64           HG2      GLU  64  -3.471  -4.405  -8.510
  452    HG3  GLU  64           HG1      GLU  64  -2.947  -5.930  -9.224
  453    HA   PRO  65           HA       PRO  65  -0.419  -1.161  -8.067
  454    HB2  PRO  65           HB2      PRO  65  -1.050  -0.654 -10.641
  455    HB3  PRO  65           HB1      PRO  65   0.491  -1.383 -10.172
  456    HG2  PRO  65           HG2      PRO  65  -1.988  -2.703 -11.215
  457    HG3  PRO  65           HG1      PRO  65  -0.297  -2.985 -11.669
  458    HD2  PRO  65           HD2      PRO  65  -1.641  -4.595  -9.948
  459    HD3  PRO  65           HD1      PRO  65   0.107  -4.313  -9.834
  460    H    ASN  66           HN       ASN  66  -2.830  -2.145  -6.960
  461    HA   ASN  66           HA       ASN  66  -4.534   0.090  -7.374
  462    HB2  ASN  66           HB2      ASN  66  -5.167  -1.258  -9.357
  463    HB3  ASN  66           HB1      ASN  66  -5.598  -2.592  -8.293
  464   HD21  ASN  66          HD21      ASN  66  -6.471   0.562  -9.438
  465   HD22  ASN  66          HD22      ASN  66  -8.077   0.574  -8.805
  466    H    ASP  67           HN       ASP  67  -3.713  -0.144  -5.088
  467    HA   ASP  67           HA       ASP  67  -5.789  -1.439  -3.497
  468    HB2  ASP  67           HB2      ASP  67  -4.206  -2.512  -1.999
  469    HB3  ASP  67           HB1      ASP  67  -3.926  -3.078  -3.643
  470    H    LYS  68           HN       LYS  68  -5.497  -0.813  -1.108
  471    HA   LYS  68           HA       LYS  68  -4.601   1.989  -0.988
  472    HB2  LYS  68           HB2      LYS  68  -7.062   1.619  -0.799
  473    HB3  LYS  68           HB1      LYS  68  -6.768   0.680   0.659
  474    HG2  LYS  68           HG2      LYS  68  -5.846   2.626   1.763
  475    HG3  LYS  68           HG1      LYS  68  -6.043   3.577   0.290
  476    HD2  LYS  68           HD2      LYS  68  -8.479   3.189   0.404
  477    HD3  LYS  68           HD1      LYS  68  -8.246   2.325   1.926
  478    HE2  LYS  68           HE2      LYS  68  -7.314   4.336   2.936
  479    HE3  LYS  68           HE1      LYS  68  -7.502   5.200   1.410
  480    HZ1  LYS  68           HZ3      LYS  68  -9.305   5.717   2.913
  481    HZ2  LYS  68           HZ1      LYS  68  -9.704   4.079   3.059
  482    HZ3  LYS  68           HZ2      LYS  68  -9.901   4.869   1.577
  483    H    ILE  69           HN       ILE  69  -2.646   1.962  -0.043
  484    HA   ILE  69           HA       ILE  69  -1.686   0.073   1.777
  485    HB   ILE  69           HB       ILE  69  -0.821   2.956   1.498
  486   HG12  ILE  69          HG12      ILE  69  -0.732   1.734  -0.634
  487   HG13  ILE  69          HG11      ILE  69   0.884   2.097  -0.038
  488   HG21  ILE  69          HG21      ILE  69   0.010   1.986   3.549
  489   HG22  ILE  69          HG22      ILE  69   1.331   2.155   2.393
  490   HG23  ILE  69          HG23      ILE  69   0.602   0.574   2.674
  491   HD11  ILE  69          HD13      ILE  69  -0.512  -0.557   0.210
  492   HD12  ILE  69          HD11      ILE  69   1.126  -0.186   0.745
  493   HD13  ILE  69          HD12      ILE  69   0.730  -0.151  -0.973
  494    H    LEU  70           HN       LEU  70  -1.477   0.045   4.011
  495    HA   LEU  70           HA       LEU  70  -3.123   1.999   5.475
  496    HG   LEU  70           HG       LEU  70  -4.419  -0.531   4.165
  497    HB2  LEU  70           HB2      LEU  70  -2.869  -0.955   6.034
  498    HB3  LEU  70           HB1      LEU  70  -3.755   0.189   7.022
  499   HD11  LEU  70          HD11      LEU  70  -5.763  -1.280   6.758
  500   HD12  LEU  70          HD12      LEU  70  -4.875  -2.365   5.689
  501   HD13  LEU  70          HD13      LEU  70  -6.381  -1.627   5.143
  502   HD21  LEU  70          HD23      LEU  70  -5.040   1.759   4.674
  503   HD22  LEU  70          HD21      LEU  70  -5.851   1.233   6.150
  504   HD23  LEU  70          HD22      LEU  70  -6.480   0.744   4.577
  505    H    ARG  71           HN       ARG  71  -0.848  -0.638   6.287
  506    HA   ARG  71           HA       ARG  71   0.717   1.318   7.826
  507    HE   ARG  71           HE       ARG  71  -0.730  -2.384  10.270
  508    HB2  ARG  71           HB2      ARG  71   0.038  -1.464   8.790
  509    HB3  ARG  71           HB1      ARG  71   0.975  -0.253   9.656
  510    HG2  ARG  71           HG2      ARG  71  -1.034   1.191   9.721
  511    HG3  ARG  71           HG1      ARG  71  -1.952  -0.112   8.965
  512    HD2  ARG  71           HD2      ARG  71  -0.579  -0.164  11.648
  513    HD3  ARG  71           HD1      ARG  71  -2.314  -0.182  11.339
  514   HH11  ARG  71          HH11      ARG  71  -2.948  -1.205  12.686
  515   HH12  ARG  71          HH12      ARG  71  -3.438  -2.788  13.194
  516   HH21  ARG  71          HH21      ARG  71  -1.364  -4.471  10.936
  517   HH22  ARG  71          HH22      ARG  71  -2.535  -4.644  12.201
  518    H    VAL  72           HN       VAL  72   2.857   1.175   7.626
  519    HA   VAL  72           HA       VAL  72   3.946  -0.927   5.900
  520    HB   VAL  72           HB       VAL  72   5.438   1.509   6.862
  521   HG11  VAL  72          HG11      VAL  72   6.809  -0.159   5.801
  522   HG12  VAL  72          HG12      VAL  72   6.635   1.215   4.708
  523   HG13  VAL  72          HG13      VAL  72   5.701  -0.256   4.432
  524   HG21  VAL  72          HG23      VAL  72   3.358   2.317   5.904
  525   HG22  VAL  72          HG21      VAL  72   3.623   1.338   4.461
  526   HG23  VAL  72          HG22      VAL  72   4.711   2.676   4.830
  527    H    ASP  73           HN       ASP  73   6.310  -1.538   6.513
  528    HA   ASP  73           HA       ASP  73   6.356  -3.006   8.834
  529    HB2  ASP  73           HB2      ASP  73   7.955  -3.233   6.940
  530    HB3  ASP  73           HB1      ASP  73   8.773  -1.776   7.495
  531    H    ASP  74           HN       ASP  74   6.023  -2.259  10.827
  532    HA   ASP  74           HA       ASP  74   6.254  -1.106  12.768
  533    HB2  ASP  74           HB2      ASP  74   8.956  -0.425  11.597
  534    HB3  ASP  74           HB1      ASP  74   8.492  -0.173  13.277
  535    H    VAL  75           HN       VAL  75   5.485   0.317  10.102
  536    HA   VAL  75           HA       VAL  75   5.421   2.999  11.296
  537    HB   VAL  75           HB       VAL  75   5.962   2.486   8.366
  538   HG11  VAL  75          HG11      VAL  75   4.738   4.536   8.720
  539   HG12  VAL  75          HG12      VAL  75   6.407   4.916   8.298
  540   HG13  VAL  75          HG13      VAL  75   5.872   5.036   9.974
  541   HG21  VAL  75          HG23      VAL  75   7.889   1.881   9.764
  542   HG22  VAL  75          HG21      VAL  75   7.853   3.485  10.494
  543   HG23  VAL  75          HG22      VAL  75   8.213   3.305   8.776
  544    H    ASN  76           HN       ASN  76   3.668   4.347  10.504
  545    HA   ASN  76           HA       ASN  76   1.485   2.840   9.229
  546    HB2  ASN  76           HB2      ASN  76  -0.111   4.037  10.728
  547    HB3  ASN  76           HB1      ASN  76   0.961   2.936  11.586
  548   HD21  ASN  76          HD21      ASN  76   0.146   6.254  10.975
  549   HD22  ASN  76          HD22      ASN  76   1.071   6.931  12.267
  550    H    VAL  77           HN       VAL  77   0.583   3.842   7.530
  551    HA   VAL  77           HA       VAL  77   1.333   6.648   7.063
  552    HB   VAL  77           HB       VAL  77   0.874   6.250   4.697
  553   HG11  VAL  77          HG11      VAL  77   3.123   5.859   5.458
  554   HG12  VAL  77          HG12      VAL  77   2.708   4.646   4.248
  555   HG13  VAL  77          HG13      VAL  77   2.709   4.220   5.960
  556   HG21  VAL  77          HG23      VAL  77   0.368   4.017   3.861
  557   HG22  VAL  77          HG21      VAL  77  -0.897   4.576   4.955
  558   HG23  VAL  77          HG22      VAL  77   0.297   3.403   5.513
  559    H    GLN  78           HN       GLN  78  -0.952   5.633   8.711
  560    HA   GLN  78           HA       GLN  78  -3.271   6.487   7.172
  561    HB2  GLN  78           HB2      GLN  78  -3.039   5.482  10.015
  562    HB3  GLN  78           HB1      GLN  78  -4.552   5.860   9.203
  563    HG2  GLN  78           HG2      GLN  78  -2.593   3.713   8.422
  564    HG3  GLN  78           HG1      GLN  78  -4.158   3.478   9.199
  565   HE21  GLN  78          HE21      GLN  78  -2.504   4.265   6.252
  566   HE22  GLN  78          HE22      GLN  78  -3.865   4.099   5.202
  567    H    GLY  79           HN       GLY  79  -1.219   8.432   7.736
  568    HA2  GLY  79           HA2      GLY  79  -2.728  10.648   8.397
  569    HA3  GLY  79           HA1      GLY  79  -2.019  10.098   9.907
  570    H    MET  80           HN       MET  80  -0.268   9.599   6.956
  571    HA   MET  80           HA       MET  80   1.525  11.824   7.682
  572    HB2  MET  80           HB2      MET  80   2.303   9.195   6.408
  573    HB3  MET  80           HB1      MET  80   3.397  10.494   6.863
  574    HG2  MET  80           HG2      MET  80   2.579  10.161   9.236
  575    HG3  MET  80           HG1      MET  80   1.826   8.675   8.660
  576    HE1  MET  80           HE3      MET  80   4.083   7.905   6.401
  577    HE2  MET  80           HE1      MET  80   3.262   6.728   7.426
  578    HE3  MET  80           HE2      MET  80   5.024   6.740   7.332
  579    H    ALA  81           HN       ALA  81   2.269  13.144   6.071
  580    HA   ALA  81           HA       ALA  81   0.707  13.486   3.781
  581    HB1  ALA  81           HB3      ALA  81   2.037  15.274   4.815
  582    HB2  ALA  81           HB1      ALA  81   2.349  15.129   3.085
  583    HB3  ALA  81           HB2      ALA  81   3.512  14.491   4.248
  584    H    GLN  82           HN       GLN  82   1.304  13.321   1.534
  585    HA   GLN  82           HA       GLN  82   2.054  10.807   0.708
  586    HB2  GLN  82           HB2      GLN  82   0.883  12.426  -0.718
  587    HB3  GLN  82           HB1      GLN  82   2.348  13.392  -0.833
  588    HG2  GLN  82           HG2      GLN  82   3.475  11.517  -1.949
  589    HG3  GLN  82           HG1      GLN  82   1.977  10.591  -1.871
  590   HE21  GLN  82          HE21      GLN  82   0.239  11.191  -3.173
  591   HE22  GLN  82          HE22      GLN  82   0.436  12.225  -4.542
  592    H    SER  83           HN       SER  83   4.089  13.730   0.518
  593    HA   SER  83           HA       SER  83   6.421  12.535  -0.371
  594    HG   SER  83           HG       SER  83   6.774  15.397   2.280
  595    HB2  SER  83           HB2      SER  83   7.595  14.489   0.587
  596    HB3  SER  83           HB1      SER  83   6.135  14.958  -0.283
  597    H    ASP  84           HN       ASP  84   5.200  12.852   2.925
  598    HA   ASP  84           HA       ASP  84   7.497  11.993   4.286
  599    HB2  ASP  84           HB2      ASP  84   5.563  13.062   5.390
  600    HB3  ASP  84           HB1      ASP  84   4.605  11.616   5.087
  601    H    VAL  85           HN       VAL  85   4.736  10.166   3.017
  602    HA   VAL  85           HA       VAL  85   5.443   7.648   4.004
  603    HB   VAL  85           HB       VAL  85   4.008   8.238   1.410
  604   HG11  VAL  85          HG11      VAL  85   4.023   5.789   3.168
  605   HG12  VAL  85          HG12      VAL  85   4.722   5.930   1.554
  606   HG13  VAL  85          HG13      VAL  85   2.975   6.033   1.771
  607   HG21  VAL  85          HG23      VAL  85   2.906   7.876   4.195
  608   HG22  VAL  85          HG21      VAL  85   1.948   8.037   2.722
  609   HG23  VAL  85          HG22      VAL  85   2.945   9.381   3.277
  610    H    VAL  86           HN       VAL  86   6.367   9.300   1.017
  611    HA   VAL  86           HA       VAL  86   7.724   7.163  -0.199
  612    HB   VAL  86           HB       VAL  86   8.305  10.116  -0.472
  613   HG11  VAL  86          HG11      VAL  86   9.212   9.486  -2.677
  614   HG12  VAL  86          HG12      VAL  86   8.983   7.787  -2.264
  615   HG13  VAL  86          HG13      VAL  86  10.119   8.772  -1.343
  616   HG21  VAL  86          HG23      VAL  86   6.452   8.331  -2.046
  617   HG22  VAL  86          HG21      VAL  86   6.837  10.007  -2.439
  618   HG23  VAL  86          HG22      VAL  86   5.974   9.627  -0.948
  619    H    GLU  87           HN       GLU  87   8.790   9.626   2.092
  620    HA   GLU  87           HA       GLU  87  11.537   9.110   2.008
  621    HB2  GLU  87           HB2      GLU  87   9.814  10.098   4.286
  622    HB3  GLU  87           HB1      GLU  87  11.571  10.110   4.302
  623    HG2  GLU  87           HG2      GLU  87  11.591  11.613   2.387
  624    HG3  GLU  87           HG1      GLU  87   9.828  11.585   2.341
  625    H    VAL  88           HN       VAL  88   8.986   7.704   4.030
  626    HA   VAL  88           HA       VAL  88  10.564   6.091   5.663
  627    HB   VAL  88           HB       VAL  88   7.763   5.645   4.628
  628   HG11  VAL  88          HG11      VAL  88   9.227   4.143   6.798
  629   HG12  VAL  88          HG12      VAL  88   8.718   3.493   5.238
  630   HG13  VAL  88          HG13      VAL  88   7.510   3.989   6.425
  631   HG21  VAL  88          HG23      VAL  88   7.104   6.380   6.870
  632   HG22  VAL  88          HG21      VAL  88   8.041   7.617   6.031
  633   HG23  VAL  88          HG22      VAL  88   8.800   6.633   7.283
  634    H    LEU  89           HN       LEU  89   8.921   5.211   2.632
  635    HA   LEU  89           HA       LEU  89   9.825   2.597   2.445
  636    HG   LEU  89           HG       LEU  89   7.277   4.159   1.715
  637    HB2  LEU  89           HB2      LEU  89   9.220   4.546   0.220
  638    HB3  LEU  89           HB1      LEU  89   9.379   2.814   0.015
  639   HD11  LEU  89          HD11      LEU  89   5.718   3.500  -0.045
  640   HD12  LEU  89          HD12      LEU  89   7.062   2.896  -1.014
  641   HD13  LEU  89          HD13      LEU  89   6.938   4.618  -0.653
  642   HD21  LEU  89          HD23      LEU  89   6.255   1.943   1.796
  643   HD22  LEU  89          HD21      LEU  89   7.872   1.924   2.501
  644   HD23  LEU  89          HD22      LEU  89   7.609   1.280   0.881
  645    H    ARG  90           HN       ARG  90  11.415   5.598   1.554
  646    HA   ARG  90           HA       ARG  90  13.586   4.277   0.195
  647    HE   ARG  90           HE       ARG  90  12.184   8.753   0.120
  648    HB2  ARG  90           HB2      ARG  90  13.118   7.137   1.025
  649    HB3  ARG  90           HB1      ARG  90  14.596   6.605   0.234
  650    HG2  ARG  90           HG2      ARG  90  13.274   5.834  -1.684
  651    HG3  ARG  90           HG1      ARG  90  11.810   6.422  -0.893
  652    HD2  ARG  90           HD2      ARG  90  14.183   8.120  -1.653
  653    HD3  ARG  90           HD1      ARG  90  12.685   8.000  -2.573
  654   HH11  ARG  90          HH11      ARG  90  13.322   9.983  -2.934
  655   HH12  ARG  90          HH12      ARG  90  12.835  11.612  -2.606
  656   HH21  ARG  90          HH21      ARG  90  11.538  10.897   0.560
  657   HH22  ARG  90          HH22      ARG  90  11.824  12.132  -0.620
  658    H    ASN  91           HN       ASN  91  12.824   5.024   3.431
  659    HA   ASN  91           HA       ASN  91  15.597   5.049   4.308
  660    HB2  ASN  91           HB2      ASN  91  12.961   5.421   5.706
  661    HB3  ASN  91           HB1      ASN  91  14.442   5.153   6.622
  662   HD21  ASN  91          HD21      ASN  91  14.382   6.877   3.590
  663   HD22  ASN  91          HD22      ASN  91  14.723   8.437   4.246
  664    H    ALA  92           HN       ALA  92  13.129   2.781   3.757
  665    HA   ALA  92           HA       ALA  92  13.519   0.865   5.720
  666    HB1  ALA  92           HB3      ALA  92  11.732   0.733   4.074
  667    HB2  ALA  92           HB1      ALA  92  12.670  -0.761   4.101
  668    HB3  ALA  92           HB2      ALA  92  12.911   0.408   2.803
  669    H    GLY  93           HN       GLY  93  14.682   0.036   2.490
  670    HA2  GLY  93           HA2      GLY  93  16.654  -0.909   1.778
  671    HA3  GLY  93           HA1      GLY  93  17.438  -0.058   3.100
  672    H    ASN  94           HN       ASN  94  14.884  -2.084   4.041
  673    HA   ASN  94           HA       ASN  94  16.577  -4.416   4.476
  674    HB2  ASN  94           HB2      ASN  94  15.752  -4.382   6.940
  675    HB3  ASN  94           HB1      ASN  94  17.091  -3.332   6.488
  676   HD21  ASN  94          HD21      ASN  94  13.745  -2.728   5.641
  677   HD22  ASN  94          HD22      ASN  94  13.549  -1.336   6.644
  678    HA   PRO  95           HA       PRO  95  12.856  -6.829   4.095
  679    HB2  PRO  95           HB2      PRO  95  13.050  -7.810   6.892
  680    HB3  PRO  95           HB1      PRO  95  12.953  -8.726   5.384
  681    HG2  PRO  95           HG2      PRO  95  15.251  -8.539   6.717
  682    HG3  PRO  95           HG1      PRO  95  15.218  -8.495   4.944
  683    HD2  PRO  95           HD2      PRO  95  15.558  -6.252   6.892
  684    HD3  PRO  95           HD1      PRO  95  16.344  -6.512   5.322
  685    H    VAL  96           HN       VAL  96  11.137  -5.470   3.977
  686    HA   VAL  96           HA       VAL  96   9.978  -4.532   6.519
  687    HB   VAL  96           HB       VAL  96   8.925  -2.708   5.160
  688   HG11  VAL  96          HG11      VAL  96  11.940  -2.795   5.182
  689   HG12  VAL  96          HG12      VAL  96  10.908  -2.317   6.530
  690   HG13  VAL  96          HG13      VAL  96  10.947  -1.342   5.061
  691   HG21  VAL  96          HG23      VAL  96   9.112  -3.786   2.966
  692   HG22  VAL  96          HG21      VAL  96  10.868  -3.645   3.049
  693   HG23  VAL  96          HG22      VAL  96   9.870  -2.193   2.973
  694    H    ARG  97           HN       ARG  97   7.832  -4.777   6.898
  695    HA   ARG  97           HA       ARG  97   6.397  -6.614   5.145
  696    HE   ARG  97           HE       ARG  97   2.575  -8.839   7.416
  697    HB2  ARG  97           HB2      ARG  97   6.579  -7.102   7.584
  698    HB3  ARG  97           HB1      ARG  97   5.680  -5.629   7.917
  699    HG2  ARG  97           HG2      ARG  97   3.743  -6.527   6.752
  700    HG3  ARG  97           HG1      ARG  97   4.646  -7.993   6.362
  701    HD2  ARG  97           HD2      ARG  97   4.905  -8.448   8.767
  702    HD3  ARG  97           HD1      ARG  97   3.954  -7.008   9.129
  703   HH11  ARG  97          HH11      ARG  97   3.389  -8.127  10.727
  704   HH12  ARG  97          HH12      ARG  97   2.023  -8.969  11.380
  705   HH21  ARG  97          HH21      ARG  97   0.774  -9.954   8.266
  706   HH22  ARG  97          HH22      ARG  97   0.538 -10.009   9.981
  707    H    LEU  98           HN       LEU  98   4.370  -6.132   4.286
  708    HA   LEU  98           HA       LEU  98   3.602  -3.291   4.417
  709    HG   LEU  98           HG       LEU  98   5.581  -4.976   2.333
  710    HB2  LEU  98           HB2      LEU  98   3.129  -5.034   2.022
  711    HB3  LEU  98           HB1      LEU  98   3.087  -3.286   2.124
  712   HD11  LEU  98          HD11      LEU  98   4.626  -5.026   0.092
  713   HD12  LEU  98          HD12      LEU  98   6.118  -4.088   0.125
  714   HD13  LEU  98          HD13      LEU  98   4.559  -3.264   0.071
  715   HD21  LEU  98          HD23      LEU  98   5.172  -1.989   2.256
  716   HD22  LEU  98          HD21      LEU  98   6.731  -2.792   2.069
  717   HD23  LEU  98          HD22      LEU  98   5.839  -2.939   3.584
  718    H    LEU  99           HN       LEU  99   1.508  -2.816   4.780
  719    HA   LEU  99           HA       LEU  99  -0.420  -5.046   4.831
  720    HG   LEU  99           HG       LEU  99  -2.596  -3.568   6.340
  721    HB2  LEU  99           HB2      LEU  99   0.208  -4.374   7.108
  722    HB3  LEU  99           HB1      LEU  99  -0.247  -2.719   6.750
  723   HD11  LEU  99          HD11      LEU  99  -1.498  -6.030   7.687
  724   HD12  LEU  99          HD12      LEU  99  -2.027  -5.922   6.009
  725   HD13  LEU  99          HD13      LEU  99  -3.193  -5.715   7.315
  726   HD21  LEU  99          HD23      LEU  99  -1.440  -3.929   9.101
  727   HD22  LEU  99          HD21      LEU  99  -3.138  -3.661   8.714
  728   HD23  LEU  99          HD22      LEU  99  -1.950  -2.400   8.385
  729    H    LEU 100           HN       LEU 100  -1.630  -4.701   3.061
  730    HA   LEU 100           HA       LEU 100  -2.859  -2.046   2.762
  731    HG   LEU 100           HG       LEU 100  -0.265  -3.948   1.340
  732    HB2  LEU 100           HB2      LEU 100  -2.851  -2.872   0.208
  733    HB3  LEU 100           HB1      LEU 100  -1.591  -1.873   0.908
  734   HD11  LEU 100          HD11      LEU 100  -0.890  -5.992   0.154
  735   HD12  LEU 100          HD12      LEU 100  -2.414  -5.245  -0.327
  736   HD13  LEU 100          HD13      LEU 100  -2.084  -5.557   1.377
  737   HD21  LEU 100          HD23      LEU 100  -1.043  -3.443  -1.528
  738   HD22  LEU 100          HD21      LEU 100   0.424  -4.254  -0.983
  739   HD23  LEU 100          HD22      LEU 100   0.169  -2.551  -0.609
  740    H    ILE 101           HN       ILE 101  -4.987  -1.994   2.027
  741    HA   ILE 101           HA       ILE 101  -6.414  -4.531   2.353
  742    HB   ILE 101           HB       ILE 101  -7.167  -2.682   3.764
  743   HG12  ILE 101          HG12      ILE 101  -9.198  -3.318   1.612
  744   HG13  ILE 101          HG11      ILE 101  -8.784  -4.391   2.943
  745   HG21  ILE 101          HG21      ILE 101  -8.227  -0.704   2.798
  746   HG22  ILE 101          HG22      ILE 101  -7.821  -1.274   1.179
  747   HG23  ILE 101          HG23      ILE 101  -6.538  -0.831   2.306
  748   HD11  ILE 101          HD13      ILE 101  -9.586  -2.693   4.528
  749   HD12  ILE 101          HD11      ILE 101 -10.842  -3.228   3.411
  750   HD13  ILE 101          HD12      ILE 101 -10.050  -1.671   3.167
  751    H    ARG 102           HN       ARG 102  -7.824  -5.339   0.836
  752    HA   ARG 102           HA       ARG 102  -7.943  -3.965  -1.760
  753    HE   ARG 102           HE       ARG 102  -6.772  -6.325  -4.976
  754    HB2  ARG 102           HB2      ARG 102  -7.002  -6.735  -1.168
  755    HB3  ARG 102           HB1      ARG 102  -7.882  -6.451  -2.663
  756    HG2  ARG 102           HG2      ARG 102  -5.442  -4.893  -1.850
  757    HG3  ARG 102           HG1      ARG 102  -5.392  -6.346  -2.849
  758    HD2  ARG 102           HD2      ARG 102  -6.858  -3.791  -3.493
  759    HD3  ARG 102           HD1      ARG 102  -5.353  -4.338  -4.229
  760   HH11  ARG 102          HH11      ARG 102  -8.012  -3.095  -4.548
  761   HH12  ARG 102          HH12      ARG 102  -9.265  -3.282  -5.728
  762   HH21  ARG 102          HH21      ARG 102  -8.415  -6.577  -6.534
  763   HH22  ARG 102          HH22      ARG 102  -9.496  -5.263  -6.857
  764    H    ARG 103           HN       ARG 103  -9.868  -4.080  -2.815
  765    HA   ARG 103           HA       ARG 103 -12.098  -5.182  -1.309
  766    HE   ARG 103           HE       ARG 103 -14.796  -2.240  -2.406
  767    HB2  ARG 103           HB2      ARG 103 -12.064  -3.491  -3.817
  768    HB3  ARG 103           HB1      ARG 103 -13.503  -3.945  -2.917
  769    HG2  ARG 103           HG2      ARG 103 -12.756  -2.677  -1.003
  770    HG3  ARG 103           HG1      ARG 103 -11.239  -2.293  -1.818
  771    HD2  ARG 103           HD2      ARG 103 -12.814  -0.425  -1.928
  772    HD3  ARG 103           HD1      ARG 103 -12.454  -1.062  -3.531
  773   HH11  ARG 103          HH11      ARG 103 -13.586   0.579  -4.060
  774   HH12  ARG 103          HH12      ARG 103 -15.122   0.992  -4.748
  775   HH21  ARG 103          HH21      ARG 103 -16.819  -1.703  -3.305
  776   HH22  ARG 103          HH22      ARG 103 -16.959  -0.304  -4.315
  777    H    LEU 104           HN       LEU 104 -13.218  -6.955  -1.855
  778    HA   LEU 104           HA       LEU 104 -12.362  -8.419  -4.241
  779    HG   LEU 104           HG       LEU 104 -11.713  -8.848  -1.191
  780    HB2  LEU 104           HB2      LEU 104 -14.034  -9.364  -1.912
  781    HB3  LEU 104           HB1      LEU 104 -13.384 -10.366  -3.195
  782   HD11  LEU 104          HD11      LEU 104 -12.395 -11.782  -1.322
  783   HD12  LEU 104          HD12      LEU 104 -12.976 -10.633  -0.117
  784   HD13  LEU 104          HD13      LEU 104 -11.261 -11.032  -0.199
  785   HD21  LEU 104          HD23      LEU 104 -10.619  -9.214  -3.360
  786   HD22  LEU 104          HD21      LEU 104 -10.943 -10.942  -3.221
  787   HD23  LEU 104          HD22      LEU 104  -9.864 -10.152  -2.071
  788    HA   PRO 105           HA       PRO 105 -16.287  -7.434  -6.124
  789    HB2  PRO 105           HB2      PRO 105 -16.007  -8.790  -8.408
  790    HB3  PRO 105           HB1      PRO 105 -15.011  -7.370  -8.061
  791    HG2  PRO 105           HG2      PRO 105 -14.319 -10.271  -7.834
  792    HG3  PRO 105           HG1      PRO 105 -13.341  -8.934  -8.463
  793    HD2  PRO 105           HD2      PRO 105 -13.108  -9.978  -5.922
  794    HD3  PRO 105           HD1      PRO 105 -12.611  -8.339  -6.381
  795    H    LEU 106           HN       LEU 106 -18.238  -8.492  -6.861
  796    HA   LEU 106           HA       LEU 106 -18.489 -11.293  -5.991
  797    HG   LEU 106           HG       LEU 106 -18.562  -9.244  -3.777
  798    HB2  LEU 106           HB2      LEU 106 -20.391  -9.016  -5.444
  799    HB3  LEU 106           HB1      LEU 106 -20.795 -10.703  -5.194
  800   HD11  LEU 106          HD11      LEU 106 -20.726  -8.375  -3.103
  801   HD12  LEU 106          HD12      LEU 106 -20.025  -9.352  -1.812
  802   HD13  LEU 106          HD13      LEU 106 -21.315 -10.012  -2.817
  803   HD21  LEU 106          HD23      LEU 106 -18.135 -11.624  -3.992
  804   HD22  LEU 106          HD21      LEU 106 -19.744 -11.989  -3.365
  805   HD23  LEU 106          HD22      LEU 106 -18.544 -11.224  -2.323
  806    H    LEU 107           HN       LEU 107 -18.585 -12.237  -7.965
  807    HA   LEU 107           HA       LEU 107 -20.052 -11.145 -10.157
  808    HG   LEU 107           HG       LEU 107 -17.155 -12.210  -9.768
  809    HB2  LEU 107           HB2      LEU 107 -18.940 -13.919  -9.748
  810    HB3  LEU 107           HB1      LEU 107 -19.548 -13.283 -11.265
  811   HD11  LEU 107          HD11      LEU 107 -15.851 -13.180 -11.590
  812   HD12  LEU 107          HD12      LEU 107 -17.320 -13.882 -12.267
  813   HD13  LEU 107          HD13      LEU 107 -16.731 -14.418 -10.694
  814   HD21  LEU 107          HD23      LEU 107 -18.308 -10.488 -11.054
  815   HD22  LEU 107          HD21      LEU 107 -18.262 -11.516 -12.486
  816   HD23  LEU 107          HD22      LEU 107 -16.761 -10.900 -11.795
  817    H    GLU 108           HN       GLU 108 -22.194 -11.104 -10.260
  818    HA   GLU 108           HA       GLU 108 -23.708 -13.317  -9.042
  819    HB2  GLU 108           HB2      GLU 108 -24.567 -10.472  -9.596
  820    HB3  GLU 108           HB1      GLU 108 -25.610 -11.727  -8.941
  821    HG2  GLU 108           HG2      GLU 108 -24.174 -11.904  -6.978
  822    HG3  GLU 108           HG1      GLU 108 -23.120 -10.653  -7.635
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1  -5.710  -7.806  19.389
    2    H2   GLY   1           HT2      GLY   1  -7.176  -8.110  20.175
    3    H3   GLY   1           HT3      GLY   1  -6.759  -6.529  19.750
    4    HA2  GLY   1           HA1      GLY   1  -7.308  -8.740  17.846
    5    HA3  GLY   1           HA2      GLY   1  -8.420  -7.436  18.236
    6    H    SER   2           HN       SER   2  -6.479  -8.454  15.892
    7    HA   SER   2           HA       SER   2  -6.138  -5.765  14.831
    8    HG   SER   2           HG       SER   2  -4.417  -6.268  16.901
    9    HB2  SER   2           HB2      SER   2  -3.840  -7.719  15.091
   10    HB3  SER   2           HB1      SER   2  -3.790  -6.234  14.141
   11    H    HIS   3           HN       HIS   3  -5.446  -9.203  14.185
   12    HA   HIS   3           HA       HIS   3  -5.937  -8.846  11.357
   13    HD1  HIS   3           HD1      HIS   3  -4.161 -10.515   9.508
   14    HD2  HIS   3           HD2      HIS   3  -6.824 -13.115  11.354
   15    HE1  HIS   3           HE1      HIS   3  -4.830 -12.165   7.731
   16    HE2  HIS   3           HE2      HIS   3  -6.379 -13.776   8.893
   17    HB2  HIS   3           HB2      HIS   3  -4.180 -10.386  12.116
   18    HB3  HIS   3           HB1      HIS   3  -5.385 -11.357  12.955
   19    H    GLY   4           HN       GLY   4  -7.782  -9.237  10.301
   20    HA2  GLY   4           HA2      GLY   4  -9.713 -11.136  10.908
   21    HA3  GLY   4           HA1      GLY   4 -10.195  -9.662  11.734
   22    H    TYR   5           HN       TYR   5 -12.048  -9.420  10.476
   23    HA   TYR   5           HA       TYR   5 -13.311  -8.700   8.729
   24    HD1  TYR   5           HD2      TYR   5 -10.324  -6.873  10.365
   25    HD2  TYR   5           HD1      TYR   5 -13.763  -5.533   8.250
   26    HE1  TYR   5           HE2      TYR   5 -10.738  -5.193  12.114
   27    HE2  TYR   5           HE1      TYR   5 -14.188  -3.850   9.991
   28    HH   TYR   5           HH       TYR   5 -11.893  -3.085  12.408
   29    HB2  TYR   5           HB2      TYR   5 -10.694  -7.403   7.948
   30    HB3  TYR   5           HB1      TYR   5 -12.247  -7.032   7.210
   31    H    SER   6           HN       SER   6 -12.579 -11.280   8.403
   32    HA   SER   6           HA       SER   6 -11.379 -11.677   5.804
   33    HG   SER   6           HG       SER   6 -10.522 -12.453   8.077
   34    HB2  SER   6           HB2      SER   6 -12.716 -13.655   7.669
   35    HB3  SER   6           HB1      SER   6 -11.805 -14.070   6.218
   36    H    ASP   7           HN       ASP   7 -12.491 -11.302   4.014
   37    HA   ASP   7           HA       ASP   7 -14.181 -11.167   2.496
   38    HB2  ASP   7           HB2      ASP   7 -15.356 -13.468   4.074
   39    HB3  ASP   7           HB1      ASP   7 -15.755 -13.027   2.417
   40    H    ALA   8           HN       ALA   8 -14.817  -9.097   3.309
   41    HA   ALA   8           HA       ALA   8 -17.431  -9.168   4.662
   42    HB1  ALA   8           HB3      ALA   8 -16.858  -7.136   5.877
   43    HB2  ALA   8           HB1      ALA   8 -15.251  -7.142   5.150
   44    HB3  ALA   8           HB2      ALA   8 -15.725  -8.435   6.251
   45    H    SER   9           HN       SER   9 -18.548  -8.940   2.728
   46    HA   SER   9           HA       SER   9 -19.533  -7.870   0.984
   47    HG   SER   9           HG       SER   9 -20.772  -7.213   2.766
   48    HB2  SER   9           HB2      SER   9 -18.661  -5.419   2.530
   49    HB3  SER   9           HB1      SER   9 -19.851  -5.430   1.229
   50    H    GLY  10           HN       GLY  10 -16.654  -8.520   0.797
   51    HA2  GLY  10           HA2      GLY  10 -15.305  -8.384  -1.129
   52    HA3  GLY  10           HA1      GLY  10 -16.109  -6.883  -1.558
   53    H    PHE  11           HN       PHE  11 -14.696  -7.603   1.581
   54    HA   PHE  11           HA       PHE  11 -12.434  -5.836   0.997
   55    HD1  PHE  11           HD2      PHE  11 -12.243  -2.936   1.761
   56    HD2  PHE  11           HD1      PHE  11 -16.131  -4.668   1.755
   57    HE1  PHE  11           HE2      PHE  11 -13.091  -1.020   0.472
   58    HE2  PHE  11           HE1      PHE  11 -16.986  -2.755   0.464
   59    HZ   PHE  11           HZ       PHE  11 -15.462  -0.919  -0.168
   60    HB2  PHE  11           HB2      PHE  11 -14.417  -5.472   3.245
   61    HB3  PHE  11           HB1      PHE  11 -12.813  -4.749   3.267
   62    H    SER  12           HN       SER  12 -10.632  -6.832   1.545
   63    HA   SER  12           HA       SER  12 -10.566  -8.461   3.978
   64    HG   SER  12           HG       SER  12  -9.138 -10.281   3.887
   65    HB2  SER  12           HB2      SER  12 -10.933 -10.039   2.142
   66    HB3  SER  12           HB1      SER  12  -9.543  -9.381   1.279
   67    H    LEU  13           HN       LEU  13  -8.589  -8.541   5.010
   68    HA   LEU  13           HA       LEU  13  -6.768  -6.401   4.356
   69    HG   LEU  13           HG       LEU  13  -8.645  -6.928   6.733
   70    HB2  LEU  13           HB2      LEU  13  -6.648  -8.446   6.578
   71    HB3  LEU  13           HB1      LEU  13  -5.644  -7.015   6.447
   72   HD11  LEU  13          HD11      LEU  13  -7.634  -7.933   8.716
   73   HD12  LEU  13          HD12      LEU  13  -8.248  -6.316   9.060
   74   HD13  LEU  13          HD13      LEU  13  -6.517  -6.575   8.840
   75   HD21  LEU  13          HD23      LEU  13  -7.764  -4.952   5.694
   76   HD22  LEU  13          HD21      LEU  13  -6.489  -4.831   6.908
   77   HD23  LEU  13          HD22      LEU  13  -8.172  -4.573   7.368
   78    H    TYR  14           HN       TYR  14  -5.028  -6.608   3.125
   79    HA   TYR  14           HA       TYR  14  -3.914  -9.303   2.710
   80    HD1  TYR  14           HD1      TYR  14  -6.619  -7.671   0.941
   81    HD2  TYR  14           HD2      TYR  14  -3.515 -10.235  -0.440
   82    HE1  TYR  14           HE1      TYR  14  -8.289  -9.075  -0.189
   83    HE2  TYR  14           HE2      TYR  14  -5.180 -11.646  -1.574
   84    HH   TYR  14           HH       TYR  14  -7.587 -12.158  -1.399
   85    HB2  TYR  14           HB2      TYR  14  -4.210  -6.948   0.872
   86    HB3  TYR  14           HB1      TYR  14  -2.969  -8.158   0.570
   87    H    SER  15           HN       SER  15  -1.647  -9.541   2.587
   88    HA   SER  15           HA       SER  15   0.030  -7.276   3.274
   89    HG   SER  15           HG       SER  15  -0.251 -10.494   4.357
   90    HB2  SER  15           HB2      SER  15   0.998  -8.389   5.254
   91    HB3  SER  15           HB1      SER  15  -0.718  -8.044   5.472
   92    H    VAL  16           HN       VAL  16   2.086  -7.481   2.554
   93    HA   VAL  16           HA       VAL  16   2.930 -10.109   1.529
   94    HB   VAL  16           HB       VAL  16   3.421  -7.478   0.127
   95   HG11  VAL  16          HG11      VAL  16   5.182  -9.111  -0.241
   96   HG12  VAL  16          HG12      VAL  16   4.231  -8.892  -1.709
   97   HG13  VAL  16          HG13      VAL  16   3.988 -10.322  -0.706
   98   HG21  VAL  16          HG23      VAL  16   1.067  -8.076  -0.001
   99   HG22  VAL  16          HG21      VAL  16   1.492  -9.692  -0.565
  100   HG23  VAL  16          HG22      VAL  16   1.845  -8.286  -1.570
  101    H    GLU  17           HN       GLU  17   5.132 -10.569   1.672
  102    HA   GLU  17           HA       GLU  17   6.590  -8.881   3.556
  103    HB2  GLU  17           HB2      GLU  17   7.120 -11.687   2.573
  104    HB3  GLU  17           HB1      GLU  17   8.137 -10.828   3.722
  105    HG2  GLU  17           HG2      GLU  17   6.196 -10.652   5.243
  106    HG3  GLU  17           HG1      GLU  17   5.263 -11.628   4.108
  107    H    LEU  18           HN       LEU  18   7.893  -7.395   2.767
  108    HA   LEU  18           HA       LEU  18   9.394  -7.981   0.302
  109    HG   LEU  18           HG       LEU  18   7.785  -5.080  -1.191
  110    HB2  LEU  18           HB2      LEU  18   7.887  -5.619   1.165
  111    HB3  LEU  18           HB1      LEU  18   9.494  -5.252   0.567
  112   HD11  LEU  18          HD11      LEU  18  10.086  -5.662  -1.784
  113   HD12  LEU  18          HD12      LEU  18   8.926  -6.420  -2.874
  114   HD13  LEU  18          HD13      LEU  18   9.700  -7.373  -1.608
  115   HD21  LEU  18          HD23      LEU  18   6.683  -7.090  -2.034
  116   HD22  LEU  18          HD21      LEU  18   6.234  -6.772  -0.358
  117   HD23  LEU  18          HD22      LEU  18   7.404  -8.038  -0.732
  118    H    PHE  19           HN       PHE  19  11.490  -6.725   0.163
  119    HA   PHE  19           HA       PHE  19  12.716  -5.972   2.658
  120    HD1  PHE  19           HD2      PHE  19  11.660  -9.610   1.271
  121    HD2  PHE  19           HD1      PHE  19  15.594  -8.256   0.380
  122    HE1  PHE  19           HE2      PHE  19  11.773 -11.189  -0.613
  123    HE2  PHE  19           HE1      PHE  19  15.715  -9.831  -1.506
  124    HZ   PHE  19           HZ       PHE  19  13.788 -11.305  -2.001
  125    HB2  PHE  19           HB2      PHE  19  14.561  -7.669   2.433
  126    HB3  PHE  19           HB1      PHE  19  13.001  -8.336   2.903
  127    H    ARG  20           HN       ARG  20  14.313  -4.522   2.342
  128    HA   ARG  20           HA       ARG  20  15.368  -4.275  -0.404
  129    HE   ARG  20           HE       ARG  20  15.157   0.043   1.583
  130    HB2  ARG  20           HB2      ARG  20  13.763  -2.452   0.328
  131    HB3  ARG  20           HB1      ARG  20  14.979  -1.969   1.503
  132    HG2  ARG  20           HG2      ARG  20  16.573  -1.586  -0.328
  133    HG3  ARG  20           HG1      ARG  20  15.316  -2.016  -1.490
  134    HD2  ARG  20           HD2      ARG  20  15.469   0.385  -1.319
  135    HD3  ARG  20           HD1      ARG  20  13.937  -0.155  -0.634
  136   HH11  ARG  20          HH11      ARG  20  15.886   2.027  -1.185
  137   HH12  ARG  20          HH12      ARG  20  16.473   3.354  -0.241
  138   HH21  ARG  20          HH21      ARG  20  15.930   1.786   2.834
  139   HH22  ARG  20          HH22      ARG  20  16.504   3.216   2.042
  140    H    GLU  21           HN       GLU  21  17.501  -3.262  -0.560
  141    HA   GLU  21           HA       GLU  21  19.165  -3.008   1.735
  142    HB2  GLU  21           HB2      GLU  21  20.665  -4.880   1.335
  143    HB3  GLU  21           HB1      GLU  21  19.034  -5.465   1.631
  144    HG2  GLU  21           HG2      GLU  21  18.698  -5.833  -0.735
  145    HG3  GLU  21           HG1      GLU  21  20.289  -5.159  -1.087
  146    H    LYS  22           HN       LYS  22  18.821  -3.333  -1.713
  147    HA   LYS  22           HA       LYS  22  21.375  -2.360  -2.454
  148    HB2  LYS  22           HB2      LYS  22  18.761  -2.331  -3.975
  149    HB3  LYS  22           HB1      LYS  22  20.340  -2.005  -4.677
  150    HG2  LYS  22           HG2      LYS  22  19.604  -4.597  -3.338
  151    HG3  LYS  22           HG1      LYS  22  19.472  -4.307  -5.073
  152    HD2  LYS  22           HD2      LYS  22  21.891  -3.792  -5.133
  153    HD3  LYS  22           HD1      LYS  22  21.991  -4.190  -3.417
  154    HE2  LYS  22           HE2      LYS  22  22.706  -6.059  -4.840
  155    HE3  LYS  22           HE1      LYS  22  21.287  -6.465  -3.874
  156    HZ1  LYS  22           HZ3      LYS  22  19.900  -6.051  -5.811
  157    HZ2  LYS  22           HZ1      LYS  22  21.053  -7.243  -6.143
  158    HZ3  LYS  22           HZ2      LYS  22  21.264  -5.673  -6.737
  159    H    ASP  23           HN       ASP  23  21.755  -0.297  -3.598
  160    HA   ASP  23           HA       ASP  23  20.669   1.902  -2.050
  161    HB2  ASP  23           HB2      ASP  23  22.798   1.882  -4.203
  162    HB3  ASP  23           HB1      ASP  23  22.383   3.259  -3.188
  163    H    THR  24           HN       THR  24  19.092   0.419  -4.139
  164    HA   THR  24           HA       THR  24  18.708   2.054  -6.396
  165    HB   THR  24           HB       THR  24  16.544   0.892  -6.661
  166    HG1  THR  24           HG1      THR  24  16.446   0.737  -4.152
  167   HG21  THR  24          HG23      THR  24  18.848  -0.894  -5.874
  168   HG22  THR  24          HG21      THR  24  18.559  -0.199  -7.469
  169   HG23  THR  24          HG22      THR  24  17.445  -1.400  -6.814
  170    H    SER  25           HN       SER  25  17.668   2.348  -3.130
  171    HA   SER  25           HA       SER  25  16.412   3.869  -2.008
  172    HG   SER  25           HG       SER  25  18.883   4.910  -3.372
  173    HB2  SER  25           HB2      SER  25  17.004   5.567  -4.443
  174    HB3  SER  25           HB1      SER  25  16.386   6.173  -2.906
  175    H    SER  26           HN       SER  26  15.096   2.025  -3.939
  176    HA   SER  26           HA       SER  26  12.491   3.298  -3.875
  177    HG   SER  26           HG       SER  26  14.393   4.342  -6.191
  178    HB2  SER  26           HB2      SER  26  13.674   2.298  -6.477
  179    HB3  SER  26           HB1      SER  26  12.011   2.839  -6.251
  180    H    LEU  27           HN       LEU  27  10.743   1.822  -4.120
  181    HA   LEU  27           HA       LEU  27  11.522  -1.005  -3.819
  182    HG   LEU  27           HG       LEU  27  11.544   0.575  -1.305
  183    HB2  LEU  27           HB2      LEU  27   9.337   0.553  -2.447
  184    HB3  LEU  27           HB1      LEU  27   9.388  -1.199  -2.458
  185   HD11  LEU  27          HD11      LEU  27   9.418  -1.046   0.092
  186   HD12  LEU  27          HD12      LEU  27   9.454   0.713  -0.035
  187   HD13  LEU  27          HD13      LEU  27  10.713  -0.131   0.867
  188   HD21  LEU  27          HD23      LEU  27  12.401  -1.560  -2.087
  189   HD22  LEU  27          HD21      LEU  27  11.133  -2.413  -1.207
  190   HD23  LEU  27          HD22      LEU  27  12.371  -1.520  -0.323
  191    H    GLY  28           HN       GLY  28   9.985   1.181  -5.775
  192    HA2  GLY  28           HA2      GLY  28   8.950   0.676  -7.816
  193    HA3  GLY  28           HA1      GLY  28   8.666  -0.960  -7.242
  194    H    ILE  29           HN       ILE  29   7.812   1.516  -5.058
  195    HA   ILE  29           HA       ILE  29   4.979   0.953  -5.528
  196    HB   ILE  29           HB       ILE  29   6.293   2.363  -3.200
  197   HG12  ILE  29          HG12      ILE  29   5.181  -0.448  -3.360
  198   HG13  ILE  29          HG11      ILE  29   6.895  -0.050  -3.435
  199   HG21  ILE  29          HG21      ILE  29   3.983   3.055  -3.524
  200   HG22  ILE  29          HG22      ILE  29   4.132   2.053  -2.081
  201   HG23  ILE  29          HG23      ILE  29   3.469   1.369  -3.564
  202   HD11  ILE  29          HD13      ILE  29   5.060   0.491  -1.113
  203   HD12  ILE  29          HD11      ILE  29   6.777   0.884  -1.187
  204   HD13  ILE  29          HD12      ILE  29   6.256  -0.801  -1.218
  205    H    SER  30           HN       SER  30   3.878   2.328  -6.762
  206    HA   SER  30           HA       SER  30   4.694   5.160  -6.786
  207    HG   SER  30           HG       SER  30   2.889   5.457  -9.847
  208    HB2  SER  30           HB2      SER  30   4.872   4.046  -8.975
  209    HB3  SER  30           HB1      SER  30   3.166   3.605  -8.891
  210    H    ILE  31           HN       ILE  31   3.487   5.817  -5.015
  211    HA   ILE  31           HA       ILE  31   0.630   5.320  -4.949
  212    HB   ILE  31           HB       ILE  31   0.670   6.628  -2.851
  213   HG12  ILE  31          HG12      ILE  31   3.660   6.763  -3.312
  214   HG13  ILE  31          HG11      ILE  31   2.558   8.124  -3.500
  215   HG21  ILE  31          HG21      ILE  31   1.013   4.218  -2.810
  216   HG22  ILE  31          HG22      ILE  31   1.960   5.005  -1.548
  217   HG23  ILE  31          HG23      ILE  31   2.748   4.450  -3.025
  218   HD11  ILE  31          HD13      ILE  31   3.713   8.219  -1.372
  219   HD12  ILE  31          HD11      ILE  31   3.097   6.622  -0.948
  220   HD13  ILE  31          HD12      ILE  31   1.983   7.977  -1.131
  221    H    SER  32           HN       SER  32  -0.832   7.221  -4.477
  222    HA   SER  32           HA       SER  32  -0.033   9.737  -5.685
  223    HG   SER  32           HG       SER  32  -2.983  10.073  -7.185
  224    HB2  SER  32           HB2      SER  32  -0.775   8.442  -7.629
  225    HB3  SER  32           HB1      SER  32  -2.301   8.083  -6.822
  226    H    GLY  33           HN       GLY  33  -1.054  11.433  -4.775
  227    HA2  GLY  33           HA2      GLY  33  -2.594  11.077  -2.446
  228    HA3  GLY  33           HA1      GLY  33  -2.368  12.597  -3.297
  229    H    MET  34           HN       MET  34  -4.709  10.899  -2.071
  230    HA   MET  34           HA       MET  34  -6.522  10.417  -4.180
  231    HB2  MET  34           HB2      MET  34  -6.763   9.445  -1.923
  232    HB3  MET  34           HB1      MET  34  -7.112  11.043  -1.281
  233    HG2  MET  34           HG2      MET  34  -9.156   9.815  -1.559
  234    HG3  MET  34           HG1      MET  34  -9.112  11.158  -2.699
  235    HE1  MET  34           HE3      MET  34 -11.076   8.314  -4.604
  236    HE2  MET  34           HE1      MET  34 -11.128   9.999  -4.086
  237    HE3  MET  34           HE2      MET  34 -11.128   8.706  -2.886
  238    H    ARG  35           HN       ARG  35  -7.785  11.734  -5.319
  239    HA   ARG  35           HA       ARG  35  -7.487  14.525  -5.234
  240    HE   ARG  35           HE       ARG  35 -11.187  14.352  -7.752
  241    HB2  ARG  35           HB2      ARG  35  -9.445  14.532  -6.806
  242    HB3  ARG  35           HB1      ARG  35  -8.117  13.485  -7.289
  243    HG2  ARG  35           HG2      ARG  35  -9.317  11.542  -6.481
  244    HG3  ARG  35           HG1      ARG  35 -10.633  12.571  -5.912
  245    HD2  ARG  35           HD2      ARG  35  -9.737  12.301  -8.779
  246    HD3  ARG  35           HD1      ARG  35 -11.142  11.505  -8.071
  247   HH11  ARG  35          HH11      ARG  35 -11.906  11.736  -9.937
  248   HH12  ARG  35          HH12      ARG  35 -13.116  12.622 -10.803
  249   HH21  ARG  35          HH21      ARG  35 -12.777  15.525  -8.885
  250   HH22  ARG  35          HH22      ARG  35 -13.612  14.776 -10.205
  251    H    ASP  36           HN       ASP  36  -9.259  16.107  -4.953
  252    HA   ASP  36           HA       ASP  36 -10.600  15.618  -2.425
  253    HB2  ASP  36           HB2      ASP  36 -10.470  18.133  -4.102
  254    HB3  ASP  36           HB1      ASP  36 -11.083  18.019  -2.455
  255    H    GLN  37           HN       GLN  37 -12.657  15.050  -2.240
  256    HA   GLN  37           HA       GLN  37 -14.421  15.368  -4.575
  257    HB2  GLN  37           HB2      GLN  37 -14.492  13.379  -2.303
  258    HB3  GLN  37           HB1      GLN  37 -15.781  13.551  -3.486
  259    HG2  GLN  37           HG2      GLN  37 -12.929  12.811  -4.099
  260    HG3  GLN  37           HG1      GLN  37 -14.289  11.693  -4.014
  261   HE21  GLN  37          HE21      GLN  37 -15.863  11.745  -5.634
  262   HE22  GLN  37          HE22      GLN  37 -15.573  12.492  -7.165
  263    H    SER  38           HN       SER  38 -16.799  15.531  -3.944
  264    HA   SER  38           HA       SER  38 -17.045  17.719  -2.037
  265    HG   SER  38           HG       SER  38 -18.576  18.660  -5.032
  266    HB2  SER  38           HB2      SER  38 -19.051  16.583  -4.001
  267    HB3  SER  38           HB1      SER  38 -19.290  18.025  -3.013
  268    H    THR  39           HN       THR  39 -16.675  14.918  -1.158
  269    HA   THR  39           HA       THR  39 -19.202  14.553   0.315
  270    HB   THR  39           HB       THR  39 -18.497  12.192   0.647
  271    HG1  THR  39           HG1      THR  39 -16.426  12.919  -1.175
  272   HG21  THR  39          HG23      THR  39 -20.027  12.767  -1.170
  273   HG22  THR  39          HG21      THR  39 -18.964  11.442  -1.641
  274   HG23  THR  39          HG22      THR  39 -18.656  13.072  -2.238
  275    H    THR  40           HN       THR  40 -19.177  14.557   2.494
  276    HA   THR  40           HA       THR  40 -16.721  15.366   3.807
  277    HB   THR  40           HB       THR  40 -18.116  15.702   5.798
  278    HG1  THR  40           HG1      THR  40 -19.715  14.235   5.753
  279   HG21  THR  40          HG23      THR  40 -19.541  17.484   4.929
  280   HG22  THR  40          HG21      THR  40 -19.392  16.825   3.300
  281   HG23  THR  40          HG22      THR  40 -17.976  17.490   4.116
  282    H    GLY  41           HN       GLY  41 -17.970  12.458   2.980
  283    HA2  GLY  41           HA2      GLY  41 -17.586  11.010   5.437
  284    HA3  GLY  41           HA1      GLY  41 -17.860  10.314   3.846
  285    H    GLU  42           HN       GLU  42 -15.810  11.113   2.350
  286    HA   GLU  42           HA       GLU  42 -13.429  10.157   3.803
  287    HB2  GLU  42           HB2      GLU  42 -14.125   9.748   0.888
  288    HB3  GLU  42           HB1      GLU  42 -12.668   9.170   1.686
  289    HG2  GLU  42           HG2      GLU  42 -14.014   7.733   3.122
  290    HG3  GLU  42           HG1      GLU  42 -15.481   8.321   2.339
  291    H    ALA  43           HN       ALA  43 -11.458  11.164   3.397
  292    HA   ALA  43           HA       ALA  43 -11.387  13.391   1.519
  293    HB1  ALA  43           HB3      ALA  43 -12.227  14.370   3.604
  294    HB2  ALA  43           HB1      ALA  43 -10.631  14.991   3.182
  295    HB3  ALA  43           HB2      ALA  43 -10.798  13.778   4.451
  296    H    THR  44           HN       THR  44  -9.566  13.292   0.430
  297    HA   THR  44           HA       THR  44  -7.468  12.723  -0.234
  298    HB   THR  44           HB       THR  44  -5.645  13.334   1.231
  299    HG1  THR  44           HG1      THR  44  -6.177  12.537   3.210
  300   HG21  THR  44          HG23      THR  44  -6.306  15.626   1.802
  301   HG22  THR  44          HG21      THR  44  -8.002  15.186   1.599
  302   HG23  THR  44          HG22      THR  44  -6.912  15.157   0.213
  303    H    GLY  45           HN       GLY  45  -5.325  11.488   0.818
  304    HA2  GLY  45           HA2      GLY  45  -5.169   9.436   2.411
  305    HA3  GLY  45           HA1      GLY  45  -6.372   8.789   1.308
  306    H    ILE  46           HN       ILE  46  -3.609   7.924   1.952
  307    HA   ILE  46           HA       ILE  46  -2.294   8.256  -0.647
  308    HB   ILE  46           HB       ILE  46  -1.324   7.482   2.075
  309   HG12  ILE  46          HG12      ILE  46   0.480   9.092   1.472
  310   HG13  ILE  46          HG11      ILE  46  -0.313   9.351  -0.078
  311   HG21  ILE  46          HG21      ILE  46   0.831   6.763   1.101
  312   HG22  ILE  46          HG22      ILE  46   0.083   6.787  -0.497
  313   HG23  ILE  46          HG23      ILE  46  -0.500   5.666   0.734
  314   HD11  ILE  46          HD13      ILE  46  -2.278  10.223   1.083
  315   HD12  ILE  46          HD11      ILE  46  -0.821  11.138   1.470
  316   HD13  ILE  46          HD12      ILE  46  -1.466   9.975   2.629
  317    H    TYR  47           HN       TYR  47  -2.462   6.711  -2.127
  318    HA   TYR  47           HA       TYR  47  -2.648   3.917  -1.308
  319    HD1  TYR  47           HD1      TYR  47  -5.186   7.082  -2.333
  320    HD2  TYR  47           HD2      TYR  47  -4.636   3.843  -5.038
  321    HE1  TYR  47           HE1      TYR  47  -5.947   8.508  -4.189
  322    HE2  TYR  47           HE2      TYR  47  -5.394   5.260  -6.899
  323    HH   TYR  47           HH       TYR  47  -6.730   7.263  -7.263
  324    HB2  TYR  47           HB2      TYR  47  -4.581   3.457  -2.687
  325    HB3  TYR  47           HB1      TYR  47  -4.985   4.729  -1.542
  326    H    VAL  48           HN       VAL  48  -2.090   2.420  -2.970
  327    HA   VAL  48           HA       VAL  48  -0.202   3.520  -4.868
  328    HB   VAL  48           HB       VAL  48  -0.957   0.650  -4.291
  329   HG11  VAL  48          HG11      VAL  48   1.088   0.077  -5.545
  330   HG12  VAL  48          HG12      VAL  48   1.267   1.773  -5.994
  331   HG13  VAL  48          HG13      VAL  48  -0.128   0.854  -6.559
  332   HG21  VAL  48          HG23      VAL  48   0.143   1.797  -2.424
  333   HG22  VAL  48          HG21      VAL  48   1.478   2.240  -3.489
  334   HG23  VAL  48          HG22      VAL  48   1.171   0.543  -3.118
  335    H    LYS  49           HN       LYS  49  -0.591   3.920  -6.933
  336    HA   LYS  49           HA       LYS  49  -3.057   2.852  -8.129
  337    HB2  LYS  49           HB2      LYS  49  -3.023   5.277  -8.011
  338    HB3  LYS  49           HB1      LYS  49  -1.461   5.326  -8.817
  339    HG2  LYS  49           HG2      LYS  49  -2.491   4.373 -10.834
  340    HG3  LYS  49           HG1      LYS  49  -4.058   4.389 -10.023
  341    HD2  LYS  49           HD2      LYS  49  -2.361   6.840 -10.483
  342    HD3  LYS  49           HD1      LYS  49  -3.670   6.326 -11.550
  343    HE2  LYS  49           HE2      LYS  49  -5.250   6.508  -9.685
  344    HE3  LYS  49           HE1      LYS  49  -3.940   7.031  -8.628
  345    HZ1  LYS  49           HZ3      LYS  49  -4.850   8.470 -11.061
  346    HZ2  LYS  49           HZ1      LYS  49  -3.638   8.981  -9.998
  347    HZ3  LYS  49           HZ2      LYS  49  -5.244   8.897  -9.474
  348    H    SER  50           HN       SER  50   0.403   3.050  -8.459
  349    HA   SER  50           HA       SER  50   0.272   1.108 -10.626
  350    HG   SER  50           HG       SER  50  -0.543   3.677 -11.373
  351    HB2  SER  50           HB2      SER  50   1.775   3.721 -10.889
  352    HB3  SER  50           HB1      SER  50   1.888   2.368 -12.015
  353    H    LEU  51           HN       LEU  51   2.569   0.404 -11.243
  354    HA   LEU  51           HA       LEU  51   4.330   0.392  -8.888
  355    HG   LEU  51           HG       LEU  51   1.920  -1.421  -8.694
  356    HB2  LEU  51           HB2      LEU  51   3.498  -1.992 -10.540
  357    HB3  LEU  51           HB1      LEU  51   4.802  -2.016  -9.370
  358   HD11  LEU  51          HD11      LEU  51   2.139  -3.710  -9.453
  359   HD12  LEU  51          HD12      LEU  51   1.914  -3.672  -7.703
  360   HD13  LEU  51          HD13      LEU  51   3.518  -3.959  -8.382
  361   HD21  LEU  51          HD23      LEU  51   4.332  -1.951  -6.961
  362   HD22  LEU  51          HD21      LEU  51   2.676  -1.775  -6.383
  363   HD23  LEU  51          HD22      LEU  51   3.493  -0.410  -7.144
  364    H    ILE  52           HN       ILE  52   6.548  -0.419  -9.436
  365    HA   ILE  52           HA       ILE  52   7.334   0.604 -12.079
  366    HB   ILE  52           HB       ILE  52   9.082   0.215  -9.650
  367   HG12  ILE  52          HG12      ILE  52   7.423   1.929  -9.179
  368   HG13  ILE  52          HG11      ILE  52   8.993   2.683  -9.435
  369   HG21  ILE  52          HG21      ILE  52  10.670   1.632 -10.873
  370   HG22  ILE  52          HG22      ILE  52   9.573   1.651 -12.253
  371   HG23  ILE  52          HG23      ILE  52  10.312   0.135 -11.735
  372   HD11  ILE  52          HD13      ILE  52   6.751   2.547 -11.438
  373   HD12  ILE  52          HD11      ILE  52   8.326   3.296 -11.701
  374   HD13  ILE  52          HD12      ILE  52   7.225   3.958 -10.492
  375    HA   PRO  53           HA       PRO  53   7.921  -3.838 -12.946
  376    HB2  PRO  53           HB2      PRO  53   8.947  -2.626 -15.462
  377    HB3  PRO  53           HB1      PRO  53   7.789  -3.941 -15.237
  378    HG2  PRO  53           HG2      PRO  53   6.970  -1.515 -15.971
  379    HG3  PRO  53           HG1      PRO  53   6.023  -2.494 -14.835
  380    HD2  PRO  53           HD2      PRO  53   7.792  -0.147 -14.303
  381    HD3  PRO  53           HD1      PRO  53   6.262  -0.608 -13.527
  382    H    GLY  54           HN       GLY  54   9.667  -4.977 -12.388
  383    HA2  GLY  54           HA2      GLY  54  11.941  -5.621 -12.640
  384    HA3  GLY  54           HA1      GLY  54  12.325  -3.977 -13.120
  385    H    SER  55           HN       SER  55  10.331  -3.707 -10.524
  386    HA   SER  55           HA       SER  55  12.616  -3.348  -8.724
  387    HG   SER  55           HG       SER  55  12.191  -1.742  -7.049
  388    HB2  SER  55           HB2      SER  55  11.132  -1.399  -9.113
  389    HB3  SER  55           HB1      SER  55   9.785  -2.316  -8.438
  390    H    ALA  56           HN       ALA  56  12.043  -3.711  -6.332
  391    HA   ALA  56           HA       ALA  56  11.715  -6.404  -5.845
  392    HB1  ALA  56           HB3      ALA  56  11.102  -4.153  -3.935
  393    HB2  ALA  56           HB1      ALA  56  12.702  -4.827  -4.250
  394    HB3  ALA  56           HB2      ALA  56  11.458  -5.825  -3.500
  395    H    ALA  57           HN       ALA  57   9.272  -3.883  -5.186
  396    HA   ALA  57           HA       ALA  57   7.194  -5.579  -4.455
  397    HB1  ALA  57           HB3      ALA  57   6.972  -2.909  -5.836
  398    HB2  ALA  57           HB1      ALA  57   7.160  -3.160  -4.100
  399    HB3  ALA  57           HB2      ALA  57   5.701  -3.718  -4.919
  400    H    ALA  58           HN       ALA  58   8.322  -4.637  -7.639
  401    HA   ALA  58           HA       ALA  58   6.037  -5.651  -9.040
  402    HB1  ALA  58           HB3      ALA  58   8.784  -4.981 -10.086
  403    HB2  ALA  58           HB1      ALA  58   7.426  -3.862  -9.969
  404    HB3  ALA  58           HB2      ALA  58   7.336  -5.247 -11.056
  405    H    LEU  59           HN       LEU  59   8.985  -6.998  -7.829
  406    HA   LEU  59           HA       LEU  59   9.035  -9.287  -9.545
  407    HG   LEU  59           HG       LEU  59  11.252  -7.434  -8.935
  408    HB2  LEU  59           HB2      LEU  59  10.409  -8.669  -6.936
  409    HB3  LEU  59           HB1      LEU  59  10.649 -10.170  -7.809
  410   HD11  LEU  59          HD11      LEU  59  12.722  -7.932  -7.060
  411   HD12  LEU  59          HD12      LEU  59  13.602  -8.012  -8.587
  412   HD13  LEU  59          HD13      LEU  59  13.115  -9.498  -7.769
  413   HD21  LEU  59          HD23      LEU  59  12.461  -8.699 -10.651
  414   HD22  LEU  59          HD21      LEU  59  10.743  -9.096 -10.637
  415   HD23  LEU  59          HD22      LEU  59  11.912 -10.207  -9.922
  416    H    ASP  60           HN       ASP  60   7.743  -8.584  -6.340
  417    HA   ASP  60           HA       ASP  60   7.114 -11.174  -5.528
  418    HB2  ASP  60           HB2      ASP  60   5.733  -8.550  -4.949
  419    HB3  ASP  60           HB1      ASP  60   5.314 -10.062  -4.150
  420    H    GLY  61           HN       GLY  61   5.169  -8.863  -7.397
  421    HA2  GLY  61           HA2      GLY  61   3.611  -9.334  -9.057
  422    HA3  GLY  61           HA1      GLY  61   3.810 -11.047  -8.720
  423    H    ARG  62           HN       ARG  62   3.269 -10.824  -5.888
  424    HA   ARG  62           HA       ARG  62   0.465 -11.128  -5.943
  425    HE   ARG  62           HE       ARG  62   3.700 -12.255  -2.641
  426    HB2  ARG  62           HB2      ARG  62   2.401 -10.841  -3.646
  427    HB3  ARG  62           HB1      ARG  62   0.689 -11.181  -3.430
  428    HG2  ARG  62           HG2      ARG  62   0.964 -13.235  -4.772
  429    HG3  ARG  62           HG1      ARG  62   2.695 -12.905  -4.869
  430    HD2  ARG  62           HD2      ARG  62   1.169 -13.248  -2.291
  431    HD3  ARG  62           HD1      ARG  62   2.062 -14.538  -3.095
  432   HH11  ARG  62          HH11      ARG  62   2.299 -15.034  -1.070
  433   HH12  ARG  62          HH12      ARG  62   3.539 -15.139   0.135
  434   HH21  ARG  62          HH21      ARG  62   5.338 -12.388  -1.057
  435   HH22  ARG  62          HH22      ARG  62   5.264 -13.635   0.143
  436    H    ILE  63           HN       ILE  63   2.450  -8.360  -5.634
  437    HA   ILE  63           HA       ILE  63   0.437  -6.770  -4.274
  438    HB   ILE  63           HB       ILE  63   3.059  -5.905  -5.501
  439   HG12  ILE  63          HG12      ILE  63   2.368  -6.462  -2.606
  440   HG13  ILE  63          HG11      ILE  63   3.288  -7.547  -3.644
  441   HG21  ILE  63          HG21      ILE  63   1.204  -4.474  -3.600
  442   HG22  ILE  63          HG22      ILE  63   1.466  -4.072  -5.296
  443   HG23  ILE  63          HG23      ILE  63   2.780  -3.889  -4.134
  444   HD11  ILE  63          HD13      ILE  63   4.742  -6.269  -2.179
  445   HD12  ILE  63          HD11      ILE  63   4.104  -4.764  -2.841
  446   HD13  ILE  63          HD12      ILE  63   5.029  -5.858  -3.870
  447    H    GLU  64           HN       GLU  64  -1.283  -6.185  -5.423
  448    HA   GLU  64           HA       GLU  64  -1.133  -5.780  -8.278
  449    HB2  GLU  64           HB2      GLU  64  -3.088  -6.868  -7.194
  450    HB3  GLU  64           HB1      GLU  64  -3.456  -5.351  -6.386
  451    HG2  GLU  64           HG2      GLU  64  -3.855  -4.279  -8.519
  452    HG3  GLU  64           HG1      GLU  64  -3.404  -5.756  -9.368
  453    HA   PRO  65           HA       PRO  65  -0.411  -1.398  -7.939
  454    HB2  PRO  65           HB2      PRO  65  -0.863  -0.670 -10.486
  455    HB3  PRO  65           HB1      PRO  65   0.552  -1.626 -10.029
  456    HG2  PRO  65           HG2      PRO  65  -2.038  -2.533 -11.230
  457    HG3  PRO  65           HG1      PRO  65  -0.383  -3.011 -11.653
  458    HD2  PRO  65           HD2      PRO  65  -2.015  -4.512 -10.067
  459    HD3  PRO  65           HD1      PRO  65  -0.246  -4.520  -9.928
  460    H    ASN  66           HN       ASN  66  -2.809  -1.991  -6.811
  461    HA   ASN  66           HA       ASN  66  -4.323   0.342  -7.229
  462    HB2  ASN  66           HB2      ASN  66  -5.051  -0.863  -9.265
  463    HB3  ASN  66           HB1      ASN  66  -5.617  -2.194  -8.263
  464   HD21  ASN  66          HD21      ASN  66  -5.906   1.198  -7.442
  465   HD22  ASN  66          HD22      ASN  66  -7.628   1.273  -7.552
  466    H    ASP  67           HN       ASP  67  -3.633   0.025  -4.937
  467    HA   ASP  67           HA       ASP  67  -5.830  -1.186  -3.443
  468    HB2  ASP  67           HB2      ASP  67  -4.297  -2.293  -1.868
  469    HB3  ASP  67           HB1      ASP  67  -4.124  -2.941  -3.496
  470    H    LYS  68           HN       LYS  68  -5.605  -0.612  -1.039
  471    HA   LYS  68           HA       LYS  68  -4.657   2.171  -0.864
  472    HB2  LYS  68           HB2      LYS  68  -7.082   1.937  -0.633
  473    HB3  LYS  68           HB1      LYS  68  -6.858   0.791   0.682
  474    HG2  LYS  68           HG2      LYS  68  -5.821   2.538   2.036
  475    HG3  LYS  68           HG1      LYS  68  -6.031   3.688   0.713
  476    HD2  LYS  68           HD2      LYS  68  -8.444   3.453   0.857
  477    HD3  LYS  68           HD1      LYS  68  -8.271   2.227   2.116
  478    HE2  LYS  68           HE2      LYS  68  -7.217   3.882   3.578
  479    HE3  LYS  68           HE1      LYS  68  -7.390   5.106   2.320
  480    HZ1  LYS  68           HZ3      LYS  68  -9.628   3.677   3.652
  481    HZ2  LYS  68           HZ1      LYS  68  -9.785   4.870   2.462
  482    HZ3  LYS  68           HZ2      LYS  68  -9.145   5.264   3.978
  483    H    ILE  69           HN       ILE  69  -2.731   2.210   0.104
  484    HA   ILE  69           HA       ILE  69  -1.756   0.268   1.891
  485    HB   ILE  69           HB       ILE  69  -0.839   3.136   1.633
  486   HG12  ILE  69          HG12      ILE  69  -0.849   2.017  -0.547
  487   HG13  ILE  69          HG11      ILE  69   0.800   2.277   0.012
  488   HG21  ILE  69          HG21      ILE  69   1.310   2.287   2.443
  489   HG22  ILE  69          HG22      ILE  69   0.599   0.685   2.641
  490   HG23  ILE  69          HG23      ILE  69   0.023   2.033   3.622
  491   HD11  ILE  69          HD13      ILE  69   0.548   0.091  -1.009
  492   HD12  ILE  69          HD11      ILE  69  -0.720  -0.317   0.146
  493   HD13  ILE  69          HD12      ILE  69   0.933  -0.060   0.705
  494    H    LEU  70           HN       LEU  70  -1.610   0.208   4.115
  495    HA   LEU  70           HA       LEU  70  -3.198   2.223   5.565
  496    HG   LEU  70           HG       LEU  70  -4.607  -0.151   4.291
  497    HB2  LEU  70           HB2      LEU  70  -2.997  -0.740   6.105
  498    HB3  LEU  70           HB1      LEU  70  -3.810   0.410   7.149
  499   HD11  LEU  70          HD11      LEU  70  -4.967  -2.117   5.670
  500   HD12  LEU  70          HD12      LEU  70  -6.507  -1.355   5.269
  501   HD13  LEU  70          HD13      LEU  70  -5.808  -1.140   6.874
  502   HD21  LEU  70          HD23      LEU  70  -5.985   1.390   6.489
  503   HD22  LEU  70          HD21      LEU  70  -6.644   1.062   4.886
  504   HD23  LEU  70          HD22      LEU  70  -5.216   2.082   5.061
  505    H    ARG  71           HN       ARG  71  -0.807  -0.359   6.187
  506    HA   ARG  71           HA       ARG  71   0.764   1.557   7.743
  507    HE   ARG  71           HE       ARG  71   0.546   0.241  11.623
  508    HB2  ARG  71           HB2      ARG  71  -0.090  -1.145   8.792
  509    HB3  ARG  71           HB1      ARG  71   1.021  -0.043   9.592
  510    HG2  ARG  71           HG2      ARG  71  -0.739   1.582   9.882
  511    HG3  ARG  71           HG1      ARG  71  -1.861   0.570   8.972
  512    HD2  ARG  71           HD2      ARG  71  -2.231   0.348  11.370
  513    HD3  ARG  71           HD1      ARG  71  -1.678  -1.172  10.671
  514   HH11  ARG  71          HH11      ARG  71  -2.276  -1.414  12.821
  515   HH12  ARG  71          HH12      ARG  71  -1.540  -1.851  14.325
  516   HH21  ARG  71          HH21      ARG  71   1.527  -0.334  13.600
  517   HH22  ARG  71          HH22      ARG  71   0.621  -1.236  14.770
  518    H    VAL  72           HN       VAL  72   2.929   1.232   7.691
  519    HA   VAL  72           HA       VAL  72   3.900  -0.946   5.974
  520    HB   VAL  72           HB       VAL  72   5.509   1.453   6.833
  521   HG11  VAL  72          HG11      VAL  72   6.804  -0.307   5.842
  522   HG12  VAL  72          HG12      VAL  72   6.676   1.014   4.682
  523   HG13  VAL  72          HG13      VAL  72   5.683  -0.431   4.487
  524   HG21  VAL  72          HG23      VAL  72   3.468   2.323   5.845
  525   HG22  VAL  72          HG21      VAL  72   3.679   1.274   4.443
  526   HG23  VAL  72          HG22      VAL  72   4.831   2.571   4.755
  527    H    ASP  73           HN       ASP  73   6.264  -1.616   6.632
  528    HA   ASP  73           HA       ASP  73   6.246  -3.045   8.958
  529    HB2  ASP  73           HB2      ASP  73   7.944  -3.147   7.079
  530    HB3  ASP  73           HB1      ASP  73   8.757  -1.790   7.850
  531    H    ASP  74           HN       ASP  74   5.805  -2.299  10.938
  532    HA   ASP  74           HA       ASP  74   5.874  -1.085  12.859
  533    HB2  ASP  74           HB2      ASP  74   8.703  -0.577  11.920
  534    HB3  ASP  74           HB1      ASP  74   8.109  -0.245  13.544
  535    H    VAL  75           HN       VAL  75   4.948   0.273  10.456
  536    HA   VAL  75           HA       VAL  75   5.189   3.011  11.430
  537    HB   VAL  75           HB       VAL  75   5.699   2.275   8.540
  538   HG11  VAL  75          HG11      VAL  75   4.395   4.313   8.686
  539   HG12  VAL  75          HG12      VAL  75   6.050   4.688   8.204
  540   HG13  VAL  75          HG13      VAL  75   5.526   4.979   9.863
  541   HG21  VAL  75          HG23      VAL  75   7.639   1.879   9.959
  542   HG22  VAL  75          HG21      VAL  75   7.516   3.516  10.603
  543   HG23  VAL  75          HG22      VAL  75   7.911   3.265   8.903
  544    H    ASN  76           HN       ASN  76   3.426   4.331  10.923
  545    HA   ASN  76           HA       ASN  76   1.133   2.952   9.682
  546    HB2  ASN  76           HB2      ASN  76   0.712   3.162  12.044
  547    HB3  ASN  76           HB1      ASN  76   1.182   4.860  12.029
  548   HD21  ASN  76          HD21      ASN  76  -1.281   2.556  11.204
  549   HD22  ASN  76          HD22      ASN  76  -2.542   3.702  10.920
  550    H    VAL  77           HN       VAL  77   0.528   3.865   7.825
  551    HA   VAL  77           HA       VAL  77   1.235   6.676   7.349
  552    HB   VAL  77           HB       VAL  77   0.951   6.223   4.977
  553   HG11  VAL  77          HG11      VAL  77   3.129   5.798   5.964
  554   HG12  VAL  77          HG12      VAL  77   2.804   4.646   4.670
  555   HG13  VAL  77          HG13      VAL  77   2.650   4.147   6.354
  556   HG21  VAL  77          HG23      VAL  77  -0.858   4.576   5.142
  557   HG22  VAL  77          HG21      VAL  77   0.276   3.398   5.802
  558   HG23  VAL  77          HG22      VAL  77   0.470   3.981   4.148
  559    H    GLN  78           HN       GLN  78  -1.121   5.694   8.892
  560    HA   GLN  78           HA       GLN  78  -3.357   6.490   7.201
  561    HB2  GLN  78           HB2      GLN  78  -3.217   5.425  10.023
  562    HB3  GLN  78           HB1      GLN  78  -4.717   5.919   9.248
  563    HG2  GLN  78           HG2      GLN  78  -2.875   3.763   8.240
  564    HG3  GLN  78           HG1      GLN  78  -4.349   3.492   9.170
  565   HE21  GLN  78          HE21      GLN  78  -3.023   4.476   6.109
  566   HE22  GLN  78          HE22      GLN  78  -4.491   4.361   5.206
  567    H    GLY  79           HN       GLY  79  -1.541   8.544   7.628
  568    HA2  GLY  79           HA2      GLY  79  -3.019  10.723   8.210
  569    HA3  GLY  79           HA1      GLY  79  -2.490  10.204   9.801
  570    H    MET  80           HN       MET  80  -0.614   9.967   6.814
  571    HA   MET  80           HA       MET  80   1.145  12.105   7.810
  572    HB2  MET  80           HB2      MET  80   2.033   9.432   6.713
  573    HB3  MET  80           HB1      MET  80   3.106  10.778   7.069
  574    HG2  MET  80           HG2      MET  80   2.233  10.655   9.445
  575    HG3  MET  80           HG1      MET  80   1.515   9.111   8.988
  576    HE1  MET  80           HE3      MET  80   3.854   8.116   6.883
  577    HE2  MET  80           HE1      MET  80   2.959   7.088   8.001
  578    HE3  MET  80           HE2      MET  80   4.722   7.050   7.987
  579    H    ALA  81           HN       ALA  81   2.204  13.327   6.249
  580    HA   ALA  81           HA       ALA  81   0.852  13.822   3.875
  581    HB1  ALA  81           HB3      ALA  81   3.740  14.438   4.497
  582    HB2  ALA  81           HB1      ALA  81   2.355  15.435   4.941
  583    HB3  ALA  81           HB2      ALA  81   2.761  15.197   3.240
  584    H    GLN  82           HN       GLN  82   1.147  13.239   1.747
  585    HA   GLN  82           HA       GLN  82   1.859  10.671   1.108
  586    HB2  GLN  82           HB2      GLN  82   0.589  12.234  -0.354
  587    HB3  GLN  82           HB1      GLN  82   2.096  13.054  -0.737
  588    HG2  GLN  82           HG2      GLN  82   2.965  11.015  -1.744
  589    HG3  GLN  82           HG1      GLN  82   1.471  10.171  -1.337
  590   HE21  GLN  82          HE21      GLN  82   2.675  10.611  -3.942
  591   HE22  GLN  82          HE22      GLN  82   1.502  11.464  -4.879
  592    H    SER  83           HN       SER  83   3.872  13.565   0.595
  593    HA   SER  83           HA       SER  83   6.136  12.319  -0.396
  594    HG   SER  83           HG       SER  83   5.160  15.637  -0.366
  595    HB2  SER  83           HB2      SER  83   5.977  14.782   1.358
  596    HB3  SER  83           HB1      SER  83   7.375  14.312   0.392
  597    H    ASP  84           HN       ASP  84   5.213  12.919   2.968
  598    HA   ASP  84           HA       ASP  84   7.557  12.050   4.205
  599    HB2  ASP  84           HB2      ASP  84   5.751  13.224   5.394
  600    HB3  ASP  84           HB1      ASP  84   4.716  11.811   5.217
  601    H    VAL  85           HN       VAL  85   4.689  10.222   3.210
  602    HA   VAL  85           HA       VAL  85   5.386   7.744   4.293
  603    HB   VAL  85           HB       VAL  85   3.875   8.234   1.721
  604   HG11  VAL  85          HG11      VAL  85   4.563   5.921   1.940
  605   HG12  VAL  85          HG12      VAL  85   2.825   6.058   2.212
  606   HG13  VAL  85          HG13      VAL  85   3.920   5.860   3.581
  607   HG21  VAL  85          HG23      VAL  85   1.858   8.132   3.100
  608   HG22  VAL  85          HG21      VAL  85   2.900   9.472   3.583
  609   HG23  VAL  85          HG22      VAL  85   2.855   7.998   4.549
  610    H    VAL  86           HN       VAL  86   6.217   9.214   1.183
  611    HA   VAL  86           HA       VAL  86   7.513   6.997   0.049
  612    HB   VAL  86           HB       VAL  86   8.176   9.908  -0.420
  613   HG11  VAL  86          HG11      VAL  86   8.572   7.477  -2.162
  614   HG12  VAL  86          HG12      VAL  86   9.840   8.361  -1.313
  615   HG13  VAL  86          HG13      VAL  86   8.939   9.142  -2.613
  616   HG21  VAL  86          HG23      VAL  86   6.568   9.800  -2.264
  617   HG22  VAL  86          HG21      VAL  86   5.788   9.505  -0.710
  618   HG23  VAL  86          HG22      VAL  86   6.137   8.157  -1.792
  619    H    GLU  87           HN       GLU  87   8.656   9.538   2.208
  620    HA   GLU  87           HA       GLU  87  11.400   9.032   2.062
  621    HB2  GLU  87           HB2      GLU  87   9.787   9.995   4.431
  622    HB3  GLU  87           HB1      GLU  87  11.536  10.099   4.286
  623    HG2  GLU  87           HG2      GLU  87  11.239  11.535   2.293
  624    HG3  GLU  87           HG1      GLU  87   9.499  11.500   2.571
  625    H    VAL  88           HN       VAL  88   8.953   7.710   4.276
  626    HA   VAL  88           HA       VAL  88  10.581   6.101   5.838
  627    HB   VAL  88           HB       VAL  88   7.739   5.637   4.930
  628   HG11  VAL  88          HG11      VAL  88   7.557   4.023   6.769
  629   HG12  VAL  88          HG12      VAL  88   9.286   4.189   7.078
  630   HG13  VAL  88          HG13      VAL  88   8.726   3.502   5.552
  631   HG21  VAL  88          HG23      VAL  88   8.893   6.708   7.503
  632   HG22  VAL  88          HG21      VAL  88   7.181   6.413   7.194
  633   HG23  VAL  88          HG22      VAL  88   8.046   7.639   6.267
  634    H    LEU  89           HN       LEU  89   8.808   5.166   2.894
  635    HA   LEU  89           HA       LEU  89   9.760   2.547   2.747
  636    HG   LEU  89           HG       LEU  89   7.108   3.891   2.236
  637    HB2  LEU  89           HB2      LEU  89   8.868   4.398   0.537
  638    HB3  LEU  89           HB1      LEU  89   9.119   2.674   0.343
  639   HD11  LEU  89          HD11      LEU  89   5.422   3.192   0.611
  640   HD12  LEU  89          HD12      LEU  89   6.697   2.692  -0.498
  641   HD13  LEU  89          HD13      LEU  89   6.517   4.393  -0.071
  642   HD21  LEU  89          HD23      LEU  89   6.208   1.615   2.325
  643   HD22  LEU  89          HD21      LEU  89   7.871   1.681   2.908
  644   HD23  LEU  89          HD22      LEU  89   7.527   1.056   1.295
  645    H    ARG  90           HN       ARG  90  11.218   5.560   1.756
  646    HA   ARG  90           HA       ARG  90  13.309   4.245   0.235
  647    HE   ARG  90           HE       ARG  90  11.656   8.638   0.129
  648    HB2  ARG  90           HB2      ARG  90  12.841   7.138   0.963
  649    HB3  ARG  90           HB1      ARG  90  14.224   6.584   0.033
  650    HG2  ARG  90           HG2      ARG  90  12.727   5.736  -1.698
  651    HG3  ARG  90           HG1      ARG  90  11.335   6.283  -0.763
  652    HD2  ARG  90           HD2      ARG  90  13.519   8.031  -1.894
  653    HD3  ARG  90           HD1      ARG  90  11.882   7.874  -2.528
  654   HH11  ARG  90          HH11      ARG  90  12.963   9.936  -2.829
  655   HH12  ARG  90          HH12      ARG  90  12.694  11.586  -2.375
  656   HH21  ARG  90          HH21      ARG  90  11.300  10.807   0.735
  657   HH22  ARG  90          HH22      ARG  90  11.748  12.081  -0.350
  658    H    ASN  91           HN       ASN  91  12.728   4.943   3.474
  659    HA   ASN  91           HA       ASN  91  15.579   5.115   4.130
  660    HB2  ASN  91           HB2      ASN  91  13.113   5.547   5.826
  661    HB3  ASN  91           HB1      ASN  91  14.760   5.608   6.446
  662   HD21  ASN  91          HD21      ASN  91  12.738   7.685   6.390
  663   HD22  ASN  91          HD22      ASN  91  13.418   9.002   5.502
  664    H    ALA  92           HN       ALA  92  13.109   2.843   3.875
  665    HA   ALA  92           HA       ALA  92  13.463   1.110   5.992
  666    HB1  ALA  92           HB3      ALA  92  12.969   0.346   3.116
  667    HB2  ALA  92           HB1      ALA  92  11.735   0.848   4.273
  668    HB3  ALA  92           HB2      ALA  92  12.633  -0.648   4.533
  669    H    GLY  93           HN       GLY  93  14.744   0.043   2.874
  670    HA2  GLY  93           HA2      GLY  93  16.761  -0.905   2.297
  671    HA3  GLY  93           HA1      GLY  93  17.473  -0.020   3.638
  672    H    ASN  94           HN       ASN  94  14.842  -2.035   4.428
  673    HA   ASN  94           HA       ASN  94  16.510  -4.336   5.085
  674    HB2  ASN  94           HB2      ASN  94  15.777  -4.322   7.439
  675    HB3  ASN  94           HB1      ASN  94  16.684  -2.863   7.050
  676   HD21  ASN  94          HD21      ASN  94  13.450  -4.169   7.459
  677   HD22  ASN  94          HD22      ASN  94  12.699  -2.674   7.884
  678    HA   PRO  95           HA       PRO  95  12.868  -6.768   4.329
  679    HB2  PRO  95           HB2      PRO  95  12.931  -7.878   7.082
  680    HB3  PRO  95           HB1      PRO  95  12.968  -8.721   5.530
  681    HG2  PRO  95           HG2      PRO  95  15.164  -8.519   7.028
  682    HG3  PRO  95           HG1      PRO  95  15.248  -8.399   5.260
  683    HD2  PRO  95           HD2      PRO  95  15.371  -6.231   7.318
  684    HD3  PRO  95           HD1      PRO  95  16.279  -6.400   5.801
  685    H    VAL  96           HN       VAL  96  11.176  -5.353   4.192
  686    HA   VAL  96           HA       VAL  96   9.853  -4.572   6.705
  687    HB   VAL  96           HB       VAL  96   8.804  -2.743   5.368
  688   HG11  VAL  96          HG11      VAL  96  10.729  -2.303   6.779
  689   HG12  VAL  96          HG12      VAL  96  10.816  -1.335   5.308
  690   HG13  VAL  96          HG13      VAL  96  11.818  -2.777   5.476
  691   HG21  VAL  96          HG23      VAL  96   9.038  -3.740   3.152
  692   HG22  VAL  96          HG21      VAL  96  10.793  -3.606   3.269
  693   HG23  VAL  96          HG22      VAL  96   9.800  -2.150   3.212
  694    H    ARG  97           HN       ARG  97   7.587  -4.584   6.822
  695    HA   ARG  97           HA       ARG  97   6.307  -6.519   5.032
  696    HE   ARG  97           HE       ARG  97   1.938  -8.046   7.174
  697    HB2  ARG  97           HB2      ARG  97   6.277  -7.149   7.387
  698    HB3  ARG  97           HB1      ARG  97   5.560  -5.603   7.818
  699    HG2  ARG  97           HG2      ARG  97   3.545  -6.192   6.562
  700    HG3  ARG  97           HG1      ARG  97   4.266  -7.746   6.143
  701    HD2  ARG  97           HD2      ARG  97   4.361  -8.362   8.488
  702    HD3  ARG  97           HD1      ARG  97   3.727  -6.784   8.950
  703   HH11  ARG  97          HH11      ARG  97   3.094  -8.251  10.457
  704   HH12  ARG  97          HH12      ARG  97   1.629  -8.947  11.064
  705   HH21  ARG  97          HH21      ARG  97   0.006  -8.960   7.968
  706   HH22  ARG  97          HH22      ARG  97  -0.124  -9.349   9.651
  707    H    LEU  98           HN       LEU  98   4.340  -6.050   4.059
  708    HA   LEU  98           HA       LEU  98   3.588  -3.201   4.083
  709    HG   LEU  98           HG       LEU  98   5.537  -4.961   2.125
  710    HB2  LEU  98           HB2      LEU  98   3.068  -5.120   1.829
  711    HB3  LEU  98           HB1      LEU  98   2.992  -3.371   1.798
  712   HD11  LEU  98          HD11      LEU  98   6.008  -4.353  -0.184
  713   HD12  LEU  98          HD12      LEU  98   4.433  -3.569  -0.311
  714   HD13  LEU  98          HD13      LEU  98   4.534  -5.315  -0.077
  715   HD21  LEU  98          HD23      LEU  98   5.661  -2.743   3.113
  716   HD22  LEU  98          HD21      LEU  98   5.054  -2.027   1.620
  717   HD23  LEU  98          HD22      LEU  98   6.629  -2.821   1.639
  718    H    LEU  99           HN       LEU  99   1.736  -2.872   5.138
  719    HA   LEU  99           HA       LEU  99  -0.324  -4.971   5.080
  720    HG   LEU  99           HG       LEU  99  -2.385  -3.468   6.735
  721    HB2  LEU  99           HB2      LEU  99   0.468  -4.269   7.310
  722    HB3  LEU  99           HB1      LEU  99  -0.031  -2.625   6.960
  723   HD11  LEU  99          HD11      LEU  99  -1.205  -5.980   7.912
  724   HD12  LEU  99          HD12      LEU  99  -1.859  -5.811   6.283
  725   HD13  LEU  99          HD13      LEU  99  -2.922  -5.647   7.681
  726   HD21  LEU  99          HD23      LEU  99  -2.749  -3.669   9.149
  727   HD22  LEU  99          HD21      LEU  99  -1.624  -2.366   8.763
  728   HD23  LEU  99          HD22      LEU  99  -1.016  -3.900   9.386
  729    H    LEU 100           HN       LEU 100  -1.575  -4.602   3.335
  730    HA   LEU 100           HA       LEU 100  -2.836  -1.956   3.131
  731    HG   LEU 100           HG       LEU 100  -0.312  -3.904   1.506
  732    HB2  LEU 100           HB2      LEU 100  -2.863  -2.585   0.565
  733    HB3  LEU 100           HB1      LEU 100  -1.512  -1.741   1.296
  734   HD11  LEU 100          HD11      LEU 100  -1.132  -5.846   0.273
  735   HD12  LEU 100          HD12      LEU 100  -2.626  -4.983  -0.097
  736   HD13  LEU 100          HD13      LEU 100  -2.236  -5.395   1.573
  737   HD21  LEU 100          HD23      LEU 100  -1.220  -3.247  -1.292
  738   HD22  LEU 100          HD21      LEU 100   0.253  -4.107  -0.844
  739   HD23  LEU 100          HD22      LEU 100   0.054  -2.410  -0.406
  740    H    ILE 101           HN       ILE 101  -4.883  -1.974   1.922
  741    HA   ILE 101           HA       ILE 101  -6.328  -4.501   2.360
  742    HB   ILE 101           HB       ILE 101  -7.147  -2.673   3.749
  743   HG12  ILE 101          HG12      ILE 101  -9.099  -3.247   1.509
  744   HG13  ILE 101          HG11      ILE 101  -8.736  -4.364   2.820
  745   HG21  ILE 101          HG21      ILE 101  -7.670  -1.225   1.157
  746   HG22  ILE 101          HG22      ILE 101  -6.442  -0.808   2.351
  747   HG23  ILE 101          HG23      ILE 101  -8.151  -0.676   2.762
  748   HD11  ILE 101          HD13      ILE 101  -9.579  -2.719   4.431
  749   HD12  ILE 101          HD11      ILE 101 -10.800  -3.190   3.250
  750   HD13  ILE 101          HD12      ILE 101  -9.978  -1.637   3.096
  751    H    ARG 102           HN       ARG 102  -7.533  -5.392   0.746
  752    HA   ARG 102           HA       ARG 102  -7.709  -3.942  -1.806
  753    HE   ARG 102           HE       ARG 102  -7.323  -6.053  -6.111
  754    HB2  ARG 102           HB2      ARG 102  -5.815  -5.447  -2.020
  755    HB3  ARG 102           HB1      ARG 102  -6.782  -6.796  -1.444
  756    HG2  ARG 102           HG2      ARG 102  -6.511  -6.921  -3.838
  757    HG3  ARG 102           HG1      ARG 102  -8.202  -6.617  -3.436
  758    HD2  ARG 102           HD2      ARG 102  -7.827  -4.209  -3.878
  759    HD3  ARG 102           HD1      ARG 102  -6.179  -4.587  -4.377
  760   HH11  ARG 102          HH11      ARG 102  -8.722  -3.125  -4.841
  761   HH12  ARG 102          HH12      ARG 102  -9.660  -2.805  -6.262
  762   HH21  ARG 102          HH21      ARG 102  -8.557  -5.642  -7.983
  763   HH22  ARG 102          HH22      ARG 102  -9.570  -4.237  -8.046
  764    H    ARG 103           HN       ARG 103  -9.578  -4.223  -2.930
  765    HA   ARG 103           HA       ARG 103 -11.750  -5.529  -1.532
  766    HE   ARG 103           HE       ARG 103 -12.447  -0.560  -1.366
  767    HB2  ARG 103           HB2      ARG 103 -11.760  -3.975  -4.126
  768    HB3  ARG 103           HB1      ARG 103 -13.182  -4.490  -3.228
  769    HG2  ARG 103           HG2      ARG 103 -12.525  -3.071  -1.357
  770    HG3  ARG 103           HG1      ARG 103 -11.087  -2.563  -2.246
  771    HD2  ARG 103           HD2      ARG 103 -12.518  -1.611  -3.995
  772    HD3  ARG 103           HD1      ARG 103 -13.948  -2.104  -3.088
  773   HH11  ARG 103          HH11      ARG 103 -14.005  -0.136  -4.454
  774   HH12  ARG 103          HH12      ARG 103 -14.300   1.555  -4.217
  775   HH21  ARG 103          HH21      ARG 103 -12.831   1.665  -1.047
  776   HH22  ARG 103          HH22      ARG 103 -13.632   2.576  -2.283
  777    H    LEU 104           HN       LEU 104 -12.481  -7.501  -1.947
  778    HA   LEU 104           HA       LEU 104 -11.270  -9.201  -3.840
  779    HG   LEU 104           HG       LEU 104 -12.153  -9.210  -0.772
  780    HB2  LEU 104           HB2      LEU 104 -13.923  -9.581  -2.450
  781    HB3  LEU 104           HB1      LEU 104 -12.949 -10.836  -3.190
  782   HD11  LEU 104          HD11      LEU 104 -13.973 -10.746  -0.279
  783   HD12  LEU 104          HD12      LEU 104 -12.471 -11.297   0.460
  784   HD13  LEU 104          HD13      LEU 104 -13.067 -12.073  -1.007
  785   HD21  LEU 104          HD23      LEU 104 -10.310 -10.815  -0.591
  786   HD22  LEU 104          HD21      LEU 104 -10.227  -9.887  -2.088
  787   HD23  LEU 104          HD22      LEU 104 -10.808 -11.551  -2.115
  788    HA   PRO 105           HA       PRO 105 -13.721  -8.380  -7.444
  789    HB2  PRO 105           HB2      PRO 105 -13.207 -10.532  -8.916
  790    HB3  PRO 105           HB1      PRO 105 -11.895  -9.432  -8.462
  791    HG2  PRO 105           HG2      PRO 105 -12.716 -12.017  -7.172
  792    HG3  PRO 105           HG1      PRO 105 -11.091 -11.497  -7.668
  793    HD2  PRO 105           HD2      PRO 105 -12.003 -11.277  -5.113
  794    HD3  PRO 105           HD1      PRO 105 -10.833 -10.143  -5.819
  795    H    LEU 106           HN       LEU 106 -15.525  -8.870  -5.644
  796    HA   LEU 106           HA       LEU 106 -17.041 -11.272  -6.213
  797    HG   LEU 106           HG       LEU 106 -15.850 -10.528  -3.576
  798    HB2  LEU 106           HB2      LEU 106 -17.567  -8.921  -4.398
  799    HB3  LEU 106           HB1      LEU 106 -18.682 -10.260  -4.589
  800   HD11  LEU 106          HD11      LEU 106 -17.214  -9.265  -2.009
  801   HD12  LEU 106          HD12      LEU 106 -16.886 -10.880  -1.384
  802   HD13  LEU 106          HD13      LEU 106 -18.465 -10.506  -2.073
  803   HD21  LEU 106          HD23      LEU 106 -16.584 -12.774  -2.908
  804   HD22  LEU 106          HD21      LEU 106 -16.671 -12.545  -4.655
  805   HD23  LEU 106          HD22      LEU 106 -18.142 -12.487  -3.684
  806    H    LEU 107           HN       LEU 107 -18.410 -11.423  -7.849
  807    HA   LEU 107           HA       LEU 107 -19.331  -9.029  -9.211
  808    HG   LEU 107           HG       LEU 107 -18.378 -11.413 -11.902
  809    HB2  LEU 107           HB2      LEU 107 -19.515 -11.970  -9.819
  810    HB3  LEU 107           HB1      LEU 107 -20.416 -10.783 -10.742
  811   HD11  LEU 107          HD11      LEU 107 -19.281  -9.110 -12.070
  812   HD12  LEU 107          HD12      LEU 107 -17.548  -9.220 -12.376
  813   HD13  LEU 107          HD13      LEU 107 -18.134  -8.612 -10.827
  814   HD21  LEU 107          HD23      LEU 107 -16.914 -10.319  -9.504
  815   HD22  LEU 107          HD21      LEU 107 -16.181 -10.889 -11.003
  816   HD23  LEU 107          HD22      LEU 107 -17.029 -12.022  -9.949
  817    H    GLU 108           HN       GLU 108 -21.648  -8.936  -9.921
  818    HA   GLU 108           HA       GLU 108 -23.339  -9.254  -7.592
  819    HB2  GLU 108           HB2      GLU 108 -23.777  -7.966 -10.286
  820    HB3  GLU 108           HB1      GLU 108 -25.038  -8.082  -9.068
  821    HG2  GLU 108           HG2      GLU 108 -24.021  -5.907  -8.986
  822    HG3  GLU 108           HG1      GLU 108 -23.636  -6.798  -7.515
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1  -3.776 -19.067   9.270
    2    H2   GLY   1           HT2      GLY   1  -4.309 -18.037  10.501
    3    H3   GLY   1           HT3      GLY   1  -3.550 -17.396   9.132
    4    HA2  GLY   1           HA1      GLY   1  -5.372 -18.101   7.730
    5    HA3  GLY   1           HA2      GLY   1  -6.153 -18.820   9.129
    6    H    SER   2           HN       SER   2  -6.777 -17.357  10.889
    7    HA   SER   2           HA       SER   2  -7.901 -14.918   9.783
    8    HG   SER   2           HG       SER   2 -10.036 -16.126  10.269
    9    HB2  SER   2           HB2      SER   2  -8.280 -16.211  12.494
   10    HB3  SER   2           HB1      SER   2  -9.179 -14.817  11.894
   11    H    HIS   3           HN       HIS   3  -7.555 -12.854  10.578
   12    HA   HIS   3           HA       HIS   3  -5.593 -12.442  12.683
   13    HD1  HIS   3           HD1      HIS   3  -4.370  -8.984  10.405
   14    HD2  HIS   3           HD2      HIS   3  -2.623 -11.838  12.869
   15    HE1  HIS   3           HE1      HIS   3  -2.583  -7.763  11.686
   16    HE2  HIS   3           HE2      HIS   3  -1.504  -9.521  13.134
   17    HB2  HIS   3           HB2      HIS   3  -4.258 -12.629  10.596
   18    HB3  HIS   3           HB1      HIS   3  -5.183 -11.297   9.912
   19    H    GLY   4           HN       GLY   4  -8.106 -11.328  10.586
   20    HA2  GLY   4           HA2      GLY   4  -8.900  -9.331  12.496
   21    HA3  GLY   4           HA1      GLY   4  -8.273  -8.637  11.008
   22    H    TYR   5           HN       TYR   5  -9.590  -8.459   9.291
   23    HA   TYR   5           HA       TYR   5 -12.342  -9.363   9.629
   24    HD1  TYR   5           HD1      TYR   5 -14.143  -6.973   9.566
   25    HD2  TYR   5           HD2      TYR   5 -10.010  -6.050   9.159
   26    HE1  TYR   5           HE1      TYR   5 -14.403  -5.128  11.169
   27    HE2  TYR   5           HE2      TYR   5 -10.259  -4.203  10.764
   28    HH   TYR   5           HH       TYR   5 -12.052  -2.738  11.620
   29    HB2  TYR   5           HB2      TYR   5 -11.114  -7.512   7.575
   30    HB3  TYR   5           HB1      TYR   5 -12.831  -7.874   7.717
   31    H    SER   6           HN       SER   6 -13.180 -11.037   8.578
   32    HA   SER   6           HA       SER   6 -11.641 -12.195   6.349
   33    HG   SER   6           HG       SER   6 -13.488 -13.827   9.414
   34    HB2  SER   6           HB2      SER   6 -12.716 -14.352   6.952
   35    HB3  SER   6           HB1      SER   6 -11.745 -13.692   8.268
   36    H    ASP   7           HN       ASP   7 -12.585 -11.161   4.635
   37    HA   ASP   7           HA       ASP   7 -14.133 -10.635   3.054
   38    HB2  ASP   7           HB2      ASP   7 -14.183 -13.096   2.855
   39    HB3  ASP   7           HB1      ASP   7 -15.467 -13.159   4.061
   40    H    ALA   8           HN       ALA   8 -14.729  -8.751   4.317
   41    HA   ALA   8           HA       ALA   8 -17.470  -8.958   5.380
   42    HB1  ALA   8           HB3      ALA   8 -16.963  -7.224   6.983
   43    HB2  ALA   8           HB1      ALA   8 -15.331  -7.063   6.339
   44    HB3  ALA   8           HB2      ALA   8 -15.811  -8.548   7.159
   45    H    SER   9           HN       SER   9 -18.756  -8.133   3.859
   46    HA   SER   9           HA       SER   9 -19.656  -6.728   2.316
   47    HG   SER   9           HG       SER   9 -20.792  -5.519   4.065
   48    HB2  SER   9           HB2      SER   9 -18.086  -4.678   3.895
   49    HB3  SER   9           HB1      SER   9 -19.357  -4.301   2.732
   50    H    GLY  10           HN       GLY  10 -16.994  -7.956   1.793
   51    HA2  GLY  10           HA2      GLY  10 -15.694  -8.006  -0.129
   52    HA3  GLY  10           HA1      GLY  10 -16.438  -6.497  -0.634
   53    H    PHE  11           HN       PHE  11 -14.679  -7.229   2.352
   54    HA   PHE  11           HA       PHE  11 -12.442  -5.563   1.475
   55    HD1  PHE  11           HD2      PHE  11 -12.236  -2.802   1.669
   56    HD2  PHE  11           HD1      PHE  11 -16.035  -4.133   3.049
   57    HE1  PHE  11           HE2      PHE  11 -13.319  -0.969   0.438
   58    HE2  PHE  11           HE1      PHE  11 -17.127  -2.302   1.819
   59    HZ   PHE  11           HZ       PHE  11 -15.768  -0.716   0.513
   60    HB2  PHE  11           HB2      PHE  11 -14.074  -5.035   3.969
   61    HB3  PHE  11           HB1      PHE  11 -12.500  -4.314   3.650
   62    H    SER  12           HN       SER  12 -10.739  -6.818   1.741
   63    HA   SER  12           HA       SER  12 -10.519  -8.369   4.233
   64    HG   SER  12           HG       SER  12  -8.570  -9.892   3.723
   65    HB2  SER  12           HB2      SER  12 -10.971  -9.901   2.382
   66    HB3  SER  12           HB1      SER  12  -9.627  -9.221   1.467
   67    H    LEU  13           HN       LEU  13  -8.569  -8.345   5.259
   68    HA   LEU  13           HA       LEU  13  -6.731  -6.263   4.483
   69    HG   LEU  13           HG       LEU  13  -8.582  -6.690   6.937
   70    HB2  LEU  13           HB2      LEU  13  -6.596  -8.206   6.791
   71    HB3  LEU  13           HB1      LEU  13  -5.586  -6.789   6.583
   72   HD11  LEU  13          HD11      LEU  13  -6.385  -6.192   8.943
   73   HD12  LEU  13          HD12      LEU  13  -7.502  -7.556   8.946
   74   HD13  LEU  13          HD13      LEU  13  -8.109  -5.921   9.206
   75   HD21  LEU  13          HD23      LEU  13  -7.775  -4.771   5.755
   76   HD22  LEU  13          HD21      LEU  13  -6.440  -4.574   6.890
   77   HD23  LEU  13          HD22      LEU  13  -8.097  -4.294   7.422
   78    H    TYR  14           HN       TYR  14  -5.011  -6.545   3.239
   79    HA   TYR  14           HA       TYR  14  -3.944  -9.273   2.930
   80    HD1  TYR  14           HD1      TYR  14  -6.536  -7.173   0.919
   81    HD2  TYR  14           HD2      TYR  14  -4.052 -10.538   0.110
   82    HE1  TYR  14           HE1      TYR  14  -8.460  -8.356  -0.049
   83    HE2  TYR  14           HE2      TYR  14  -5.972 -11.725  -0.860
   84    HH   TYR  14           HH       TYR  14  -8.870 -10.192  -1.664
   85    HB2  TYR  14           HB2      TYR  14  -4.101  -6.982   0.974
   86    HB3  TYR  14           HB1      TYR  14  -3.082  -8.390   0.702
   87    H    SER  15           HN       SER  15  -1.748  -9.616   3.019
   88    HA   SER  15           HA       SER  15  -0.002  -7.322   3.497
   89    HG   SER  15           HG       SER  15   0.525 -10.460   5.663
   90    HB2  SER  15           HB2      SER  15   1.000  -8.418   5.482
   91    HB3  SER  15           HB1      SER  15  -0.696  -8.006   5.732
   92    H    VAL  16           HN       VAL  16   1.836  -7.506   2.413
   93    HA   VAL  16           HA       VAL  16   2.689 -10.193   1.547
   94    HB   VAL  16           HB       VAL  16   3.239  -7.616   0.073
   95   HG11  VAL  16          HG11      VAL  16   4.831  -9.416  -0.346
   96   HG12  VAL  16          HG12      VAL  16   3.842  -9.101  -1.771
   97   HG13  VAL  16          HG13      VAL  16   3.504 -10.503  -0.755
   98   HG21  VAL  16          HG23      VAL  16   0.838  -8.022   0.091
   99   HG22  VAL  16          HG21      VAL  16   1.099  -9.674  -0.469
  100   HG23  VAL  16          HG22      VAL  16   1.505  -8.312  -1.515
  101    H    GLU  17           HN       GLU  17   4.864 -10.706   1.672
  102    HA   GLU  17           HA       GLU  17   6.427  -8.961   3.422
  103    HB2  GLU  17           HB2      GLU  17   6.752 -11.859   2.648
  104    HB3  GLU  17           HB1      GLU  17   7.928 -10.980   3.616
  105    HG2  GLU  17           HG2      GLU  17   6.581 -12.179   5.126
  106    HG3  GLU  17           HG1      GLU  17   6.073 -10.493   5.236
  107    H    LEU  18           HN       LEU  18   7.775  -7.595   2.515
  108    HA   LEU  18           HA       LEU  18   9.153  -8.381   0.031
  109    HG   LEU  18           HG       LEU  18   7.431  -5.436  -1.354
  110    HB2  LEU  18           HB2      LEU  18   8.021  -5.786   0.964
  111    HB3  LEU  18           HB1      LEU  18   9.470  -5.743  -0.020
  112   HD11  LEU  18          HD11      LEU  18   9.413  -6.426  -2.378
  113   HD12  LEU  18          HD12      LEU  18   7.933  -7.082  -3.077
  114   HD13  LEU  18          HD13      LEU  18   8.854  -8.033  -1.912
  115   HD21  LEU  18          HD23      LEU  18   5.919  -6.797   0.019
  116   HD22  LEU  18          HD21      LEU  18   6.758  -8.254  -0.513
  117   HD23  LEU  18          HD22      LEU  18   5.873  -7.272  -1.678
  118    H    PHE  19           HN       PHE  19  11.312  -7.277  -0.241
  119    HA   PHE  19           HA       PHE  19  12.679  -6.485   2.161
  120    HD1  PHE  19           HD2      PHE  19  11.546 -10.088   0.566
  121    HD2  PHE  19           HD1      PHE  19  15.630  -8.932   0.257
  122    HE1  PHE  19           HE2      PHE  19  11.841 -11.649  -1.313
  123    HE2  PHE  19           HE1      PHE  19  15.931 -10.488  -1.626
  124    HZ   PHE  19           HZ       PHE  19  14.047 -11.866  -2.397
  125    HB2  PHE  19           HB2      PHE  19  14.350  -8.278   2.128
  126    HB3  PHE  19           HB1      PHE  19  12.738  -8.923   2.412
  127    H    ARG  20           HN       ARG  20  14.311  -5.131   1.712
  128    HA   ARG  20           HA       ARG  20  15.166  -4.984  -1.106
  129    HE   ARG  20           HE       ARG  20  14.014  -4.078  -2.425
  130    HB2  ARG  20           HB2      ARG  20  13.911  -3.007  -0.241
  131    HB3  ARG  20           HB1      ARG  20  15.187  -2.762   0.941
  132    HG2  ARG  20           HG2      ARG  20  15.850  -1.299  -0.671
  133    HG3  ARG  20           HG1      ARG  20  16.717  -2.742  -1.199
  134    HD2  ARG  20           HD2      ARG  20  14.120  -1.663  -2.283
  135    HD3  ARG  20           HD1      ARG  20  15.674  -1.741  -3.111
  136   HH11  ARG  20          HH11      ARG  20  16.416  -2.501  -4.393
  137   HH12  ARG  20          HH12      ARG  20  16.551  -3.817  -5.511
  138   HH21  ARG  20          HH21      ARG  20  14.188  -5.819  -3.887
  139   HH22  ARG  20          HH22      ARG  20  15.284  -5.705  -5.222
  140    H    GLU  21           HN       GLU  21  17.234  -5.355  -1.561
  141    HA   GLU  21           HA       GLU  21  19.192  -5.237   0.638
  142    HB2  GLU  21           HB2      GLU  21  19.126  -7.266  -1.603
  143    HB3  GLU  21           HB1      GLU  21  20.320  -7.185  -0.316
  144    HG2  GLU  21           HG2      GLU  21  17.385  -7.750   0.033
  145    HG3  GLU  21           HG1      GLU  21  18.687  -8.937   0.091
  146    H    LYS  22           HN       LYS  22  18.286  -4.105  -2.363
  147    HA   LYS  22           HA       LYS  22  20.993  -3.602  -3.318
  148    HB2  LYS  22           HB2      LYS  22  18.377  -2.737  -4.558
  149    HB3  LYS  22           HB1      LYS  22  19.955  -2.780  -5.331
  150    HG2  LYS  22           HG2      LYS  22  18.471  -5.205  -4.338
  151    HG3  LYS  22           HG1      LYS  22  18.469  -4.634  -6.007
  152    HD2  LYS  22           HD2      LYS  22  20.886  -4.942  -6.127
  153    HD3  LYS  22           HD1      LYS  22  20.911  -5.474  -4.445
  154    HE2  LYS  22           HE2      LYS  22  19.524  -7.388  -5.010
  155    HE3  LYS  22           HE1      LYS  22  19.423  -6.843  -6.684
  156    HZ1  LYS  22           HZ3      LYS  22  21.803  -7.149  -6.898
  157    HZ2  LYS  22           HZ1      LYS  22  21.073  -8.591  -6.398
  158    HZ3  LYS  22           HZ2      LYS  22  21.918  -7.641  -5.283
  159    H    ASP  23           HN       ASP  23  21.695  -1.443  -3.870
  160    HA   ASP  23           HA       ASP  23  20.889   0.480  -1.849
  161    HB2  ASP  23           HB2      ASP  23  22.836   1.775  -2.613
  162    HB3  ASP  23           HB1      ASP  23  23.278   0.111  -2.242
  163    H    THR  24           HN       THR  24  18.995  -0.105  -3.923
  164    HA   THR  24           HA       THR  24  19.017   2.163  -5.727
  165    HB   THR  24           HB       THR  24  16.948   1.243  -6.633
  166    HG1  THR  24           HG1      THR  24  16.840   0.036  -4.216
  167   HG21  THR  24          HG23      THR  24  17.795  -0.921  -7.408
  168   HG22  THR  24          HG21      THR  24  19.010  -0.908  -6.131
  169   HG23  THR  24          HG22      THR  24  19.070   0.297  -7.416
  170    H    SER  25           HN       SER  25  17.733   1.337  -2.655
  171    HA   SER  25           HA       SER  25  16.411   2.417  -1.158
  172    HG   SER  25           HG       SER  25  18.246   4.303  -0.378
  173    HB2  SER  25           HB2      SER  25  17.097   4.821  -2.865
  174    HB3  SER  25           HB1      SER  25  16.381   4.888  -1.254
  175    H    SER  26           HN       SER  26  15.321   1.479  -3.876
  176    HA   SER  26           HA       SER  26  12.724   2.840  -3.615
  177    HG   SER  26           HG       SER  26  14.868   3.876  -5.912
  178    HB2  SER  26           HB2      SER  26  14.041   1.937  -6.187
  179    HB3  SER  26           HB1      SER  26  12.411   2.595  -6.057
  180    H    LEU  27           HN       LEU  27  10.909   1.571  -3.730
  181    HA   LEU  27           HA       LEU  27  11.387  -1.333  -3.813
  182    HG   LEU  27           HG       LEU  27  11.572   0.045  -1.187
  183    HB2  LEU  27           HB2      LEU  27   9.342   0.270  -2.285
  184    HB3  LEU  27           HB1      LEU  27   9.281  -1.475  -2.435
  185   HD11  LEU  27          HD11      LEU  27   9.595   0.307   0.173
  186   HD12  LEU  27          HD12      LEU  27  10.700  -0.832   0.945
  187   HD13  LEU  27          HD13      LEU  27   9.273  -1.425   0.093
  188   HD21  LEU  27          HD23      LEU  27  10.920  -2.898  -1.266
  189   HD22  LEU  27          HD21      LEU  27  12.246  -2.163  -0.365
  190   HD23  LEU  27          HD22      LEU  27  12.234  -2.097  -2.127
  191    H    GLY  28           HN       GLY  28   9.887   1.260  -5.368
  192    HA2  GLY  28           HA2      GLY  28   8.855   1.102  -7.477
  193    HA3  GLY  28           HA1      GLY  28   8.524  -0.592  -7.163
  194    H    ILE  29           HN       ILE  29   7.736   1.942  -4.879
  195    HA   ILE  29           HA       ILE  29   4.899   1.293  -5.256
  196    HB   ILE  29           HB       ILE  29   6.187   2.773  -2.962
  197   HG12  ILE  29          HG12      ILE  29   7.019   0.479  -3.051
  198   HG13  ILE  29          HG11      ILE  29   5.913   0.671  -1.695
  199   HG21  ILE  29          HG21      ILE  29   4.075   2.308  -1.802
  200   HG22  ILE  29          HG22      ILE  29   3.435   1.584  -3.277
  201   HG23  ILE  29          HG23      ILE  29   3.839   3.301  -3.240
  202   HD11  ILE  29          HD13      ILE  29   4.145  -0.406  -2.988
  203   HD12  ILE  29          HD11      ILE  29   5.562  -1.443  -2.831
  204   HD13  ILE  29          HD12      ILE  29   5.255  -0.594  -4.346
  205    H    SER  30           HN       SER  30   3.805   2.635  -6.535
  206    HA   SER  30           HA       SER  30   4.538   5.487  -6.539
  207    HG   SER  30           HG       SER  30   3.623   6.604  -8.312
  208    HB2  SER  30           HB2      SER  30   4.745   4.377  -8.731
  209    HB3  SER  30           HB1      SER  30   3.048   3.905  -8.648
  210    H    ILE  31           HN       ILE  31   3.301   6.318  -4.922
  211    HA   ILE  31           HA       ILE  31   0.496   5.623  -4.694
  212    HB   ILE  31           HB       ILE  31   0.513   7.275  -2.807
  213   HG12  ILE  31          HG12      ILE  31   3.489   7.329  -3.366
  214   HG13  ILE  31          HG11      ILE  31   2.382   8.666  -3.650
  215   HG21  ILE  31          HG21      ILE  31   2.563   5.065  -2.702
  216   HG22  ILE  31          HG22      ILE  31   0.830   4.892  -2.427
  217   HG23  ILE  31          HG23      ILE  31   1.811   5.835  -1.306
  218   HD11  ILE  31          HD13      ILE  31   1.918   8.797  -1.263
  219   HD12  ILE  31          HD11      ILE  31   3.642   8.966  -1.593
  220   HD13  ILE  31          HD12      ILE  31   3.009   7.442  -0.974
  221    H    SER  32           HN       SER  32  -1.213   7.171  -4.768
  222    HA   SER  32           HA       SER  32  -0.617   9.606  -6.307
  223    HG   SER  32           HG       SER  32  -2.344  10.269  -7.713
  224    HB2  SER  32           HB2      SER  32  -1.481   7.934  -7.870
  225    HB3  SER  32           HB1      SER  32  -2.884   7.668  -6.836
  226    H    GLY  33           HN       GLY  33  -1.751  11.407  -5.739
  227    HA2  GLY  33           HA2      GLY  33  -3.058  11.393  -3.197
  228    HA3  GLY  33           HA1      GLY  33  -2.868  12.778  -4.260
  229    H    MET  34           HN       MET  34  -5.183  11.681  -2.670
  230    HA   MET  34           HA       MET  34  -7.099  11.147  -4.820
  231    HB2  MET  34           HB2      MET  34  -7.111   9.642  -2.867
  232    HB3  MET  34           HB1      MET  34  -7.455  11.013  -1.820
  233    HG2  MET  34           HG2      MET  34  -9.587  11.352  -2.949
  234    HG3  MET  34           HG1      MET  34  -9.240   9.997  -4.021
  235    HE1  MET  34           HE3      MET  34 -11.530   8.859  -3.428
  236    HE2  MET  34           HE1      MET  34 -11.946  10.187  -2.344
  237    HE3  MET  34           HE2      MET  34 -12.073   8.518  -1.784
  238    H    ARG  35           HN       ARG  35  -7.849  12.957  -5.733
  239    HA   ARG  35           HA       ARG  35  -8.351  15.308  -4.065
  240    HE   ARG  35           HE       ARG  35  -4.193  16.257  -5.542
  241    HB2  ARG  35           HB2      ARG  35  -8.184  14.911  -7.048
  242    HB3  ARG  35           HB1      ARG  35  -8.773  16.404  -6.331
  243    HG2  ARG  35           HG2      ARG  35  -6.514  16.785  -6.823
  244    HG3  ARG  35           HG1      ARG  35  -6.577  16.515  -5.081
  245    HD2  ARG  35           HD2      ARG  35  -5.901  14.173  -5.450
  246    HD3  ARG  35           HD1      ARG  35  -5.778  14.498  -7.178
  247   HH11  ARG  35          HH11      ARG  35  -4.286  13.197  -7.207
  248   HH12  ARG  35          HH12      ARG  35  -2.565  13.084  -7.363
  249   HH21  ARG  35          HH21      ARG  35  -1.929  16.116  -5.740
  250   HH22  ARG  35          HH22      ARG  35  -1.225  14.743  -6.526
  251    H    ASP  36           HN       ASP  36 -10.324  15.810  -3.398
  252    HA   ASP  36           HA       ASP  36 -12.602  14.324  -4.453
  253    HB2  ASP  36           HB2      ASP  36 -12.264  14.468  -2.005
  254    HB3  ASP  36           HB1      ASP  36 -12.448  16.217  -2.097
  255    H    GLN  37           HN       GLN  37 -14.580  15.389  -5.035
  256    HA   GLN  37           HA       GLN  37 -14.148  17.709  -6.651
  257    HB2  GLN  37           HB2      GLN  37 -15.672  15.672  -7.108
  258    HB3  GLN  37           HB1      GLN  37 -16.825  16.479  -6.054
  259    HG2  GLN  37           HG2      GLN  37 -16.792  18.429  -7.523
  260    HG3  GLN  37           HG1      GLN  37 -15.652  17.600  -8.582
  261   HE21  GLN  37          HE21      GLN  37 -18.262  15.951  -6.968
  262   HE22  GLN  37          HE22      GLN  37 -19.202  15.635  -8.382
  263    H    SER  38           HN       SER  38 -14.168  17.742  -3.549
  264    HA   SER  38           HA       SER  38 -15.305  20.350  -3.309
  265    HG   SER  38           HG       SER  38 -16.542  20.008  -0.593
  266    HB2  SER  38           HB2      SER  38 -17.374  19.038  -3.127
  267    HB3  SER  38           HB1      SER  38 -16.664  18.088  -1.823
  268    H    THR  39           HN       THR  39 -15.056  21.219  -1.082
  269    HA   THR  39           HA       THR  39 -12.884  19.845   0.366
  270    HB   THR  39           HB       THR  39 -12.006  22.080   0.986
  271    HG1  THR  39           HG1      THR  39 -12.864  23.903   0.082
  272   HG21  THR  39          HG23      THR  39 -11.015  20.890  -0.895
  273   HG22  THR  39          HG21      THR  39 -11.031  22.625  -1.207
  274   HG23  THR  39          HG22      THR  39 -12.218  21.578  -1.985
  275    H    THR  40           HN       THR  40 -13.017  19.749   2.561
  276    HA   THR  40           HA       THR  40 -14.842  21.376   4.065
  277    HB   THR  40           HB       THR  40 -16.444  19.759   3.187
  278    HG1  THR  40           HG1      THR  40 -16.619  20.483   5.408
  279   HG21  THR  40          HG23      THR  40 -16.269  17.378   3.739
  280   HG22  THR  40          HG21      THR  40 -14.696  17.664   4.485
  281   HG23  THR  40          HG22      THR  40 -14.907  17.905   2.750
  282    H    GLY  41           HN       GLY  41 -12.017  19.955   3.811
  283    HA2  GLY  41           HA2      GLY  41 -10.843  20.353   6.114
  284    HA3  GLY  41           HA1      GLY  41 -11.820  18.964   6.566
  285    H    GLU  42           HN       GLU  42 -10.975  17.007   6.279
  286    HA   GLU  42           HA       GLU  42  -8.504  16.806   4.700
  287    HB2  GLU  42           HB2      GLU  42  -9.558  14.997   6.882
  288    HB3  GLU  42           HB1      GLU  42  -8.036  14.782   6.026
  289    HG2  GLU  42           HG2      GLU  42  -8.739  17.165   7.720
  290    HG3  GLU  42           HG1      GLU  42  -7.765  15.795   8.251
  291    H    ALA  43           HN       ALA  43  -8.344  15.455   3.006
  292    HA   ALA  43           HA       ALA  43 -10.167  13.281   2.577
  293    HB1  ALA  43           HB3      ALA  43 -11.572  15.167   1.883
  294    HB2  ALA  43           HB1      ALA  43 -11.179  14.112   0.525
  295    HB3  ALA  43           HB2      ALA  43 -10.340  15.652   0.719
  296    H    THR  44           HN       THR  44  -7.686  12.781   2.779
  297    HA   THR  44           HA       THR  44  -6.675  12.498   0.030
  298    HB   THR  44           HB       THR  44  -4.372  12.775   0.841
  299    HG1  THR  44           HG1      THR  44  -5.710  13.079   3.301
  300   HG21  THR  44          HG23      THR  44  -5.573  14.720  -0.056
  301   HG22  THR  44          HG21      THR  44  -4.428  15.190   1.199
  302   HG23  THR  44          HG22      THR  44  -6.150  15.107   1.566
  303    H    GLY  45           HN       GLY  45  -5.844  10.527  -0.492
  304    HA2  GLY  45           HA2      GLY  45  -5.599   8.549   1.681
  305    HA3  GLY  45           HA1      GLY  45  -6.519   8.176   0.231
  306    H    ILE  46           HN       ILE  46  -3.743   7.491   1.668
  307    HA   ILE  46           HA       ILE  46  -1.970   7.737  -0.621
  308    HB   ILE  46           HB       ILE  46  -1.462   6.400   2.041
  309   HG12  ILE  46          HG12      ILE  46  -1.980   8.786   2.318
  310   HG13  ILE  46          HG11      ILE  46  -0.285   8.462   2.660
  311   HG21  ILE  46          HG21      ILE  46   0.421   7.279  -0.144
  312   HG22  ILE  46          HG22      ILE  46   0.046   5.619   0.320
  313   HG23  ILE  46          HG23      ILE  46   0.913   6.672   1.438
  314   HD11  ILE  46          HD13      ILE  46  -1.381   9.634   0.114
  315   HD12  ILE  46          HD11      ILE  46   0.319   9.308   0.451
  316   HD13  ILE  46          HD12      ILE  46  -0.552  10.514   1.397
  317    H    TYR  47           HN       TYR  47  -3.113   6.388  -2.094
  318    HA   TYR  47           HA       TYR  47  -2.886   3.513  -1.492
  319    HD1  TYR  47           HD1      TYR  47  -5.404   6.687  -2.200
  320    HD2  TYR  47           HD2      TYR  47  -4.870   3.811  -5.288
  321    HE1  TYR  47           HE1      TYR  47  -6.171   8.333  -3.858
  322    HE2  TYR  47           HE2      TYR  47  -5.634   5.450  -6.954
  323    HH   TYR  47           HH       TYR  47  -5.949   8.753  -6.275
  324    HB2  TYR  47           HB2      TYR  47  -4.763   3.135  -3.021
  325    HB3  TYR  47           HB1      TYR  47  -5.224   4.230  -1.722
  326    H    VAL  48           HN       VAL  48  -1.820   2.228  -2.904
  327    HA   VAL  48           HA       VAL  48  -0.044   3.407  -4.765
  328    HB   VAL  48           HB       VAL  48  -0.817   0.498  -4.470
  329   HG11  VAL  48          HG11      VAL  48   1.586   1.757  -5.792
  330   HG12  VAL  48          HG12      VAL  48   0.246   0.960  -6.618
  331   HG13  VAL  48          HG13      VAL  48   1.317   0.028  -5.571
  332   HG21  VAL  48          HG23      VAL  48   1.194   0.305  -3.099
  333   HG22  VAL  48          HG21      VAL  48   0.061   1.464  -2.400
  334   HG23  VAL  48          HG22      VAL  48   1.485   2.037  -3.269
  335    H    LYS  49           HN       LYS  49  -0.688   4.290  -6.608
  336    HA   LYS  49           HA       LYS  49  -3.020   3.299  -8.019
  337    HB2  LYS  49           HB2      LYS  49  -2.628   5.726  -7.775
  338    HB3  LYS  49           HB1      LYS  49  -1.145   5.570  -8.706
  339    HG2  LYS  49           HG2      LYS  49  -2.444   4.834 -10.646
  340    HG3  LYS  49           HG1      LYS  49  -3.929   5.010  -9.709
  341    HD2  LYS  49           HD2      LYS  49  -3.435   7.405  -9.416
  342    HD3  LYS  49           HD1      LYS  49  -1.985   7.212 -10.403
  343    HE2  LYS  49           HE2      LYS  49  -4.820   6.719 -11.305
  344    HE3  LYS  49           HE1      LYS  49  -3.839   8.126 -11.706
  345    HZ1  LYS  49           HZ3      LYS  49  -3.210   5.322 -12.456
  346    HZ2  LYS  49           HZ1      LYS  49  -2.292   6.684 -12.860
  347    HZ3  LYS  49           HZ2      LYS  49  -3.848   6.494 -13.492
  348    H    SER  50           HN       SER  50   0.454   3.184  -8.277
  349    HA   SER  50           HA       SER  50   0.233   1.215 -10.388
  350    HG   SER  50           HG       SER  50   1.499   4.870 -11.071
  351    HB2  SER  50           HB2      SER  50   1.833   2.382 -11.880
  352    HB3  SER  50           HB1      SER  50   0.318   3.263 -11.700
  353    H    LEU  51           HN       LEU  51   2.433   0.338 -10.975
  354    HA   LEU  51           HA       LEU  51   4.226   0.407  -8.638
  355    HG   LEU  51           HG       LEU  51   1.840  -1.370  -8.466
  356    HB2  LEU  51           HB2      LEU  51   3.425  -1.964 -10.325
  357    HB3  LEU  51           HB1      LEU  51   4.714  -1.995  -9.137
  358   HD11  LEU  51          HD11      LEU  51   1.734  -3.649  -7.574
  359   HD12  LEU  51          HD12      LEU  51   3.343  -3.971  -8.224
  360   HD13  LEU  51          HD13      LEU  51   1.999  -3.638  -9.318
  361   HD21  LEU  51          HD23      LEU  51   3.498  -0.483  -6.896
  362   HD22  LEU  51          HD21      LEU  51   4.200  -2.093  -6.732
  363   HD23  LEU  51          HD22      LEU  51   2.555  -1.786  -6.175
  364    H    ILE  52           HN       ILE  52   6.454  -0.368  -9.148
  365    HA   ILE  52           HA       ILE  52   7.259   0.584 -11.817
  366    HB   ILE  52           HB       ILE  52   8.919   0.522  -9.296
  367   HG12  ILE  52          HG12      ILE  52   7.109   2.166  -9.120
  368   HG13  ILE  52          HG11      ILE  52   8.665   2.971  -9.287
  369   HG21  ILE  52          HG21      ILE  52   9.463   1.704 -12.013
  370   HG22  ILE  52          HG22      ILE  52  10.269   0.314 -11.288
  371   HG23  ILE  52          HG23      ILE  52  10.481   1.920 -10.589
  372   HD11  ILE  52          HD13      ILE  52   8.197   3.375 -11.651
  373   HD12  ILE  52          HD11      ILE  52   6.960   4.077 -10.606
  374   HD13  ILE  52          HD12      ILE  52   6.634   2.576 -11.473
  375    HA   PRO  53           HA       PRO  53   8.272  -3.819 -12.302
  376    HB2  PRO  53           HB2      PRO  53   9.210  -3.515 -14.875
  377    HB3  PRO  53           HB1      PRO  53   7.515  -3.782 -14.454
  378    HG2  PRO  53           HG2      PRO  53   8.931  -1.226 -15.088
  379    HG3  PRO  53           HG1      PRO  53   7.316  -1.768 -15.584
  380    HD2  PRO  53           HD2      PRO  53   7.651   0.002 -13.598
  381    HD3  PRO  53           HD1      PRO  53   6.370  -1.226 -13.537
  382    H    GLY  54           HN       GLY  54  10.115  -4.794 -11.740
  383    HA2  GLY  54           HA2      GLY  54  12.466  -5.196 -12.102
  384    HA3  GLY  54           HA1      GLY  54  12.666  -3.478 -12.405
  385    H    SER  55           HN       SER  55  10.668  -3.367  -9.928
  386    HA   SER  55           HA       SER  55  12.839  -3.067  -8.006
  387    HG   SER  55           HG       SER  55   9.420  -2.960  -8.511
  388    HB2  SER  55           HB2      SER  55  11.197  -1.891  -6.627
  389    HB3  SER  55           HB1      SER  55  11.191  -1.241  -8.267
  390    H    ALA  56           HN       ALA  56  11.734  -3.499  -5.610
  391    HA   ALA  56           HA       ALA  56  11.743  -6.337  -5.401
  392    HB1  ALA  56           HB3      ALA  56  11.041  -4.299  -3.292
  393    HB2  ALA  56           HB1      ALA  56  12.673  -4.849  -3.671
  394    HB3  ALA  56           HB2      ALA  56  11.489  -5.983  -3.020
  395    H    ALA  57           HN       ALA  57   9.231  -3.893  -4.752
  396    HA   ALA  57           HA       ALA  57   7.171  -5.638  -4.066
  397    HB1  ALA  57           HB3      ALA  57   5.657  -3.799  -4.556
  398    HB2  ALA  57           HB1      ALA  57   6.935  -2.965  -5.441
  399    HB3  ALA  57           HB2      ALA  57   7.088  -3.220  -3.702
  400    H    ALA  58           HN       ALA  58   8.123  -4.394  -7.246
  401    HA   ALA  58           HA       ALA  58   5.971  -5.513  -8.690
  402    HB1  ALA  58           HB3      ALA  58   7.369  -3.689  -9.546
  403    HB2  ALA  58           HB1      ALA  58   7.286  -5.043 -10.674
  404    HB3  ALA  58           HB2      ALA  58   8.726  -4.805  -9.685
  405    H    LEU  59           HN       LEU  59   9.336  -6.637  -8.319
  406    HA   LEU  59           HA       LEU  59   8.990  -9.022  -9.777
  407    HG   LEU  59           HG       LEU  59  11.213  -6.904  -9.649
  408    HB2  LEU  59           HB2      LEU  59  10.997  -8.317  -7.638
  409    HB3  LEU  59           HB1      LEU  59  11.088  -9.749  -8.644
  410   HD11  LEU  59          HD11      LEU  59  13.382  -8.980  -9.385
  411   HD12  LEU  59          HD12      LEU  59  13.196  -7.549  -8.371
  412   HD13  LEU  59          HD13      LEU  59  13.558  -7.372 -10.088
  413   HD21  LEU  59          HD23      LEU  59  11.546  -9.536 -11.085
  414   HD22  LEU  59          HD21      LEU  59  11.859  -7.946 -11.781
  415   HD23  LEU  59          HD22      LEU  59  10.223  -8.387 -11.292
  416    H    ASP  60           HN       ASP  60   8.048  -8.153  -6.600
  417    HA   ASP  60           HA       ASP  60   8.131 -10.598  -5.267
  418    HB2  ASP  60           HB2      ASP  60   7.576  -8.386  -4.238
  419    HB3  ASP  60           HB1      ASP  60   5.981  -8.492  -4.978
  420    H    GLY  61           HN       GLY  61   5.512  -9.207  -7.239
  421    HA2  GLY  61           HA2      GLY  61   4.176 -10.490  -8.719
  422    HA3  GLY  61           HA1      GLY  61   4.600 -11.932  -7.810
  423    H    ARG  62           HN       ARG  62   3.975 -11.044  -5.222
  424    HA   ARG  62           HA       ARG  62   1.165 -11.488  -5.215
  425    HE   ARG  62           HE       ARG  62   0.958 -12.741  -1.508
  426    HB2  ARG  62           HB2      ARG  62   2.992 -10.653  -2.956
  427    HB3  ARG  62           HB1      ARG  62   1.345 -11.237  -2.772
  428    HG2  ARG  62           HG2      ARG  62   2.026 -13.387  -3.769
  429    HG3  ARG  62           HG1      ARG  62   3.686 -12.793  -3.851
  430    HD2  ARG  62           HD2      ARG  62   3.362 -14.187  -1.882
  431    HD3  ARG  62           HD1      ARG  62   3.707 -12.521  -1.421
  432   HH11  ARG  62          HH11      ARG  62   3.577 -14.211   0.256
  433   HH12  ARG  62          HH12      ARG  62   2.625 -14.514   1.671
  434   HH21  ARG  62          HH21      ARG  62  -0.303 -13.132   0.351
  435   HH22  ARG  62          HH22      ARG  62   0.420 -13.900   1.725
  436    H    ILE  63           HN       ILE  63   3.111  -8.656  -5.328
  437    HA   ILE  63           HA       ILE  63   1.223  -6.855  -4.167
  438    HB   ILE  63           HB       ILE  63   3.468  -6.207  -6.081
  439   HG12  ILE  63          HG12      ILE  63   4.293  -7.431  -4.115
  440   HG13  ILE  63          HG11      ILE  63   4.816  -5.751  -4.082
  441   HG21  ILE  63          HG21      ILE  63   3.368  -3.977  -5.071
  442   HG22  ILE  63          HG22      ILE  63   1.989  -4.484  -4.098
  443   HG23  ILE  63          HG23      ILE  63   1.849  -4.410  -5.854
  444   HD11  ILE  63          HD13      ILE  63   4.140  -6.493  -1.881
  445   HD12  ILE  63          HD11      ILE  63   2.547  -6.935  -2.496
  446   HD13  ILE  63          HD12      ILE  63   3.045  -5.243  -2.472
  447    H    GLU  64           HN       GLU  64  -0.418  -5.762  -5.078
  448    HA   GLU  64           HA       GLU  64  -0.771  -5.953  -7.992
  449    HB2  GLU  64           HB2      GLU  64  -2.236  -7.588  -6.896
  450    HB3  GLU  64           HB1      GLU  64  -2.916  -6.318  -5.889
  451    HG2  GLU  64           HG2      GLU  64  -3.866  -5.240  -7.835
  452    HG3  GLU  64           HG1      GLU  64  -3.119  -6.440  -8.890
  453    HA   PRO  65           HA       PRO  65  -1.238  -1.541  -7.664
  454    HB2  PRO  65           HB2      PRO  65  -2.504  -1.085 -10.039
  455    HB3  PRO  65           HB1      PRO  65  -0.769  -1.384  -9.901
  456    HG2  PRO  65           HG2      PRO  65  -2.965  -3.278 -10.640
  457    HG3  PRO  65           HG1      PRO  65  -1.354  -3.094 -11.362
  458    HD2  PRO  65           HD2      PRO  65  -1.924  -5.071  -9.622
  459    HD3  PRO  65           HD1      PRO  65  -0.325  -4.300  -9.681
  460    H    ASN  66           HN       ASN  66  -2.953   0.130  -7.766
  461    HA   ASN  66           HA       ASN  66  -4.957   0.967  -7.105
  462    HB2  ASN  66           HB2      ASN  66  -5.735  -0.187  -9.181
  463    HB3  ASN  66           HB1      ASN  66  -6.128  -1.598  -8.204
  464   HD21  ASN  66          HD21      ASN  66  -8.299  -1.490  -8.730
  465   HD22  ASN  66          HD22      ASN  66  -9.347  -0.275  -8.088
  466    H    ASP  67           HN       ASP  67  -3.651   0.133  -5.038
  467    HA   ASP  67           HA       ASP  67  -5.654  -1.262  -3.394
  468    HB2  ASP  67           HB2      ASP  67  -2.687  -1.772  -3.514
  469    HB3  ASP  67           HB1      ASP  67  -3.638  -2.194  -2.093
  470    H    LYS  68           HN       LYS  68  -5.750  -0.621  -1.204
  471    HA   LYS  68           HA       LYS  68  -4.712   2.081  -0.773
  472    HB2  LYS  68           HB2      LYS  68  -7.123   1.729  -0.487
  473    HB3  LYS  68           HB1      LYS  68  -6.805   0.523   0.754
  474    HG2  LYS  68           HG2      LYS  68  -5.838   2.201   2.194
  475    HG3  LYS  68           HG1      LYS  68  -6.025   3.425   0.936
  476    HD2  LYS  68           HD2      LYS  68  -8.448   3.170   1.031
  477    HD3  LYS  68           HD1      LYS  68  -8.277   1.910   2.255
  478    HE2  LYS  68           HE2      LYS  68  -7.234   3.527   3.769
  479    HE3  LYS  68           HE1      LYS  68  -7.411   4.784   2.547
  480    HZ1  LYS  68           HZ3      LYS  68  -9.168   4.868   4.220
  481    HZ2  LYS  68           HZ1      LYS  68  -9.654   3.300   3.806
  482    HZ3  LYS  68           HZ2      LYS  68  -9.799   4.555   2.682
  483    H    ILE  69           HN       ILE  69  -2.913   2.330   0.351
  484    HA   ILE  69           HA       ILE  69  -1.825   0.213   1.966
  485    HB   ILE  69           HB       ILE  69  -0.854   3.061   1.667
  486   HG12  ILE  69          HG12      ILE  69  -0.925   1.917  -0.498
  487   HG13  ILE  69          HG11      ILE  69   0.740   2.145   0.028
  488   HG21  ILE  69          HG21      ILE  69   0.031   1.980   3.651
  489   HG22  ILE  69          HG22      ILE  69   1.298   2.165   2.439
  490   HG23  ILE  69          HG23      ILE  69   0.543   0.592   2.691
  491   HD11  ILE  69          HD13      ILE  69  -0.855  -0.402   0.144
  492   HD12  ILE  69          HD11      ILE  69   0.771  -0.202   0.798
  493   HD13  ILE  69          HD12      ILE  69   0.491  -0.036  -0.935
  494    H    LEU  70           HN       LEU  70  -1.796   0.034   4.143
  495    HA   LEU  70           HA       LEU  70  -3.326   2.036   5.660
  496    HG   LEU  70           HG       LEU  70  -4.445  -0.611   4.513
  497    HB2  LEU  70           HB2      LEU  70  -2.747  -0.854   6.320
  498    HB3  LEU  70           HB1      LEU  70  -3.689   0.244   7.310
  499   HD11  LEU  70          HD11      LEU  70  -6.164  -1.969   5.623
  500   HD12  LEU  70          HD12      LEU  70  -5.465  -1.556   7.188
  501   HD13  LEU  70          HD13      LEU  70  -4.532  -2.502   6.028
  502   HD21  LEU  70          HD23      LEU  70  -6.618   0.370   5.075
  503   HD22  LEU  70          HD21      LEU  70  -5.330   1.574   5.127
  504   HD23  LEU  70          HD22      LEU  70  -5.973   0.906   6.627
  505    H    ARG  71           HN       ARG  71  -0.662  -0.279   6.210
  506    HA   ARG  71           HA       ARG  71   0.954   1.820   7.371
  507    HE   ARG  71           HE       ARG  71   1.624  -0.903  10.938
  508    HB2  ARG  71           HB2      ARG  71   1.295   0.565   9.506
  509    HB3  ARG  71           HB1      ARG  71  -0.316   1.245   9.318
  510    HG2  ARG  71           HG2      ARG  71  -1.186  -0.929   8.689
  511    HG3  ARG  71           HG1      ARG  71   0.432  -1.625   8.803
  512    HD2  ARG  71           HD2      ARG  71  -1.060  -0.330  11.083
  513    HD3  ARG  71           HD1      ARG  71  -0.963  -2.067  10.799
  514   HH11  ARG  71          HH11      ARG  71  -1.065  -1.922  12.911
  515   HH12  ARG  71          HH12      ARG  71  -0.088  -2.231  14.307
  516   HH21  ARG  71          HH21      ARG  71   2.914  -1.309  12.771
  517   HH22  ARG  71          HH22      ARG  71   2.173  -1.885  14.226
  518    H    VAL  72           HN       VAL  72   3.073   1.444   7.182
  519    HA   VAL  72           HA       VAL  72   3.902  -0.953   5.771
  520    HB   VAL  72           HB       VAL  72   5.771   1.239   6.618
  521   HG11  VAL  72          HG11      VAL  72   5.629  -0.603   4.236
  522   HG12  VAL  72          HG12      VAL  72   6.798  -0.648   5.557
  523   HG13  VAL  72          HG13      VAL  72   6.806   0.698   4.418
  524   HG21  VAL  72          HG23      VAL  72   3.902   1.363   4.253
  525   HG22  VAL  72          HG21      VAL  72   5.198   2.507   4.608
  526   HG23  VAL  72          HG22      VAL  72   3.813   2.374   5.695
  527    H    ASP  73           HN       ASP  73   6.211  -1.757   6.496
  528    HA   ASP  73           HA       ASP  73   5.995  -3.162   8.840
  529    HB2  ASP  73           HB2      ASP  73   7.658  -3.607   7.066
  530    HB3  ASP  73           HB1      ASP  73   8.568  -2.194   7.582
  531    H    ASP  74           HN       ASP  74   5.652  -2.374  10.810
  532    HA   ASP  74           HA       ASP  74   5.853  -1.185  12.733
  533    HB2  ASP  74           HB2      ASP  74   8.689  -0.857  11.736
  534    HB3  ASP  74           HB1      ASP  74   8.148  -0.474  13.368
  535    H    VAL  75           HN       VAL  75   5.146   0.235  10.186
  536    HA   VAL  75           HA       VAL  75   5.434   2.942  11.251
  537    HB   VAL  75           HB       VAL  75   6.000   2.269   8.357
  538   HG11  VAL  75          HG11      VAL  75   4.884   4.408   8.592
  539   HG12  VAL  75          HG12      VAL  75   6.577   4.653   8.163
  540   HG13  VAL  75          HG13      VAL  75   6.045   4.903   9.825
  541   HG21  VAL  75          HG23      VAL  75   8.284   3.007   8.820
  542   HG22  VAL  75          HG21      VAL  75   7.849   1.617   9.815
  543   HG23  VAL  75          HG22      VAL  75   7.871   3.234  10.519
  544    H    ASN  76           HN       ASN  76   3.712   4.300  10.791
  545    HA   ASN  76           HA       ASN  76   1.421   3.011   9.458
  546    HB2  ASN  76           HB2      ASN  76  -0.021   4.404  10.871
  547    HB3  ASN  76           HB1      ASN  76   1.064   3.424  11.854
  548   HD21  ASN  76          HD21      ASN  76   2.747   4.414  12.966
  549   HD22  ASN  76          HD22      ASN  76   2.784   6.118  13.245
  550    H    VAL  77           HN       VAL  77   0.348   4.076   7.848
  551    HA   VAL  77           HA       VAL  77   1.378   6.748   7.130
  552    HB   VAL  77           HB       VAL  77   0.919   6.196   4.768
  553   HG11  VAL  77          HG11      VAL  77   3.167   5.922   5.626
  554   HG12  VAL  77          HG12      VAL  77   2.812   4.656   4.452
  555   HG13  VAL  77          HG13      VAL  77   2.784   4.291   6.177
  556   HG21  VAL  77          HG23      VAL  77   0.467   3.909   4.096
  557   HG22  VAL  77          HG21      VAL  77  -0.808   4.491   5.166
  558   HG23  VAL  77          HG22      VAL  77   0.432   3.397   5.782
  559    H    GLN  78           HN       GLN  78  -0.986   5.899   8.757
  560    HA   GLN  78           HA       GLN  78  -3.208   6.791   7.084
  561    HB2  GLN  78           HB2      GLN  78  -3.212   5.794   9.938
  562    HB3  GLN  78           HB1      GLN  78  -4.635   6.136   8.964
  563    HG2  GLN  78           HG2      GLN  78  -2.577   4.014   8.402
  564    HG3  GLN  78           HG1      GLN  78  -4.186   3.751   9.071
  565   HE21  GLN  78          HE21      GLN  78  -2.352   4.528   6.231
  566   HE22  GLN  78          HE22      GLN  78  -3.633   4.313   5.093
  567    H    GLY  79           HN       GLY  79  -1.364   8.780   7.493
  568    HA2  GLY  79           HA2      GLY  79  -2.825  10.949   8.279
  569    HA3  GLY  79           HA1      GLY  79  -2.058  10.401   9.762
  570    H    MET  80           HN       MET  80  -0.433   9.969   6.724
  571    HA   MET  80           HA       MET  80   1.339  12.235   7.371
  572    HB2  MET  80           HB2      MET  80   2.192   9.586   6.190
  573    HB3  MET  80           HB1      MET  80   3.243  10.933   6.605
  574    HG2  MET  80           HG2      MET  80   2.436  10.641   8.988
  575    HG3  MET  80           HG1      MET  80   1.740   9.113   8.455
  576    HE1  MET  80           HE3      MET  80   5.022   7.290   7.145
  577    HE2  MET  80           HE1      MET  80   4.043   8.409   6.196
  578    HE3  MET  80           HE2      MET  80   3.263   7.208   7.226
  579    H    ALA  81           HN       ALA  81   2.066  13.481   5.677
  580    HA   ALA  81           HA       ALA  81   0.469  13.577   3.352
  581    HB1  ALA  81           HB3      ALA  81   1.585  15.544   4.345
  582    HB2  ALA  81           HB1      ALA  81   1.914  15.366   2.620
  583    HB3  ALA  81           HB2      ALA  81   3.138  14.905   3.803
  584    H    GLN  82           HN       GLN  82   1.319  13.519   1.108
  585    HA   GLN  82           HA       GLN  82   2.198  11.030   0.362
  586    HB2  GLN  82           HB2      GLN  82   1.187  12.573  -1.217
  587    HB3  GLN  82           HB1      GLN  82   2.570  13.653  -1.096
  588    HG2  GLN  82           HG2      GLN  82   3.995  11.934  -2.094
  589    HG3  GLN  82           HG1      GLN  82   2.604  10.860  -2.221
  590   HE21  GLN  82          HE21      GLN  82   0.996  11.309  -3.734
  591   HE22  GLN  82          HE22      GLN  82   1.258  12.390  -5.055
  592    H    SER  83           HN       SER  83   4.198  13.966   0.602
  593    HA   SER  83           HA       SER  83   6.636  12.876  -0.121
  594    HG   SER  83           HG       SER  83   6.637  15.579   2.752
  595    HB2  SER  83           HB2      SER  83   7.657  14.748   1.129
  596    HB3  SER  83           HB1      SER  83   6.290  15.279   0.149
  597    H    ASP  84           HN       ASP  84   5.112  12.965   3.076
  598    HA   ASP  84           HA       ASP  84   7.284  11.940   4.531
  599    HB2  ASP  84           HB2      ASP  84   4.316  11.784   5.075
  600    HB3  ASP  84           HB1      ASP  84   5.558  11.322   6.234
  601    H    VAL  85           HN       VAL  85   4.561  10.293   2.955
  602    HA   VAL  85           HA       VAL  85   5.142   7.699   3.858
  603    HB   VAL  85           HB       VAL  85   3.893   8.388   1.198
  604   HG11  VAL  85          HG11      VAL  85   2.738   6.258   1.466
  605   HG12  VAL  85          HG12      VAL  85   3.563   5.994   3.003
  606   HG13  VAL  85          HG13      VAL  85   4.487   6.033   1.500
  607   HG21  VAL  85          HG23      VAL  85   2.775   9.641   2.960
  608   HG22  VAL  85          HG21      VAL  85   2.577   8.164   3.904
  609   HG23  VAL  85          HG22      VAL  85   1.737   8.347   2.364
  610    H    VAL  86           HN       VAL  86   6.181   9.438   0.952
  611    HA   VAL  86           HA       VAL  86   7.553   7.345  -0.297
  612    HB   VAL  86           HB       VAL  86   8.204  10.294  -0.400
  613   HG11  VAL  86          HG11      VAL  86   9.206   9.776  -2.576
  614   HG12  VAL  86          HG12      VAL  86   8.886   8.062  -2.312
  615   HG13  VAL  86          HG13      VAL  86  10.017   8.918  -1.266
  616   HG21  VAL  86          HG23      VAL  86   6.782  10.374  -2.359
  617   HG22  VAL  86          HG21      VAL  86   5.865   9.785  -0.975
  618   HG23  VAL  86          HG22      VAL  86   6.428   8.654  -2.204
  619    H    GLU  87           HN       GLU  87   8.631   9.702   2.111
  620    HA   GLU  87           HA       GLU  87  11.359   9.087   2.083
  621    HB2  GLU  87           HB2      GLU  87   9.592  10.103   4.312
  622    HB3  GLU  87           HB1      GLU  87  11.343   9.997   4.433
  623    HG2  GLU  87           HG2      GLU  87  11.592  11.552   2.592
  624    HG3  GLU  87           HG1      GLU  87   9.842  11.621   2.391
  625    H    VAL  88           HN       VAL  88   8.708   7.707   3.990
  626    HA   VAL  88           HA       VAL  88  10.199   6.012   5.625
  627    HB   VAL  88           HB       VAL  88   7.405   5.671   4.537
  628   HG11  VAL  88          HG11      VAL  88   7.070   4.036   6.345
  629   HG12  VAL  88          HG12      VAL  88   8.790   4.127   6.728
  630   HG13  VAL  88          HG13      VAL  88   8.267   3.493   5.167
  631   HG21  VAL  88          HG23      VAL  88   8.439   6.654   7.195
  632   HG22  VAL  88          HG21      VAL  88   6.740   6.424   6.781
  633   HG23  VAL  88          HG22      VAL  88   7.699   7.636   5.932
  634    H    LEU  89           HN       LEU  89   8.514   5.163   2.599
  635    HA   LEU  89           HA       LEU  89   9.340   2.542   2.389
  636    HG   LEU  89           HG       LEU  89   6.883   4.126   1.658
  637    HB2  LEU  89           HB2      LEU  89   8.864   4.533   0.171
  638    HB3  LEU  89           HB1      LEU  89   8.984   2.798  -0.055
  639   HD11  LEU  89          HD11      LEU  89   6.679   3.094  -1.167
  640   HD12  LEU  89          HD12      LEU  89   6.622   4.788  -0.675
  641   HD13  LEU  89          HD13      LEU  89   5.341   3.680  -0.180
  642   HD21  LEU  89          HD23      LEU  89   7.383   1.811   2.264
  643   HD22  LEU  89          HD21      LEU  89   7.128   1.314   0.591
  644   HD23  LEU  89          HD22      LEU  89   5.783   1.950   1.537
  645    H    ARG  90           HN       ARG  90  11.084   5.470   1.532
  646    HA   ARG  90           HA       ARG  90  13.220   4.073   0.213
  647    HE   ARG  90           HE       ARG  90  11.719   8.779   0.113
  648    HB2  ARG  90           HB2      ARG  90  12.980   6.926   1.175
  649    HB3  ARG  90           HB1      ARG  90  14.350   6.305   0.265
  650    HG2  ARG  90           HG2      ARG  90  12.851   5.765  -1.600
  651    HG3  ARG  90           HG1      ARG  90  11.496   6.432  -0.688
  652    HD2  ARG  90           HD2      ARG  90  13.959   7.940  -1.558
  653    HD3  ARG  90           HD1      ARG  90  12.368   8.041  -2.313
  654   HH11  ARG  90          HH11      ARG  90  14.587   9.618  -1.677
  655   HH12  ARG  90          HH12      ARG  90  14.769  11.161  -0.913
  656   HH21  ARG  90          HH21      ARG  90  11.949  10.810   1.123
  657   HH22  ARG  90          HH22      ARG  90  13.268  11.839   0.679
  658    H    ASN  91           HN       ASN  91  12.528   5.152   3.449
  659    HA   ASN  91           HA       ASN  91  15.188   4.987   4.449
  660    HB2  ASN  91           HB2      ASN  91  12.511   4.924   5.854
  661    HB3  ASN  91           HB1      ASN  91  14.060   4.978   6.692
  662   HD21  ASN  91          HD21      ASN  91  11.845   6.883   6.681
  663   HD22  ASN  91          HD22      ASN  91  12.516   8.388   6.163
  664    H    ALA  92           HN       ALA  92  12.728   2.678   3.778
  665    HA   ALA  92           HA       ALA  92  13.353   0.636   5.570
  666    HB1  ALA  92           HB3      ALA  92  12.373   0.375   2.730
  667    HB2  ALA  92           HB1      ALA  92  11.363   0.606   4.157
  668    HB3  ALA  92           HB2      ALA  92  12.298  -0.878   3.968
  669    H    GLY  93           HN       GLY  93  14.082   0.079   2.163
  670    HA2  GLY  93           HA2      GLY  93  15.925  -0.820   1.130
  671    HA3  GLY  93           HA1      GLY  93  16.882   0.029   2.333
  672    H    ASN  94           HN       ASN  94  14.575  -2.162   3.571
  673    HA   ASN  94           HA       ASN  94  16.434  -4.403   3.663
  674    HB2  ASN  94           HB2      ASN  94  15.671  -2.706   6.002
  675    HB3  ASN  94           HB1      ASN  94  15.869  -4.436   6.258
  676   HD21  ASN  94          HD21      ASN  94  17.908  -4.678   4.194
  677   HD22  ASN  94          HD22      ASN  94  19.347  -3.997   4.857
  678    HA   PRO  95           HA       PRO  95  12.881  -7.085   3.791
  679    HB2  PRO  95           HB2      PRO  95  13.512  -7.975   6.561
  680    HB3  PRO  95           HB1      PRO  95  13.247  -8.939   5.103
  681    HG2  PRO  95           HG2      PRO  95  15.700  -8.598   6.074
  682    HG3  PRO  95           HG1      PRO  95  15.405  -8.594   4.324
  683    HD2  PRO  95           HD2      PRO  95  15.917  -6.299   6.168
  684    HD3  PRO  95           HD1      PRO  95  16.454  -6.545   4.494
  685    H    VAL  96           HN       VAL  96  11.115  -5.767   3.863
  686    HA   VAL  96           HA       VAL  96  10.090  -5.086   6.541
  687    HB   VAL  96           HB       VAL  96   9.050  -3.069   5.546
  688   HG11  VAL  96          HG11      VAL  96  11.161  -2.910   6.758
  689   HG12  VAL  96          HG12      VAL  96  11.096  -1.740   5.441
  690   HG13  VAL  96          HG13      VAL  96  12.048  -3.214   5.266
  691   HG21  VAL  96          HG23      VAL  96   8.955  -3.765   3.226
  692   HG22  VAL  96          HG21      VAL  96  10.716  -3.796   3.138
  693   HG23  VAL  96          HG22      VAL  96   9.871  -2.265   3.367
  694    H    ARG  97           HN       ARG  97   7.852  -5.117   6.832
  695    HA   ARG  97           HA       ARG  97   6.422  -6.836   4.949
  696    HE   ARG  97           HE       ARG  97   2.146  -8.496   7.063
  697    HB2  ARG  97           HB2      ARG  97   6.488  -7.541   7.312
  698    HB3  ARG  97           HB1      ARG  97   5.721  -6.030   7.781
  699    HG2  ARG  97           HG2      ARG  97   3.735  -6.647   6.484
  700    HG3  ARG  97           HG1      ARG  97   4.504  -8.174   6.050
  701    HD2  ARG  97           HD2      ARG  97   4.612  -8.794   8.412
  702    HD3  ARG  97           HD1      ARG  97   3.858  -7.262   8.852
  703   HH11  ARG  97          HH11      ARG  97   3.474  -9.161  10.216
  704   HH12  ARG  97          HH12      ARG  97   2.105 -10.084  10.739
  705   HH21  ARG  97          HH21      ARG  97   0.342  -9.709   7.742
  706   HH22  ARG  97          HH22      ARG  97   0.323 -10.397   9.331
  707    H    LEU  98           HN       LEU  98   4.429  -6.252   4.084
  708    HA   LEU  98           HA       LEU  98   3.744  -3.398   4.349
  709    HG   LEU  98           HG       LEU  98   5.713  -4.969   2.287
  710    HB2  LEU  98           HB2      LEU  98   3.245  -5.059   1.897
  711    HB3  LEU  98           HB1      LEU  98   3.200  -3.314   2.050
  712   HD11  LEU  98          HD11      LEU  98   4.639  -3.399  -0.053
  713   HD12  LEU  98          HD12      LEU  98   4.829  -5.150   0.041
  714   HD13  LEU  98          HD13      LEU  98   6.250  -4.107   0.049
  715   HD21  LEU  98          HD23      LEU  98   5.258  -1.996   2.043
  716   HD22  LEU  98          HD21      LEU  98   6.830  -2.793   1.994
  717   HD23  LEU  98          HD22      LEU  98   5.855  -2.855   3.464
  718    H    LEU  99           HN       LEU  99   1.760  -2.983   5.093
  719    HA   LEU  99           HA       LEU  99  -0.250  -5.131   4.934
  720    HG   LEU  99           HG       LEU  99  -2.391  -3.692   6.630
  721    HB2  LEU  99           HB2      LEU  99   0.452  -4.527   7.226
  722    HB3  LEU  99           HB1      LEU  99  -0.070  -2.878   6.937
  723   HD11  LEU  99          HD11      LEU  99  -2.951  -5.974   7.316
  724   HD12  LEU  99          HD12      LEU  99  -1.234  -6.342   7.481
  725   HD13  LEU  99          HD13      LEU  99  -1.904  -5.957   5.896
  726   HD21  LEU  99          HD23      LEU  99  -2.746  -4.334   9.034
  727   HD22  LEU  99          HD21      LEU  99  -1.835  -2.847   8.777
  728   HD23  LEU  99          HD22      LEU  99  -0.992  -4.331   9.218
  729    H    LEU 100           HN       LEU 100  -1.361  -4.673   3.117
  730    HA   LEU 100           HA       LEU 100  -2.621  -2.017   2.955
  731    HG   LEU 100           HG       LEU 100  -0.093  -3.949   1.417
  732    HB2  LEU 100           HB2      LEU 100  -2.661  -2.742   0.383
  733    HB3  LEU 100           HB1      LEU 100  -1.357  -1.815   1.096
  734   HD11  LEU 100          HD11      LEU 100  -1.911  -5.527   1.431
  735   HD12  LEU 100          HD12      LEU 100  -0.823  -5.903   0.096
  736   HD13  LEU 100          HD13      LEU 100  -2.354  -5.086  -0.218
  737   HD21  LEU 100          HD23      LEU 100  -0.911  -3.256  -1.401
  738   HD22  LEU 100          HD21      LEU 100   0.516  -4.191  -0.951
  739   HD23  LEU 100          HD22      LEU 100   0.382  -2.500  -0.468
  740    H    ILE 101           HN       ILE 101  -4.771  -1.926   2.443
  741    HA   ILE 101           HA       ILE 101  -6.206  -4.473   2.579
  742    HB   ILE 101           HB       ILE 101  -6.898  -2.809   4.196
  743   HG12  ILE 101          HG12      ILE 101  -9.016  -3.017   2.046
  744   HG13  ILE 101          HG11      ILE 101  -8.600  -4.328   3.145
  745   HG21  ILE 101          HG21      ILE 101  -7.902  -0.680   3.503
  746   HG22  ILE 101          HG22      ILE 101  -7.498  -1.044   1.826
  747   HG23  ILE 101          HG23      ILE 101  -6.213  -0.804   3.010
  748   HD11  ILE 101          HD13      ILE 101  -9.694  -1.639   3.936
  749   HD12  ILE 101          HD11      ILE 101  -9.273  -2.947   5.041
  750   HD13  ILE 101          HD12      ILE 101 -10.589  -3.157   3.886
  751    H    ARG 102           HN       ARG 102  -7.637  -5.160   1.040
  752    HA   ARG 102           HA       ARG 102  -8.011  -3.498  -1.347
  753    HE   ARG 102           HE       ARG 102  -7.614  -5.065  -5.842
  754    HB2  ARG 102           HB2      ARG 102  -6.123  -4.982  -1.829
  755    HB3  ARG 102           HB1      ARG 102  -7.093  -6.379  -1.386
  756    HG2  ARG 102           HG2      ARG 102  -6.943  -6.165  -3.794
  757    HG3  ARG 102           HG1      ARG 102  -8.605  -5.919  -3.253
  758    HD2  ARG 102           HD2      ARG 102  -8.380  -3.535  -3.477
  759    HD3  ARG 102           HD1      ARG 102  -6.661  -3.690  -3.837
  760   HH11  ARG 102          HH11      ARG 102  -8.935  -2.148  -4.462
  761   HH12  ARG 102          HH12      ARG 102  -9.613  -1.596  -5.957
  762   HH21  ARG 102          HH21      ARG 102  -8.501  -4.339  -7.817
  763   HH22  ARG 102          HH22      ARG 102  -9.366  -2.840  -7.862
  764    H    ARG 103           HN       ARG 103 -10.030  -3.538  -2.113
  765    HA   ARG 103           HA       ARG 103 -11.985  -5.177  -0.742
  766    HE   ARG 103           HE       ARG 103 -12.216  -0.831  -1.508
  767    HB2  ARG 103           HB2      ARG 103 -13.641  -3.827  -1.981
  768    HB3  ARG 103           HB1      ARG 103 -12.503  -2.836  -1.079
  769    HG2  ARG 103           HG2      ARG 103 -11.229  -2.474  -3.171
  770    HG3  ARG 103           HG1      ARG 103 -12.477  -3.368  -4.041
  771    HD2  ARG 103           HD2      ARG 103 -12.859  -0.980  -4.238
  772    HD3  ARG 103           HD1      ARG 103 -14.149  -1.731  -3.300
  773   HH11  ARG 103          HH11      ARG 103 -14.470   0.498  -3.808
  774   HH12  ARG 103          HH12      ARG 103 -14.664   1.989  -2.950
  775   HH21  ARG 103          HH21      ARG 103 -12.467   1.131  -0.371
  776   HH22  ARG 103          HH22      ARG 103 -13.528   2.349  -0.997
  777    H    LEU 104           HN       LEU 104 -13.271  -6.732  -1.646
  778    HA   LEU 104           HA       LEU 104 -12.239  -7.998  -4.033
  779    HG   LEU 104           HG       LEU 104 -12.206  -8.908  -1.144
  780    HB2  LEU 104           HB2      LEU 104 -14.492  -8.789  -2.186
  781    HB3  LEU 104           HB1      LEU 104 -13.879  -9.772  -3.501
  782   HD11  LEU 104          HD11      LEU 104 -13.671 -11.500  -1.614
  783   HD12  LEU 104          HD12      LEU 104 -14.018 -10.312  -0.358
  784   HD13  LEU 104          HD13      LEU 104 -12.499 -11.208  -0.330
  785   HD21  LEU 104          HD23      LEU 104 -10.906  -9.444  -3.117
  786   HD22  LEU 104          HD21      LEU 104 -11.780 -10.963  -3.310
  787   HD23  LEU 104          HD22      LEU 104 -10.729 -10.722  -1.916
  788    HA   PRO 105           HA       PRO 105 -15.388  -6.370  -6.716
  789    HB2  PRO 105           HB2      PRO 105 -15.126  -7.980  -8.818
  790    HB3  PRO 105           HB1      PRO 105 -13.787  -6.927  -8.332
  791    HG2  PRO 105           HG2      PRO 105 -14.218  -9.835  -7.720
  792    HG3  PRO 105           HG1      PRO 105 -12.753  -9.038  -8.331
  793    HD2  PRO 105           HD2      PRO 105 -13.140  -9.640  -5.700
  794    HD3  PRO 105           HD1      PRO 105 -12.168  -8.257  -6.243
  795    H    LEU 106           HN       LEU 106 -16.718  -7.516  -4.806
  796    HA   LEU 106           HA       LEU 106 -18.255  -9.796  -5.708
  797    HG   LEU 106           HG       LEU 106 -16.415  -9.128  -3.206
  798    HB2  LEU 106           HB2      LEU 106 -18.671  -8.085  -3.258
  799    HB3  LEU 106           HB1      LEU 106 -19.365  -9.666  -3.561
  800   HD11  LEU 106          HD11      LEU 106 -18.416 -10.306  -1.285
  801   HD12  LEU 106          HD12      LEU 106 -17.658  -8.719  -1.147
  802   HD13  LEU 106          HD13      LEU 106 -16.676 -10.178  -1.023
  803   HD21  LEU 106          HD23      LEU 106 -16.227 -11.551  -3.047
  804   HD22  LEU 106          HD21      LEU 106 -16.908 -11.078  -4.603
  805   HD23  LEU 106          HD22      LEU 106 -17.959 -11.716  -3.339
  806    H    LEU 107           HN       LEU 107 -19.816  -9.501  -7.159
  807    HA   LEU 107           HA       LEU 107 -21.230  -6.960  -7.301
  808    HG   LEU 107           HG       LEU 107 -20.498  -7.835 -10.834
  809    HB2  LEU 107           HB2      LEU 107 -21.107  -9.384  -9.069
  810    HB3  LEU 107           HB1      LEU 107 -22.358  -8.175  -9.286
  811   HD11  LEU 107          HD11      LEU 107 -20.597  -5.662  -8.754
  812   HD12  LEU 107          HD12      LEU 107 -21.832  -5.933  -9.982
  813   HD13  LEU 107          HD13      LEU 107 -20.194  -5.485 -10.462
  814   HD21  LEU 107          HD23      LEU 107 -18.831  -7.373  -8.363
  815   HD22  LEU 107          HD21      LEU 107 -18.308  -7.138 -10.031
  816   HD23  LEU 107          HD22      LEU 107 -18.700  -8.756  -9.450
  817    H    GLU 108           HN       GLU 108 -22.637  -6.881  -5.607
  818    HA   GLU 108           HA       GLU 108 -24.292  -9.113  -4.886
  819    HB2  GLU 108           HB2      GLU 108 -24.475  -6.217  -4.033
  820    HB3  GLU 108           HB1      GLU 108 -25.306  -7.568  -3.276
  821    HG2  GLU 108           HG2      GLU 108 -22.321  -7.200  -3.404
  822    HG3  GLU 108           HG1      GLU 108 -23.344  -6.865  -2.006
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1  -5.514 -16.578  12.469
    2    H2   GLY   1           HT2      GLY   1  -6.783 -15.900  11.578
    3    H3   GLY   1           HT3      GLY   1  -6.069 -15.022  12.835
    4    HA2  GLY   1           HA1      GLY   1  -3.974 -14.940  11.623
    5    HA3  GLY   1           HA2      GLY   1  -4.731 -15.832  10.313
    6    H    SER   2           HN       SER   2  -7.190 -14.056  11.315
    7    HA   SER   2           HA       SER   2  -6.708 -12.003   9.303
    8    HG   SER   2           HG       SER   2  -8.889 -14.321   9.395
    9    HB2  SER   2           HB2      SER   2  -9.220 -12.720  10.833
   10    HB3  SER   2           HB1      SER   2  -9.122 -11.521   9.544
   11    H    HIS   3           HN       HIS   3  -7.432  -9.764   9.754
   12    HA   HIS   3           HA       HIS   3  -7.146  -8.985  12.566
   13    HD1  HIS   3           HD1      HIS   3  -3.811  -9.433   9.773
   14    HD2  HIS   3           HD2      HIS   3  -4.484  -9.034  13.854
   15    HE1  HIS   3           HE1      HIS   3  -2.029 -10.814  10.886
   16    HE2  HIS   3           HE2      HIS   3  -2.408 -10.495  13.356
   17    HB2  HIS   3           HB2      HIS   3  -5.593  -7.774  10.269
   18    HB3  HIS   3           HB1      HIS   3  -5.627  -7.136  11.911
   19    H    GLY   4           HN       GLY   4  -9.390  -9.135  10.631
   20    HA2  GLY   4           HA2      GLY   4 -10.732  -6.781  11.342
   21    HA3  GLY   4           HA1      GLY   4 -10.100  -6.569   9.716
   22    H    TYR   5           HN       TYR   5 -11.182  -7.422   8.038
   23    HA   TYR   5           HA       TYR   5 -13.575  -9.009   8.674
   24    HD1  TYR   5           HD2      TYR   5 -12.392  -5.383   7.769
   25    HD2  TYR   5           HD1      TYR   5 -16.199  -7.274   7.935
   26    HE1  TYR   5           HE2      TYR   5 -13.295  -3.444   8.984
   27    HE2  TYR   5           HE1      TYR   5 -17.112  -5.343   9.151
   28    HH   TYR   5           HH       TYR   5 -15.458  -2.382   9.408
   29    HB2  TYR   5           HB2      TYR   5 -13.006  -7.284   6.254
   30    HB3  TYR   5           HB1      TYR   5 -14.496  -8.173   6.550
   31    H    SER   6           HN       SER   6 -14.216 -10.667   7.151
   32    HA   SER   6           HA       SER   6 -11.915 -11.866   5.752
   33    HG   SER   6           HG       SER   6 -12.830 -12.761   8.740
   34    HB2  SER   6           HB2      SER   6 -14.193 -13.284   7.158
   35    HB3  SER   6           HB1      SER   6 -12.890 -14.075   6.270
   36    H    ASP   7           HN       ASP   7 -12.351 -11.110   3.717
   37    HA   ASP   7           HA       ASP   7 -13.332 -10.955   1.672
   38    HB2  ASP   7           HB2      ASP   7 -14.707 -13.496   2.573
   39    HB3  ASP   7           HB1      ASP   7 -14.613 -12.918   0.912
   40    H    ALA   8           HN       ALA   8 -14.493  -9.295   3.481
   41    HA   ALA   8           HA       ALA   8 -17.386  -9.610   3.231
   42    HB1  ALA   8           HB3      ALA   8 -17.536  -7.738   4.791
   43    HB2  ALA   8           HB1      ALA   8 -15.784  -7.545   4.739
   44    HB3  ALA   8           HB2      ALA   8 -16.490  -9.009   5.425
   45    H    SER   9           HN       SER   9 -18.317  -8.837   1.464
   46    HA   SER   9           HA       SER   9 -18.822  -7.544  -0.334
   47    HG   SER   9           HG       SER   9 -20.371  -6.030   1.002
   48    HB2  SER   9           HB2      SER   9 -17.651  -5.367   1.413
   49    HB3  SER   9           HB1      SER   9 -18.631  -5.097  -0.027
   50    H    GLY  10           HN       GLY  10 -16.121  -8.785  -0.118
   51    HA2  GLY  10           HA2      GLY  10 -14.516  -8.955  -1.831
   52    HA3  GLY  10           HA1      GLY  10 -14.939  -7.332  -2.358
   53    H    PHE  11           HN       PHE  11 -14.705  -6.123   0.255
   54    HA   PHE  11           HA       PHE  11 -11.956  -5.481   0.202
   55    HD1  PHE  11           HD1      PHE  11 -15.761  -4.329   0.745
   56    HD2  PHE  11           HD2      PHE  11 -11.927  -2.483   0.656
   57    HE1  PHE  11           HE1      PHE  11 -16.655  -2.549  -0.699
   58    HE2  PHE  11           HE2      PHE  11 -12.816  -0.698  -0.786
   59    HZ   PHE  11           HZ       PHE  11 -15.183  -0.730  -1.467
   60    HB2  PHE  11           HB2      PHE  11 -14.032  -4.939   2.333
   61    HB3  PHE  11           HB1      PHE  11 -12.437  -4.197   2.267
   62    H    SER  12           HN       SER  12 -10.371  -6.773   0.816
   63    HA   SER  12           HA       SER  12 -10.629  -8.211   3.361
   64    HG   SER  12           HG       SER  12  -8.443 -10.100   2.681
   65    HB2  SER  12           HB2      SER  12 -11.060  -9.857   1.606
   66    HB3  SER  12           HB1      SER  12  -9.569  -9.399   0.784
   67    H    LEU  13           HN       LEU  13  -8.794  -8.296   4.583
   68    HA   LEU  13           HA       LEU  13  -6.693  -6.457   3.890
   69    HG   LEU  13           HG       LEU  13  -8.762  -6.533   6.124
   70    HB2  LEU  13           HB2      LEU  13  -6.969  -8.297   6.269
   71    HB3  LEU  13           HB1      LEU  13  -5.786  -7.013   6.104
   72   HD11  LEU  13          HD11      LEU  13  -8.080  -7.494   8.254
   73   HD12  LEU  13          HD12      LEU  13  -8.458  -5.780   8.433
   74   HD13  LEU  13          HD13      LEU  13  -6.777  -6.313   8.383
   75   HD21  LEU  13          HD23      LEU  13  -7.505  -4.784   5.034
   76   HD22  LEU  13          HD21      LEU  13  -6.377  -4.710   6.387
   77   HD23  LEU  13          HD22      LEU  13  -8.057  -4.216   6.610
   78    H    TYR  14           HN       TYR  14  -4.922  -6.951   2.795
   79    HA   TYR  14           HA       TYR  14  -4.037  -9.759   2.757
   80    HD1  TYR  14           HD1      TYR  14  -6.435  -7.955   0.480
   81    HD2  TYR  14           HD2      TYR  14  -3.741 -11.210  -0.032
   82    HE1  TYR  14           HE1      TYR  14  -8.235  -9.275  -0.550
   83    HE2  TYR  14           HE2      TYR  14  -5.536 -12.537  -1.064
   84    HH   TYR  14           HH       TYR  14  -8.489 -11.180  -2.062
   85    HB2  TYR  14           HB2      TYR  14  -3.991  -7.639   0.625
   86    HB3  TYR  14           HB1      TYR  14  -2.914  -9.030   0.549
   87    H    SER  15           HN       SER  15  -2.076 -10.223   3.484
   88    HA   SER  15           HA       SER  15  -0.321  -7.998   4.239
   89    HG   SER  15           HG       SER  15   1.375  -8.717   5.654
   90    HB2  SER  15           HB2      SER  15  -0.947  -9.504   6.059
   91    HB3  SER  15           HB1      SER  15  -0.328 -10.884   5.152
   92    H    VAL  16           HN       VAL  16   1.703  -7.776   3.464
   93    HA   VAL  16           HA       VAL  16   2.746  -9.862   1.671
   94    HB   VAL  16           HB       VAL  16   3.063  -6.922   1.089
   95   HG11  VAL  16          HG11      VAL  16   4.703  -8.361   0.053
   96   HG12  VAL  16          HG12      VAL  16   3.591  -7.756  -1.174
   97   HG13  VAL  16          HG13      VAL  16   3.433  -9.407  -0.577
   98   HG21  VAL  16          HG23      VAL  16   0.969  -8.794  -0.017
   99   HG22  VAL  16          HG21      VAL  16   1.294  -7.161  -0.600
  100   HG23  VAL  16          HG22      VAL  16   0.681  -7.408   1.035
  101    H    GLU  17           HN       GLU  17   5.094  -9.769   1.374
  102    HA   GLU  17           HA       GLU  17   6.515  -8.285   3.470
  103    HB2  GLU  17           HB2      GLU  17   6.854 -11.235   2.907
  104    HB3  GLU  17           HB1      GLU  17   7.854 -10.290   4.002
  105    HG2  GLU  17           HG2      GLU  17   5.891  -9.831   5.390
  106    HG3  GLU  17           HG1      GLU  17   4.903 -10.803   4.300
  107    H    LEU  18           HN       LEU  18   7.926  -7.038   2.454
  108    HA   LEU  18           HA       LEU  18   9.441  -8.172   0.195
  109    HG   LEU  18           HG       LEU  18   7.836  -5.667  -1.939
  110    HB2  LEU  18           HB2      LEU  18   8.072  -5.557   0.491
  111    HB3  LEU  18           HB1      LEU  18   9.631  -5.543  -0.308
  112   HD11  LEU  18          HD11      LEU  18   9.935  -6.770  -2.478
  113   HD12  LEU  18          HD12      LEU  18   8.571  -7.643  -3.176
  114   HD13  LEU  18          HD13      LEU  18   9.361  -8.258  -1.724
  115   HD21  LEU  18          HD23      LEU  18   6.324  -7.536  -2.061
  116   HD22  LEU  18          HD21      LEU  18   6.184  -6.776  -0.476
  117   HD23  LEU  18          HD22      LEU  18   7.079  -8.285  -0.654
  118    H    PHE  19           HN       PHE  19  11.557  -7.012  -0.161
  119    HA   PHE  19           HA       PHE  19  12.704  -5.927   2.299
  120    HD1  PHE  19           HD2      PHE  19  12.032  -9.647   0.847
  121    HD2  PHE  19           HD1      PHE  19  15.775  -7.839  -0.060
  122    HE1  PHE  19           HE2      PHE  19  12.295 -11.165  -1.072
  123    HE2  PHE  19           HE1      PHE  19  16.045  -9.352  -1.980
  124    HZ   PHE  19           HZ       PHE  19  14.312 -11.027  -2.481
  125    HB2  PHE  19           HB2      PHE  19  14.703  -7.415   2.022
  126    HB3  PHE  19           HB1      PHE  19  13.232  -8.261   2.488
  127    H    ARG  20           HN       ARG  20  14.041  -4.258   1.944
  128    HA   ARG  20           HA       ARG  20  14.764  -3.702  -0.852
  129    HE   ARG  20           HE       ARG  20  12.861   0.181  -0.070
  130    HB2  ARG  20           HB2      ARG  20  13.478  -1.950   0.280
  131    HB3  ARG  20           HB1      ARG  20  14.702  -1.850   1.538
  132    HG2  ARG  20           HG2      ARG  20  16.345  -1.168  -0.199
  133    HG3  ARG  20           HG1      ARG  20  15.025  -1.128  -1.366
  134    HD2  ARG  20           HD2      ARG  20  15.025   0.463   1.189
  135    HD3  ARG  20           HD1      ARG  20  15.652   1.086  -0.335
  136   HH11  ARG  20          HH11      ARG  20  15.226   2.579  -0.965
  137   HH12  ARG  20          HH12      ARG  20  14.061   3.658  -1.655
  138   HH21  ARG  20          HH21      ARG  20  11.319   1.603  -0.971
  139   HH22  ARG  20          HH22      ARG  20  11.842   3.103  -1.660
  140    H    GLU  21           HN       GLU  21  16.625  -4.902  -1.107
  141    HA   GLU  21           HA       GLU  21  18.934  -3.979   0.466
  142    HB2  GLU  21           HB2      GLU  21  19.867  -6.235   0.434
  143    HB3  GLU  21           HB1      GLU  21  18.299  -6.224   1.229
  144    HG2  GLU  21           HG2      GLU  21  17.256  -7.108  -0.781
  145    HG3  GLU  21           HG1      GLU  21  18.810  -7.081  -1.611
  146    H    LYS  22           HN       LYS  22  17.531  -4.049  -2.470
  147    HA   LYS  22           HA       LYS  22  19.910  -4.581  -4.051
  148    HB2  LYS  22           HB2      LYS  22  17.163  -3.643  -4.904
  149    HB3  LYS  22           HB1      LYS  22  18.454  -4.150  -5.984
  150    HG2  LYS  22           HG2      LYS  22  17.149  -5.919  -3.924
  151    HG3  LYS  22           HG1      LYS  22  16.722  -5.876  -5.635
  152    HD2  LYS  22           HD2      LYS  22  19.481  -6.513  -4.594
  153    HD3  LYS  22           HD1      LYS  22  18.272  -7.732  -5.000
  154    HE2  LYS  22           HE2      LYS  22  19.397  -5.676  -6.900
  155    HE3  LYS  22           HE1      LYS  22  19.880  -7.371  -6.824
  156    HZ1  LYS  22           HZ3      LYS  22  18.293  -7.029  -8.588
  157    HZ2  LYS  22           HZ1      LYS  22  17.177  -6.349  -7.512
  158    HZ3  LYS  22           HZ2      LYS  22  17.591  -7.984  -7.380
  159    H    ASP  23           HN       ASP  23  20.651  -2.996  -5.659
  160    HA   ASP  23           HA       ASP  23  20.957  -0.394  -4.428
  161    HB2  ASP  23           HB2      ASP  23  22.125  -1.509  -6.988
  162    HB3  ASP  23           HB1      ASP  23  22.581   0.018  -6.237
  163    H    THR  24           HN       THR  24  18.321  -0.889  -5.262
  164    HA   THR  24           HA       THR  24  17.989   0.679  -7.712
  165    HB   THR  24           HB       THR  24  15.647   0.006  -7.656
  166    HG1  THR  24           HG1      THR  24  16.383  -1.177  -5.173
  167   HG21  THR  24          HG23      THR  24  17.296  -1.514  -8.682
  168   HG22  THR  24          HG21      THR  24  15.926  -2.387  -7.996
  169   HG23  THR  24          HG22      THR  24  17.466  -2.349  -7.138
  170    H    SER  25           HN       SER  25  17.793   0.951  -4.310
  171    HA   SER  25           HA       SER  25  17.169   2.612  -2.890
  172    HG   SER  25           HG       SER  25  18.198   5.698  -3.339
  173    HB2  SER  25           HB2      SER  25  18.747   3.898  -4.307
  174    HB3  SER  25           HB1      SER  25  17.405   4.360  -5.352
  175    H    SER  26           HN       SER  26  15.129   1.247  -4.746
  176    HA   SER  26           HA       SER  26  12.873   2.829  -3.843
  177    HG   SER  26           HG       SER  26  12.919   4.760  -5.703
  178    HB2  SER  26           HB2      SER  26  13.253   2.187  -6.777
  179    HB3  SER  26           HB1      SER  26  11.818   2.923  -6.065
  180    H    LEU  27           HN       LEU  27  10.876   1.678  -3.885
  181    HA   LEU  27           HA       LEU  27  11.257  -1.232  -3.938
  182    HG   LEU  27           HG       LEU  27  11.489   0.024  -1.372
  183    HB2  LEU  27           HB2      LEU  27   9.304   0.543  -2.496
  184    HB3  LEU  27           HB1      LEU  27   9.035  -1.182  -2.650
  185   HD11  LEU  27          HD11      LEU  27   8.986  -1.062  -0.088
  186   HD12  LEU  27          HD12      LEU  27   9.518   0.620  -0.086
  187   HD13  LEU  27          HD13      LEU  27  10.463  -0.604   0.762
  188   HD21  LEU  27          HD23      LEU  27  10.386  -2.784  -1.394
  189   HD22  LEU  27          HD21      LEU  27  11.794  -2.241  -0.482
  190   HD23  LEU  27          HD22      LEU  27  11.825  -2.222  -2.245
  191    H    GLY  28           HN       GLY  28   9.646   1.353  -5.514
  192    HA2  GLY  28           HA2      GLY  28   8.729   1.043  -7.700
  193    HA3  GLY  28           HA1      GLY  28   8.291  -0.596  -7.249
  194    H    ILE  29           HN       ILE  29   7.534   1.387  -4.706
  195    HA   ILE  29           HA       ILE  29   4.720   1.147  -5.205
  196    HB   ILE  29           HB       ILE  29   6.121   2.651  -2.991
  197   HG12  ILE  29          HG12      ILE  29   6.798   0.304  -3.000
  198   HG13  ILE  29          HG11      ILE  29   5.736   0.627  -1.634
  199   HG21  ILE  29          HG21      ILE  29   3.291   1.640  -3.230
  200   HG22  ILE  29          HG22      ILE  29   3.811   3.325  -3.247
  201   HG23  ILE  29          HG23      ILE  29   3.997   2.358  -1.783
  202   HD11  ILE  29          HD13      ILE  29   3.875  -0.386  -2.831
  203   HD12  ILE  29          HD11      ILE  29   5.229  -1.507  -2.690
  204   HD13  ILE  29          HD12      ILE  29   4.922  -0.685  -4.219
  205    H    SER  30           HN       SER  30   3.763   2.458  -6.636
  206    HA   SER  30           HA       SER  30   4.535   5.300  -6.655
  207    HG   SER  30           HG       SER  30   3.565   5.555 -10.076
  208    HB2  SER  30           HB2      SER  30   4.897   4.168  -8.803
  209    HB3  SER  30           HB1      SER  30   3.207   3.667  -8.833
  210    H    ILE  31           HN       ILE  31   3.196   6.040  -5.041
  211    HA   ILE  31           HA       ILE  31   0.340   5.494  -5.192
  212    HB   ILE  31           HB       ILE  31   0.225   6.879  -3.108
  213   HG12  ILE  31          HG12      ILE  31   3.247   6.769  -3.280
  214   HG13  ILE  31          HG11      ILE  31   2.279   8.212  -3.560
  215   HG21  ILE  31          HG21      ILE  31   1.240   5.167  -1.678
  216   HG22  ILE  31          HG22      ILE  31   2.114   4.529  -3.070
  217   HG23  ILE  31          HG23      ILE  31   0.353   4.452  -3.024
  218   HD11  ILE  31          HD13      ILE  31   1.480   8.119  -1.255
  219   HD12  ILE  31          HD11      ILE  31   3.240   8.215  -1.335
  220   HD13  ILE  31          HD12      ILE  31   2.455   6.676  -0.978
  221    H    SER  32           HN       SER  32  -1.151   7.396  -4.836
  222    HA   SER  32           HA       SER  32  -0.233   9.821  -6.203
  223    HG   SER  32           HG       SER  32  -2.656   7.157  -6.769
  224    HB2  SER  32           HB2      SER  32  -2.295   9.843  -7.579
  225    HB3  SER  32           HB1      SER  32  -1.275   8.451  -7.935
  226    H    GLY  33           HN       GLY  33  -1.212  11.703  -5.540
  227    HA2  GLY  33           HA2      GLY  33  -2.358  11.748  -2.964
  228    HA3  GLY  33           HA1      GLY  33  -2.284  13.107  -4.076
  229    H    MET  34           HN       MET  34  -4.374  11.553  -2.266
  230    HA   MET  34           HA       MET  34  -6.490  10.837  -3.992
  231    HB2  MET  34           HB2      MET  34  -6.400  10.078  -1.675
  232    HB3  MET  34           HB1      MET  34  -6.546  11.733  -1.104
  233    HG2  MET  34           HG2      MET  34  -8.658  10.636  -0.881
  234    HG3  MET  34           HG1      MET  34  -8.779  11.859  -2.142
  235    HE1  MET  34           HE3      MET  34 -11.038  10.772  -3.021
  236    HE2  MET  34           HE1      MET  34 -10.937   9.559  -1.744
  237    HE3  MET  34           HE2      MET  34 -11.208   9.062  -3.415
  238    H    ARG  35           HN       ARG  35  -8.252  11.959  -4.732
  239    HA   ARG  35           HA       ARG  35  -8.095  14.888  -4.485
  240    HE   ARG  35           HE       ARG  35  -7.971  16.361  -7.709
  241    HB2  ARG  35           HB2      ARG  35  -9.420  13.265  -6.665
  242    HB3  ARG  35           HB1      ARG  35  -9.243  15.013  -6.629
  243    HG2  ARG  35           HG2      ARG  35  -6.963  13.052  -6.735
  244    HG3  ARG  35           HG1      ARG  35  -7.631  13.910  -8.123
  245    HD2  ARG  35           HD2      ARG  35  -6.404  15.207  -5.692
  246    HD3  ARG  35           HD1      ARG  35  -5.592  14.976  -7.240
  247   HH11  ARG  35          HH11      ARG  35  -4.916  16.841  -6.100
  248   HH12  ARG  35          HH12      ARG  35  -4.915  18.556  -6.337
  249   HH21  ARG  35          HH21      ARG  35  -7.978  18.618  -8.023
  250   HH22  ARG  35          HH22      ARG  35  -6.655  19.567  -7.430
  251    H    ASP  36           HN       ASP  36  -9.583  15.801  -3.270
  252    HA   ASP  36           HA       ASP  36 -12.083  14.354  -2.746
  253    HB2  ASP  36           HB2      ASP  36 -10.739  16.588  -1.217
  254    HB3  ASP  36           HB1      ASP  36 -12.289  15.873  -0.784
  255    H    GLN  37           HN       GLN  37 -11.113  17.784  -2.911
  256    HA   GLN  37           HA       GLN  37 -12.125  19.612  -3.801
  257    HB2  GLN  37           HB2      GLN  37 -13.332  17.562  -5.668
  258    HB3  GLN  37           HB1      GLN  37 -13.419  19.303  -5.901
  259    HG2  GLN  37           HG2      GLN  37 -10.952  19.373  -6.001
  260    HG3  GLN  37           HG1      GLN  37 -10.928  17.614  -5.881
  261   HE21  GLN  37          HE21      GLN  37 -11.654  16.378  -7.617
  262   HE22  GLN  37          HE22      GLN  37 -11.837  17.040  -9.202
  263    H    SER  38           HN       SER  38 -13.269  19.767  -1.755
  264    HA   SER  38           HA       SER  38 -15.120  20.134  -0.493
  265    HG   SER  38           HG       SER  38 -14.907  21.984  -1.804
  266    HB2  SER  38           HB2      SER  38 -16.484  20.210  -3.196
  267    HB3  SER  38           HB1      SER  38 -17.186  20.787  -1.685
  268    H    THR  39           HN       THR  39 -15.049  18.081   0.497
  269    HA   THR  39           HA       THR  39 -17.262  16.325  -0.312
  270    HB   THR  39           HB       THR  39 -15.931  14.332   0.248
  271    HG1  THR  39           HG1      THR  39 -13.465  15.250   0.091
  272   HG21  THR  39          HG23      THR  39 -16.059  15.065  -2.085
  273   HG22  THR  39          HG21      THR  39 -14.495  14.328  -1.737
  274   HG23  THR  39          HG22      THR  39 -14.638  16.082  -1.848
  275    H    THR  40           HN       THR  40 -18.492  15.569   1.331
  276    HA   THR  40           HA       THR  40 -17.684  16.330   4.059
  277    HB   THR  40           HB       THR  40 -19.718  17.460   3.328
  278    HG1  THR  40           HG1      THR  40 -21.096  15.973   5.000
  279   HG21  THR  40          HG23      THR  40 -20.506  15.867   1.666
  280   HG22  THR  40          HG21      THR  40 -21.769  16.174   2.860
  281   HG23  THR  40          HG22      THR  40 -20.833  14.680   2.930
  282    H    GLY  41           HN       GLY  41 -17.168  13.806   2.416
  283    HA2  GLY  41           HA2      GLY  41 -18.283  11.895   4.376
  284    HA3  GLY  41           HA1      GLY  41 -18.021  11.493   2.685
  285    H    GLU  42           HN       GLU  42 -15.736  11.626   1.916
  286    HA   GLU  42           HA       GLU  42 -13.991  10.452   3.948
  287    HB2  GLU  42           HB2      GLU  42 -13.803  10.523   0.935
  288    HB3  GLU  42           HB1      GLU  42 -12.576   9.815   1.976
  289    HG2  GLU  42           HG2      GLU  42 -14.225   8.224   2.829
  290    HG3  GLU  42           HG1      GLU  42 -15.444   8.927   1.768
  291    H    ALA  43           HN       ALA  43 -11.610  10.981   3.714
  292    HA   ALA  43           HA       ALA  43 -11.087  13.724   2.868
  293    HB1  ALA  43           HB3      ALA  43 -11.813  13.918   5.202
  294    HB2  ALA  43           HB1      ALA  43 -10.115  14.355   5.009
  295    HB3  ALA  43           HB2      ALA  43 -10.549  12.785   5.685
  296    H    THR  44           HN       THR  44  -9.516  13.305   1.442
  297    HA   THR  44           HA       THR  44  -7.587  12.542   0.505
  298    HB   THR  44           HB       THR  44  -5.577  12.685   1.861
  299    HG1  THR  44           HG1      THR  44  -6.399  11.667   3.761
  300   HG21  THR  44          HG23      THR  44  -7.598  14.817   2.562
  301   HG22  THR  44          HG21      THR  44  -6.544  14.790   1.147
  302   HG23  THR  44          HG22      THR  44  -5.852  14.972   2.759
  303    H    GLY  45           HN       GLY  45  -5.537  10.915   1.355
  304    HA2  GLY  45           HA2      GLY  45  -5.738   8.656   2.691
  305    HA3  GLY  45           HA1      GLY  45  -6.908   8.332   1.421
  306    H    ILE  46           HN       ILE  46  -3.952   7.539   2.290
  307    HA   ILE  46           HA       ILE  46  -2.576   7.920  -0.238
  308    HB   ILE  46           HB       ILE  46  -1.714   6.358   2.201
  309   HG12  ILE  46          HG12      ILE  46  -2.024   8.762   2.668
  310   HG13  ILE  46          HG11      ILE  46  -0.331   8.294   2.748
  311   HG21  ILE  46          HG21      ILE  46  -0.160   7.266  -0.216
  312   HG22  ILE  46          HG22      ILE  46  -0.577   5.604   0.203
  313   HG23  ILE  46          HG23      ILE  46   0.538   6.517   1.221
  314   HD11  ILE  46          HD13      ILE  46  -0.609  10.438   1.646
  315   HD12  ILE  46          HD11      ILE  46  -1.663   9.695   0.442
  316   HD13  ILE  46          HD12      ILE  46   0.037   9.236   0.530
  317    H    TYR  47           HN       TYR  47  -2.658   6.537  -1.885
  318    HA   TYR  47           HA       TYR  47  -3.048   3.695  -1.399
  319    HD1  TYR  47           HD1      TYR  47  -5.408   7.045  -2.020
  320    HD2  TYR  47           HD2      TYR  47  -4.870   4.276  -5.205
  321    HE1  TYR  47           HE1      TYR  47  -6.031   8.791  -3.635
  322    HE2  TYR  47           HE2      TYR  47  -5.490   6.015  -6.830
  323    HH   TYR  47           HH       TYR  47  -6.724   8.109  -6.906
  324    HB2  TYR  47           HB2      TYR  47  -4.918   3.505  -2.955
  325    HB3  TYR  47           HB1      TYR  47  -5.336   4.584  -1.628
  326    H    VAL  48           HN       VAL  48  -2.252   2.381  -3.016
  327    HA   VAL  48           HA       VAL  48  -0.410   3.643  -4.851
  328    HB   VAL  48           HB       VAL  48  -1.019   0.714  -4.408
  329   HG11  VAL  48          HG11      VAL  48   1.094   0.307  -5.589
  330   HG12  VAL  48          HG12      VAL  48   1.231   2.032  -5.927
  331   HG13  VAL  48          HG13      VAL  48  -0.094   1.098  -6.623
  332   HG21  VAL  48          HG23      VAL  48   1.305   2.364  -3.425
  333   HG22  VAL  48          HG21      VAL  48   1.012   0.655  -3.104
  334   HG23  VAL  48          HG22      VAL  48  -0.075   1.876  -2.442
  335    H    LYS  49           HN       LYS  49  -0.803   4.073  -6.924
  336    HA   LYS  49           HA       LYS  49  -3.214   2.912  -8.143
  337    HB2  LYS  49           HB2      LYS  49  -3.172   5.377  -7.944
  338    HB3  LYS  49           HB1      LYS  49  -1.712   5.416  -8.923
  339    HG2  LYS  49           HG2      LYS  49  -2.924   4.495 -10.813
  340    HG3  LYS  49           HG1      LYS  49  -4.389   4.380  -9.835
  341    HD2  LYS  49           HD2      LYS  49  -2.935   6.960 -10.411
  342    HD3  LYS  49           HD1      LYS  49  -4.311   6.370 -11.344
  343    HE2  LYS  49           HE2      LYS  49  -4.311   6.996  -8.393
  344    HE3  LYS  49           HE1      LYS  49  -5.003   8.005  -9.662
  345    HZ1  LYS  49           HZ3      LYS  49  -6.702   6.690  -8.578
  346    HZ2  LYS  49           HZ1      LYS  49  -5.883   5.258  -8.955
  347    HZ3  LYS  49           HZ2      LYS  49  -6.538   6.207 -10.191
  348    H    SER  50           HN       SER  50   0.213   3.093  -8.355
  349    HA   SER  50           HA       SER  50   0.187   1.225 -10.570
  350    HG   SER  50           HG       SER  50   1.695   4.155  -9.726
  351    HB2  SER  50           HB2      SER  50   1.795   2.551 -11.915
  352    HB3  SER  50           HB1      SER  50   0.231   3.351 -11.756
  353    H    LEU  51           HN       LEU  51   2.485   0.524 -11.103
  354    HA   LEU  51           HA       LEU  51   4.230   0.648  -8.743
  355    HG   LEU  51           HG       LEU  51   1.794  -1.068  -8.481
  356    HB2  LEU  51           HB2      LEU  51   3.442  -1.859 -10.231
  357    HB3  LEU  51           HB1      LEU  51   4.679  -1.775  -8.992
  358   HD11  LEU  51          HD11      LEU  51   1.912  -3.389  -9.180
  359   HD12  LEU  51          HD12      LEU  51   1.597  -3.282  -7.449
  360   HD13  LEU  51          HD13      LEU  51   3.212  -3.688  -8.027
  361   HD21  LEU  51          HD23      LEU  51   4.076  -1.735  -6.626
  362   HD22  LEU  51          HD21      LEU  51   2.421  -1.359  -6.145
  363   HD23  LEU  51          HD22      LEU  51   3.418  -0.124  -6.915
  364    H    ILE  52           HN       ILE  52   6.443  -0.199  -9.230
  365    HA   ILE  52           HA       ILE  52   7.226   0.609 -11.950
  366    HB   ILE  52           HB       ILE  52   8.928   0.511  -9.455
  367   HG12  ILE  52          HG12      ILE  52   7.242   2.274  -9.304
  368   HG13  ILE  52          HG11      ILE  52   8.839   2.975  -9.543
  369   HG21  ILE  52          HG21      ILE  52  10.240   0.151 -11.453
  370   HG22  ILE  52          HG22      ILE  52  10.562   1.759 -10.805
  371   HG23  ILE  52          HG23      ILE  52   9.518   1.570 -12.214
  372   HD11  ILE  52          HD13      ILE  52   8.330   3.312 -11.908
  373   HD12  ILE  52          HD11      ILE  52   7.166   4.127 -10.864
  374   HD13  ILE  52          HD12      ILE  52   6.728   2.617 -11.660
  375    HA   PRO  53           HA       PRO  53   7.764  -3.926 -12.362
  376    HB2  PRO  53           HB2      PRO  53   8.759  -2.887 -14.978
  377    HB3  PRO  53           HB1      PRO  53   7.678  -4.244 -14.645
  378    HG2  PRO  53           HG2      PRO  53   6.711  -1.939 -15.551
  379    HG3  PRO  53           HG1      PRO  53   5.837  -2.869 -14.319
  380    HD2  PRO  53           HD2      PRO  53   7.449  -0.378 -14.027
  381    HD3  PRO  53           HD1      PRO  53   5.992  -0.891 -13.153
  382    H    GLY  54           HN       GLY  54   9.535  -5.176 -12.069
  383    HA2  GLY  54           HA2      GLY  54  11.819  -5.756 -12.291
  384    HA3  GLY  54           HA1      GLY  54  12.185  -4.076 -12.658
  385    H    SER  55           HN       SER  55  10.452  -3.289 -10.292
  386    HA   SER  55           HA       SER  55  12.589  -3.225  -8.380
  387    HG   SER  55           HG       SER  55   8.926  -1.637  -8.411
  388    HB2  SER  55           HB2      SER  55  11.127  -1.836  -7.052
  389    HB3  SER  55           HB1      SER  55  10.979  -1.339  -8.738
  390    H    ALA  56           HN       ALA  56  11.692  -3.535  -5.942
  391    HA   ALA  56           HA       ALA  56  11.490  -6.333  -5.599
  392    HB1  ALA  56           HB3      ALA  56  12.563  -4.838  -3.969
  393    HB2  ALA  56           HB1      ALA  56  11.331  -5.860  -3.229
  394    HB3  ALA  56           HB2      ALA  56  10.983  -4.163  -3.567
  395    H    ALA  57           HN       ALA  57   9.145  -3.757  -4.823
  396    HA   ALA  57           HA       ALA  57   7.025  -5.396  -4.084
  397    HB1  ALA  57           HB3      ALA  57   6.867  -2.699  -5.424
  398    HB2  ALA  57           HB1      ALA  57   7.079  -2.977  -3.696
  399    HB3  ALA  57           HB2      ALA  57   5.587  -3.477  -4.494
  400    H    ALA  58           HN       ALA  58   8.094  -4.387  -7.273
  401    HA   ALA  58           HA       ALA  58   5.782  -5.265  -8.677
  402    HB1  ALA  58           HB3      ALA  58   7.328  -3.614  -9.606
  403    HB2  ALA  58           HB1      ALA  58   7.134  -4.996 -10.685
  404    HB3  ALA  58           HB2      ALA  58   8.589  -4.845  -9.699
  405    H    LEU  59           HN       LEU  59   8.924  -6.749  -7.978
  406    HA   LEU  59           HA       LEU  59   8.457  -9.108  -9.476
  407    HG   LEU  59           HG       LEU  59  10.848  -7.374  -9.392
  408    HB2  LEU  59           HB2      LEU  59  10.355  -8.502  -7.215
  409    HB3  LEU  59           HB1      LEU  59  10.334 -10.036  -8.063
  410   HD11  LEU  59          HD11      LEU  59  12.629  -7.906  -7.818
  411   HD12  LEU  59          HD12      LEU  59  13.185  -8.070  -9.484
  412   HD13  LEU  59          HD13      LEU  59  12.799  -9.507  -8.539
  413   HD21  LEU  59          HD23      LEU  59  11.165 -10.206 -10.378
  414   HD22  LEU  59          HD21      LEU  59  11.620  -8.749 -11.262
  415   HD23  LEU  59          HD22      LEU  59   9.925  -9.060 -10.888
  416    H    ASP  60           HN       ASP  60   7.339  -8.044  -6.417
  417    HA   ASP  60           HA       ASP  60   7.010 -10.449  -5.046
  418    HB2  ASP  60           HB2      ASP  60   6.636  -8.247  -4.015
  419    HB3  ASP  60           HB1      ASP  60   5.196  -8.026  -5.005
  420    H    GLY  61           HN       GLY  61   4.810  -8.833  -7.329
  421    HA2  GLY  61           HA2      GLY  61   3.472  -9.997  -8.898
  422    HA3  GLY  61           HA1      GLY  61   3.617 -11.444  -7.912
  423    H    ARG  62           HN       ARG  62   2.772 -10.658  -5.465
  424    HA   ARG  62           HA       ARG  62  -0.030 -10.643  -5.761
  425    HE   ARG  62           HE       ARG  62   2.824 -11.122  -2.061
  426    HB2  ARG  62           HB2      ARG  62   1.660 -10.073  -3.321
  427    HB3  ARG  62           HB1      ARG  62  -0.075 -10.358  -3.296
  428    HG2  ARG  62           HG2      ARG  62   0.253 -12.608  -4.130
  429    HG3  ARG  62           HG1      ARG  62   1.991 -12.329  -4.252
  430    HD2  ARG  62           HD2      ARG  62   0.392 -12.214  -1.698
  431    HD3  ARG  62           HD1      ARG  62   1.354 -13.593  -2.226
  432   HH11  ARG  62          HH11      ARG  62   1.746 -13.951  -0.333
  433   HH12  ARG  62          HH12      ARG  62   3.004 -13.863   0.853
  434   HH21  ARG  62          HH21      ARG  62   4.481 -10.998  -0.500
  435   HH22  ARG  62          HH22      ARG  62   4.557 -12.185   0.760
  436    H    ILE  63           HN       ILE  63   2.270  -8.091  -4.890
  437    HA   ILE  63           HA       ILE  63   0.359  -6.102  -4.317
  438    HB   ILE  63           HB       ILE  63   3.157  -5.692  -5.380
  439   HG12  ILE  63          HG12      ILE  63   2.191  -5.818  -2.512
  440   HG13  ILE  63          HG11      ILE  63   3.073  -7.102  -3.332
  441   HG21  ILE  63          HG21      ILE  63   1.769  -3.700  -5.535
  442   HG22  ILE  63          HG22      ILE  63   2.998  -3.504  -4.284
  443   HG23  ILE  63          HG23      ILE  63   1.330  -3.856  -3.834
  444   HD11  ILE  63          HD13      ILE  63   4.988  -5.609  -3.599
  445   HD12  ILE  63          HD11      ILE  63   4.540  -5.806  -1.905
  446   HD13  ILE  63          HD12      ILE  63   4.101  -4.331  -2.767
  447    H    GLU  64           HN       GLU  64  -1.109  -5.323  -5.666
  448    HA   GLU  64           HA       GLU  64  -0.310  -4.749  -8.436
  449    HB2  GLU  64           HB2      GLU  64  -2.690  -6.256  -7.444
  450    HB3  GLU  64           HB1      GLU  64  -2.856  -5.271  -8.892
  451    HG2  GLU  64           HG2      GLU  64  -1.082  -6.503  -9.973
  452    HG3  GLU  64           HG1      GLU  64  -0.816  -7.450  -8.507
  453    HA   PRO  65           HA       PRO  65  -1.882  -0.653  -8.025
  454    HB2  PRO  65           HB2      PRO  65  -3.584  -0.495 -10.224
  455    HB3  PRO  65           HB1      PRO  65  -1.847  -0.185 -10.249
  456    HG2  PRO  65           HG2      PRO  65  -3.343  -2.663 -10.991
  457    HG3  PRO  65           HG1      PRO  65  -1.924  -1.933 -11.766
  458    HD2  PRO  65           HD2      PRO  65  -1.680  -4.076 -10.197
  459    HD3  PRO  65           HD1      PRO  65  -0.464  -2.780 -10.164
  460    H    ASN  66           HN       ASN  66  -3.996   0.627  -8.001
  461    HA   ASN  66           HA       ASN  66  -6.042   0.992  -7.088
  462    HB2  ASN  66           HB2      ASN  66  -6.601  -1.827  -8.032
  463    HB3  ASN  66           HB1      ASN  66  -7.817  -0.658  -7.527
  464   HD21  ASN  66          HD21      ASN  66  -8.242   1.132  -8.840
  465   HD22  ASN  66          HD22      ASN  66  -7.791   1.161 -10.506
  466    H    ASP  67           HN       ASP  67  -3.948   0.043  -5.401
  467    HA   ASP  67           HA       ASP  67  -5.466  -1.478  -3.383
  468    HB2  ASP  67           HB2      ASP  67  -3.504  -2.705  -4.018
  469    HB3  ASP  67           HB1      ASP  67  -2.490  -1.272  -3.870
  470    H    LYS  68           HN       LYS  68  -5.294  -0.816  -1.167
  471    HA   LYS  68           HA       LYS  68  -4.534   2.017  -0.871
  472    HB2  LYS  68           HB2      LYS  68  -6.940   1.703  -0.686
  473    HB3  LYS  68           HB1      LYS  68  -6.710   0.469   0.543
  474    HG2  LYS  68           HG2      LYS  68  -5.838   2.098   2.086
  475    HG3  LYS  68           HG1      LYS  68  -5.896   3.351   0.845
  476    HD2  LYS  68           HD2      LYS  68  -8.326   3.150   0.745
  477    HD3  LYS  68           HD1      LYS  68  -8.279   1.871   1.960
  478    HE2  LYS  68           HE2      LYS  68  -7.372   3.417   3.591
  479    HE3  LYS  68           HE1      LYS  68  -7.315   4.696   2.379
  480    HZ1  LYS  68           HZ3      LYS  68  -9.703   4.657   2.235
  481    HZ2  LYS  68           HZ1      LYS  68  -9.250   4.868   3.852
  482    HZ3  LYS  68           HZ2      LYS  68  -9.797   3.359   3.315
  483    H    ILE  69           HN       ILE  69  -2.599   2.053   0.094
  484    HA   ILE  69           HA       ILE  69  -1.598   0.082   1.838
  485    HB   ILE  69           HB       ILE  69  -0.728   2.968   1.648
  486   HG12  ILE  69          HG12      ILE  69  -0.696   1.874  -0.550
  487   HG13  ILE  69          HG11      ILE  69   0.937   2.181   0.029
  488   HG21  ILE  69          HG21      ILE  69   0.139   1.884   3.624
  489   HG22  ILE  69          HG22      ILE  69   1.437   2.101   2.450
  490   HG23  ILE  69          HG23      ILE  69   0.698   0.514   2.664
  491   HD11  ILE  69          HD13      ILE  69   0.785   0.006  -1.017
  492   HD12  ILE  69          HD11      ILE  69  -0.502  -0.461   0.094
  493   HD13  ILE  69          HD12      ILE  69   1.125  -0.163   0.706
  494    H    LEU  70           HN       LEU  70  -1.780  -0.216   3.973
  495    HA   LEU  70           HA       LEU  70  -3.389   1.718   5.485
  496    HG   LEU  70           HG       LEU  70  -4.180  -1.100   4.230
  497    HB2  LEU  70           HB2      LEU  70  -2.682  -1.128   6.195
  498    HB3  LEU  70           HB1      LEU  70  -3.806  -0.091   7.053
  499   HD11  LEU  70          HD11      LEU  70  -4.350  -2.886   5.890
  500   HD12  LEU  70          HD12      LEU  70  -5.919  -2.516   5.176
  501   HD13  LEU  70          HD13      LEU  70  -5.528  -1.935   6.794
  502   HD21  LEU  70          HD23      LEU  70  -6.032   0.443   6.043
  503   HD22  LEU  70          HD21      LEU  70  -6.448  -0.208   4.459
  504   HD23  LEU  70          HD22      LEU  70  -5.237   1.066   4.599
  505    H    ARG  71           HN       ARG  71  -0.750  -0.554   6.243
  506    HA   ARG  71           HA       ARG  71   0.747   1.606   7.493
  507    HE   ARG  71           HE       ARG  71   1.014  -1.185  11.242
  508    HB2  ARG  71           HB2      ARG  71   1.076   0.238   9.565
  509    HB3  ARG  71           HB1      ARG  71  -0.557   0.855   9.350
  510    HG2  ARG  71           HG2      ARG  71  -1.162  -1.383   8.380
  511    HG3  ARG  71           HG1      ARG  71   0.423  -1.952   8.910
  512    HD2  ARG  71           HD2      ARG  71  -1.732  -0.795  10.675
  513    HD3  ARG  71           HD1      ARG  71  -1.307  -2.501  10.543
  514   HH11  ARG  71          HH11      ARG  71  -2.164  -1.632  12.596
  515   HH12  ARG  71          HH12      ARG  71  -1.622  -1.520  14.236
  516   HH21  ARG  71          HH21      ARG  71   1.737  -1.036  13.401
  517   HH22  ARG  71          HH22      ARG  71   0.594  -1.182  14.694
  518    H    VAL  72           HN       VAL  72   2.882   1.379   7.305
  519    HA   VAL  72           HA       VAL  72   3.906  -0.920   5.854
  520    HB   VAL  72           HB       VAL  72   5.526   1.444   6.787
  521   HG11  VAL  72          HG11      VAL  72   6.841  -0.325   5.857
  522   HG12  VAL  72          HG12      VAL  72   6.769   0.980   4.674
  523   HG13  VAL  72          HG13      VAL  72   5.769  -0.459   4.463
  524   HG21  VAL  72          HG23      VAL  72   3.507   2.307   5.691
  525   HG22  VAL  72          HG21      VAL  72   3.861   1.314   4.276
  526   HG23  VAL  72          HG22      VAL  72   4.958   2.616   4.736
  527    H    ASP  73           HN       ASP  73   6.235  -1.609   6.622
  528    HA   ASP  73           HA       ASP  73   6.077  -3.043   8.941
  529    HB2  ASP  73           HB2      ASP  73   7.831  -3.250   7.159
  530    HB3  ASP  73           HB1      ASP  73   8.639  -1.858   7.867
  531    H    ASP  74           HN       ASP  74   5.599  -2.303  10.906
  532    HA   ASP  74           HA       ASP  74   5.637  -1.119  12.844
  533    HB2  ASP  74           HB2      ASP  74   8.488  -0.581  11.988
  534    HB3  ASP  74           HB1      ASP  74   7.845  -0.310  13.606
  535    H    VAL  75           HN       VAL  75   4.889   0.282  10.334
  536    HA   VAL  75           HA       VAL  75   4.987   2.991  11.412
  537    HB   VAL  75           HB       VAL  75   5.756   2.384   8.548
  538   HG11  VAL  75          HG11      VAL  75   5.507   5.006  10.017
  539   HG12  VAL  75          HG12      VAL  75   4.485   4.436   8.698
  540   HG13  VAL  75          HG13      VAL  75   6.182   4.810   8.400
  541   HG21  VAL  75          HG23      VAL  75   7.581   1.862  10.054
  542   HG22  VAL  75          HG21      VAL  75   7.414   3.432  10.840
  543   HG23  VAL  75          HG22      VAL  75   7.945   3.339   9.161
  544    H    ASN  76           HN       ASN  76   3.264   4.312  10.735
  545    HA   ASN  76           HA       ASN  76   1.127   2.905   9.271
  546    HB2  ASN  76           HB2      ASN  76  -0.496   4.164  10.630
  547    HB3  ASN  76           HB1      ASN  76   0.553   3.171  11.637
  548   HD21  ASN  76          HD21      ASN  76  -0.995   5.544  12.312
  549   HD22  ASN  76          HD22      ASN  76   0.135   6.693  12.933
  550    H    VAL  77           HN       VAL  77   0.280   3.908   7.524
  551    HA   VAL  77           HA       VAL  77   1.273   6.618   6.948
  552    HB   VAL  77           HB       VAL  77   0.723   6.130   4.580
  553   HG11  VAL  77          HG11      VAL  77   2.574   4.174   5.935
  554   HG12  VAL  77          HG12      VAL  77   2.983   5.788   5.356
  555   HG13  VAL  77          HG13      VAL  77   2.559   4.521   4.207
  556   HG21  VAL  77          HG23      VAL  77   0.157   3.898   3.876
  557   HG22  VAL  77          HG21      VAL  77  -1.039   4.449   5.049
  558   HG23  VAL  77          HG22      VAL  77   0.222   3.315   5.539
  559    H    GLN  78           HN       GLN  78  -1.075   5.920   8.621
  560    HA   GLN  78           HA       GLN  78  -3.306   6.916   7.022
  561    HB2  GLN  78           HB2      GLN  78  -3.180   5.874   9.855
  562    HB3  GLN  78           HB1      GLN  78  -4.648   6.439   9.072
  563    HG2  GLN  78           HG2      GLN  78  -2.957   4.123   8.162
  564    HG3  GLN  78           HG1      GLN  78  -4.476   4.006   9.051
  565   HE21  GLN  78          HE21      GLN  78  -3.763   2.961   6.424
  566   HE22  GLN  78          HE22      GLN  78  -4.903   3.630   5.314
  567    H    GLY  79           HN       GLY  79  -0.959   8.581   7.907
  568    HA2  GLY  79           HA2      GLY  79  -2.426  10.927   8.553
  569    HA3  GLY  79           HA1      GLY  79  -1.592  10.319   9.975
  570    H    MET  80           HN       MET  80  -0.047   9.678   6.987
  571    HA   MET  80           HA       MET  80   1.811  11.913   7.479
  572    HB2  MET  80           HB2      MET  80   2.486   9.216   6.295
  573    HB3  MET  80           HB1      MET  80   3.618  10.509   6.671
  574    HG2  MET  80           HG2      MET  80   2.949  10.278   9.069
  575    HG3  MET  80           HG1      MET  80   2.031   8.846   8.608
  576    HE1  MET  80           HE3      MET  80   4.992   6.623   7.129
  577    HE2  MET  80           HE1      MET  80   4.100   7.851   6.231
  578    HE3  MET  80           HE2      MET  80   3.242   6.751   7.308
  579    H    ALA  81           HN       ALA  81   2.352  13.204   5.802
  580    HA   ALA  81           HA       ALA  81   0.735  13.241   3.495
  581    HB1  ALA  81           HB3      ALA  81   3.327  14.674   4.058
  582    HB2  ALA  81           HB1      ALA  81   1.700  15.273   4.380
  583    HB3  ALA  81           HB2      ALA  81   2.239  15.034   2.718
  584    H    GLN  82           HN       GLN  82   1.484  13.132   1.249
  585    HA   GLN  82           HA       GLN  82   2.504  10.696   0.527
  586    HB2  GLN  82           HB2      GLN  82   1.331  12.253  -0.997
  587    HB3  GLN  82           HB1      GLN  82   2.774  13.255  -1.060
  588    HG2  GLN  82           HG2      GLN  82   4.014  11.412  -2.072
  589    HG3  GLN  82           HG1      GLN  82   2.570  10.402  -1.999
  590   HE21  GLN  82          HE21      GLN  82   0.855  10.823  -3.393
  591   HE22  GLN  82          HE22      GLN  82   1.035  11.811  -4.799
  592    H    SER  83           HN       SER  83   4.331  13.758   0.562
  593    HA   SER  83           HA       SER  83   6.809  12.765  -0.168
  594    HG   SER  83           HG       SER  83   8.379  15.522   0.431
  595    HB2  SER  83           HB2      SER  83   6.359  15.159  -0.007
  596    HB3  SER  83           HB1      SER  83   6.194  15.031   1.744
  597    H    ASP  84           HN       ASP  84   5.209  12.672   2.949
  598    HA   ASP  84           HA       ASP  84   7.520  11.878   4.430
  599    HB2  ASP  84           HB2      ASP  84   5.419  12.973   5.365
  600    HB3  ASP  84           HB1      ASP  84   4.651  11.394   5.227
  601    H    VAL  85           HN       VAL  85   4.834  10.158   2.901
  602    HA   VAL  85           HA       VAL  85   5.477   7.595   3.901
  603    HB   VAL  85           HB       VAL  85   4.106   8.208   1.279
  604   HG11  VAL  85          HG11      VAL  85   3.943   5.813   3.106
  605   HG12  VAL  85          HG12      VAL  85   4.774   5.876   1.552
  606   HG13  VAL  85          HG13      VAL  85   3.020   6.046   1.620
  607   HG21  VAL  85          HG23      VAL  85   3.018   9.436   3.072
  608   HG22  VAL  85          HG21      VAL  85   2.921   7.969   4.043
  609   HG23  VAL  85          HG22      VAL  85   2.003   8.096   2.543
  610    H    VAL  86           HN       VAL  86   6.675   9.486   1.228
  611    HA   VAL  86           HA       VAL  86   7.968   7.362  -0.155
  612    HB   VAL  86           HB       VAL  86   8.523  10.332  -0.242
  613   HG11  VAL  86          HG11      VAL  86   9.609   9.860  -2.394
  614   HG12  VAL  86          HG12      VAL  86   9.377   8.133  -2.124
  615   HG13  VAL  86          HG13      VAL  86  10.431   9.059  -1.055
  616   HG21  VAL  86          HG23      VAL  86   6.223   9.653  -0.884
  617   HG22  VAL  86          HG21      VAL  86   6.915   8.622  -2.135
  618   HG23  VAL  86          HG22      VAL  86   7.139  10.370  -2.209
  619    H    GLU  87           HN       GLU  87   9.170   9.875   2.087
  620    HA   GLU  87           HA       GLU  87  11.847   9.044   2.068
  621    HB2  GLU  87           HB2      GLU  87  12.120  10.325   4.114
  622    HB3  GLU  87           HB1      GLU  87  11.120  11.213   2.974
  623    HG2  GLU  87           HG2      GLU  87   9.131  10.624   4.190
  624    HG3  GLU  87           HG1      GLU  87  10.063   9.599   5.282
  625    H    VAL  88           HN       VAL  88   9.066   7.832   3.790
  626    HA   VAL  88           HA       VAL  88  10.425   6.321   5.752
  627    HB   VAL  88           HB       VAL  88   7.694   5.980   4.516
  628   HG11  VAL  88          HG11      VAL  88   7.206   4.419   6.362
  629   HG12  VAL  88          HG12      VAL  88   8.908   4.456   6.820
  630   HG13  VAL  88          HG13      VAL  88   8.430   3.794   5.257
  631   HG21  VAL  88          HG23      VAL  88   6.866   6.941   6.533
  632   HG22  VAL  88          HG21      VAL  88   8.167   7.980   5.951
  633   HG23  VAL  88          HG22      VAL  88   8.459   6.870   7.290
  634    H    LEU  89           HN       LEU  89   8.944   5.284   2.679
  635    HA   LEU  89           HA       LEU  89   9.791   2.644   2.719
  636    HG   LEU  89           HG       LEU  89   7.334   4.140   1.748
  637    HB2  LEU  89           HB2      LEU  89   9.375   4.458   0.342
  638    HB3  LEU  89           HB1      LEU  89   9.533   2.714   0.249
  639   HD11  LEU  89          HD11      LEU  89   5.891   3.439  -0.110
  640   HD12  LEU  89          HD12      LEU  89   7.309   2.853  -0.978
  641   HD13  LEU  89          HD13      LEU  89   7.138   4.573  -0.630
  642   HD21  LEU  89          HD23      LEU  89   7.836   1.919   2.615
  643   HD22  LEU  89          HD21      LEU  89   7.700   1.243   0.993
  644   HD23  LEU  89          HD22      LEU  89   6.282   1.932   1.782
  645    H    ARG  90           HN       ARG  90  11.522   5.536   1.712
  646    HA   ARG  90           HA       ARG  90  13.721   4.091   0.568
  647    HE   ARG  90           HE       ARG  90  12.470   8.656   0.220
  648    HB2  ARG  90           HB2      ARG  90  13.360   6.993   1.308
  649    HB3  ARG  90           HB1      ARG  90  14.830   6.361   0.581
  650    HG2  ARG  90           HG2      ARG  90  13.506   5.598  -1.358
  651    HG3  ARG  90           HG1      ARG  90  12.076   6.338  -0.635
  652    HD2  ARG  90           HD2      ARG  90  14.609   7.802  -1.370
  653    HD3  ARG  90           HD1      ARG  90  13.139   7.768  -2.344
  654   HH11  ARG  90          HH11      ARG  90  14.314   9.706  -2.544
  655   HH12  ARG  90          HH12      ARG  90  14.069  11.391  -2.228
  656   HH21  ARG  90          HH21      ARG  90  12.144  10.873   0.644
  657   HH22  ARG  90          HH22      ARG  90  12.837  12.054  -0.417
  658    H    ASN  91           HN       ASN  91  12.988   5.515   3.690
  659    HA   ASN  91           HA       ASN  91  15.621   5.301   4.745
  660    HB2  ASN  91           HB2      ASN  91  12.903   5.720   5.948
  661    HB3  ASN  91           HB1      ASN  91  14.289   5.404   6.987
  662   HD21  ASN  91          HD21      ASN  91  14.552   7.135   3.970
  663   HD22  ASN  91          HD22      ASN  91  14.883   8.682   4.663
  664    H    ALA  92           HN       ALA  92  13.130   3.042   4.159
  665    HA   ALA  92           HA       ALA  92  13.519   1.151   6.163
  666    HB1  ALA  92           HB3      ALA  92  12.788   0.684   3.274
  667    HB2  ALA  92           HB1      ALA  92  11.668   1.043   4.587
  668    HB3  ALA  92           HB2      ALA  92  12.572  -0.471   4.588
  669    H    GLY  93           HN       GLY  93  14.563   0.323   2.887
  670    HA2  GLY  93           HA2      GLY  93  16.480  -0.677   2.109
  671    HA3  GLY  93           HA1      GLY  93  17.327   0.135   3.419
  672    H    ASN  94           HN       ASN  94  14.698  -1.941   4.206
  673    HA   ASN  94           HA       ASN  94  16.422  -4.240   4.714
  674    HB2  ASN  94           HB2      ASN  94  15.764  -4.363   7.073
  675    HB3  ASN  94           HB1      ASN  94  16.582  -2.837   6.746
  676   HD21  ASN  94          HD21      ASN  94  13.440  -4.342   7.172
  677   HD22  ASN  94          HD22      ASN  94  12.617  -2.914   7.686
  678    HA   PRO  95           HA       PRO  95  12.784  -6.674   3.920
  679    HB2  PRO  95           HB2      PRO  95  12.972  -7.998   6.564
  680    HB3  PRO  95           HB1      PRO  95  12.999  -8.710   4.948
  681    HG2  PRO  95           HG2      PRO  95  15.221  -8.551   6.422
  682    HG3  PRO  95           HG1      PRO  95  15.262  -8.310   4.665
  683    HD2  PRO  95           HD2      PRO  95  15.366  -6.282   6.863
  684    HD3  PRO  95           HD1      PRO  95  16.248  -6.324   5.321
  685    H    VAL  96           HN       VAL  96  11.265  -4.979   4.040
  686    HA   VAL  96           HA       VAL  96   9.979  -4.532   6.638
  687    HB   VAL  96           HB       VAL  96   8.882  -2.593   5.523
  688   HG11  VAL  96          HG11      VAL  96  10.889  -1.187   5.461
  689   HG12  VAL  96          HG12      VAL  96  11.897  -2.634   5.426
  690   HG13  VAL  96          HG13      VAL  96  10.902  -2.285   6.840
  691   HG21  VAL  96          HG23      VAL  96   9.733  -1.830   3.364
  692   HG22  VAL  96          HG21      VAL  96   8.977  -3.417   3.223
  693   HG23  VAL  96          HG22      VAL  96  10.735  -3.275   3.241
  694    H    ARG  97           HN       ARG  97   7.792  -4.762   6.944
  695    HA   ARG  97           HA       ARG  97   6.454  -6.566   5.097
  696    HE   ARG  97           HE       ARG  97   3.750  -5.786   8.953
  697    HB2  ARG  97           HB2      ARG  97   6.500  -7.083   7.524
  698    HB3  ARG  97           HB1      ARG  97   5.601  -5.604   7.836
  699    HG2  ARG  97           HG2      ARG  97   3.719  -6.465   6.547
  700    HG3  ARG  97           HG1      ARG  97   4.622  -7.943   6.211
  701    HD2  ARG  97           HD2      ARG  97   3.070  -8.320   8.029
  702    HD3  ARG  97           HD1      ARG  97   4.727  -8.402   8.626
  703   HH11  ARG  97          HH11      ARG  97   3.314  -9.002  10.225
  704   HH12  ARG  97          HH12      ARG  97   2.815  -8.454  11.790
  705   HH21  ARG  97          HH21      ARG  97   3.090  -5.056  11.009
  706   HH22  ARG  97          HH22      ARG  97   2.685  -6.211  12.235
  707    H    LEU  98           HN       LEU  98   4.692  -6.048   3.928
  708    HA   LEU  98           HA       LEU  98   3.781  -3.253   4.055
  709    HG   LEU  98           HG       LEU  98   6.015  -4.165   2.275
  710    HB2  LEU  98           HB2      LEU  98   3.768  -5.194   1.747
  711    HB3  LEU  98           HB1      LEU  98   3.118  -3.568   1.691
  712   HD11  LEU  98          HD11      LEU  98   4.714  -3.473  -0.355
  713   HD12  LEU  98          HD12      LEU  98   5.475  -5.009   0.063
  714   HD13  LEU  98          HD13      LEU  98   6.451  -3.544  -0.055
  715   HD21  LEU  98          HD23      LEU  98   6.304  -1.804   1.634
  716   HD22  LEU  98          HD21      LEU  98   5.271  -1.997   3.051
  717   HD23  LEU  98          HD22      LEU  98   4.555  -1.651   1.478
  718    H    LEU  99           HN       LEU  99   1.975  -3.248   5.293
  719    HA   LEU  99           HA       LEU  99  -0.022  -5.350   4.876
  720    HG   LEU  99           HG       LEU  99  -2.212  -4.413   6.654
  721    HB2  LEU  99           HB2      LEU  99   0.752  -4.663   7.193
  722    HB3  LEU  99           HB1      LEU  99  -0.094  -3.150   6.934
  723   HD11  LEU  99          HD11      LEU  99  -2.287  -6.766   7.321
  724   HD12  LEU  99          HD12      LEU  99  -0.529  -6.781   7.462
  725   HD13  LEU  99          HD13      LEU  99  -1.286  -6.528   5.889
  726   HD21  LEU  99          HD23      LEU  99  -2.448  -5.049   9.029
  727   HD22  LEU  99          HD21      LEU  99  -1.688  -3.473   8.812
  728   HD23  LEU  99          HD22      LEU  99  -0.704  -4.877   9.223
  729    H    LEU 100           HN       LEU 100  -1.334  -4.937   3.216
  730    HA   LEU 100           HA       LEU 100  -2.638  -2.309   3.127
  731    HG   LEU 100           HG       LEU 100  -0.004  -4.079   1.491
  732    HB2  LEU 100           HB2      LEU 100  -2.522  -2.719   0.522
  733    HB3  LEU 100           HB1      LEU 100  -1.231  -1.905   1.384
  734   HD11  LEU 100          HD11      LEU 100  -0.691  -5.889   0.017
  735   HD12  LEU 100          HD12      LEU 100  -2.157  -5.003  -0.404
  736   HD13  LEU 100          HD13      LEU 100  -1.915  -5.575   1.247
  737   HD21  LEU 100          HD23      LEU 100   0.650  -4.073  -0.894
  738   HD22  LEU 100          HD21      LEU 100   0.589  -2.459  -0.186
  739   HD23  LEU 100          HD22      LEU 100  -0.716  -3.011  -1.235
  740    H    ILE 101           HN       ILE 101  -4.602  -2.318   1.735
  741    HA   ILE 101           HA       ILE 101  -5.974  -4.911   1.970
  742    HB   ILE 101           HB       ILE 101  -6.998  -3.235   3.374
  743   HG12  ILE 101          HG12      ILE 101  -8.682  -3.668   0.895
  744   HG13  ILE 101          HG11      ILE 101  -8.460  -4.850   2.180
  745   HG21  ILE 101          HG21      ILE 101  -7.295  -1.569   0.878
  746   HG22  ILE 101          HG22      ILE 101  -6.189  -1.248   2.213
  747   HG23  ILE 101          HG23      ILE 101  -7.931  -1.168   2.474
  748   HD11  ILE 101          HD13      ILE 101  -9.509  -3.293   3.762
  749   HD12  ILE 101          HD11      ILE 101 -10.576  -3.728   2.427
  750   HD13  ILE 101          HD12      ILE 101  -9.775  -2.157   2.438
  751    H    ARG 102           HN       ARG 102  -6.855  -5.840   0.226
  752    HA   ARG 102           HA       ARG 102  -6.693  -4.375  -2.325
  753    HE   ARG 102           HE       ARG 102  -4.487  -6.878  -4.965
  754    HB2  ARG 102           HB2      ARG 102  -6.525  -7.340  -1.769
  755    HB3  ARG 102           HB1      ARG 102  -6.593  -6.643  -3.379
  756    HG2  ARG 102           HG2      ARG 102  -4.454  -5.899  -1.412
  757    HG3  ARG 102           HG1      ARG 102  -4.308  -7.292  -2.485
  758    HD2  ARG 102           HD2      ARG 102  -4.748  -4.436  -3.348
  759    HD3  ARG 102           HD1      ARG 102  -3.219  -5.311  -3.423
  760   HH11  ARG 102          HH11      ARG 102  -5.225  -3.486  -4.671
  761   HH12  ARG 102          HH12      ARG 102  -5.854  -3.352  -6.278
  762   HH21  ARG 102          HH21      ARG 102  -5.312  -6.709  -7.084
  763   HH22  ARG 102          HH22      ARG 102  -5.904  -5.183  -7.650
  764    H    ARG 103           HN       ARG 103  -8.516  -4.044  -3.453
  765    HA   ARG 103           HA       ARG 103 -11.007  -5.041  -2.334
  766    HE   ARG 103           HE       ARG 103 -11.840  -2.158  -6.047
  767    HB2  ARG 103           HB2      ARG 103 -10.766  -2.646  -2.940
  768    HB3  ARG 103           HB1      ARG 103 -10.561  -3.115  -4.622
  769    HG2  ARG 103           HG2      ARG 103 -12.808  -4.062  -4.640
  770    HG3  ARG 103           HG1      ARG 103 -13.016  -3.607  -2.948
  771    HD2  ARG 103           HD2      ARG 103 -14.090  -1.945  -4.277
  772    HD3  ARG 103           HD1      ARG 103 -12.616  -1.233  -3.623
  773   HH11  ARG 103          HH11      ARG 103 -14.453  -0.113  -4.984
  774   HH12  ARG 103          HH12      ARG 103 -14.515   0.794  -6.459
  775   HH21  ARG 103          HH21      ARG 103 -11.915  -0.970  -7.993
  776   HH22  ARG 103          HH22      ARG 103 -13.072   0.307  -8.169
  777    H    LEU 104           HN       LEU 104 -11.598  -7.013  -2.966
  778    HA   LEU 104           HA       LEU 104 -10.791  -8.266  -5.352
  779    HG   LEU 104           HG       LEU 104 -10.986  -9.005  -2.359
  780    HB2  LEU 104           HB2      LEU 104 -13.155  -8.896  -3.584
  781    HB3  LEU 104           HB1      LEU 104 -12.481  -9.965  -4.800
  782   HD11  LEU 104          HD11      LEU 104 -11.308 -11.283  -1.514
  783   HD12  LEU 104          HD12      LEU 104 -12.345 -11.643  -2.895
  784   HD13  LEU 104          HD13      LEU 104 -12.840 -10.433  -1.712
  785   HD21  LEU 104          HD23      LEU 104  -9.542  -9.556  -4.245
  786   HD22  LEU 104          HD21      LEU 104 -10.334 -11.124  -4.405
  787   HD23  LEU 104          HD22      LEU 104  -9.390 -10.757  -2.961
  788    HA   PRO 105           HA       PRO 105 -13.753  -6.404  -8.129
  789    HB2  PRO 105           HB2      PRO 105 -13.156  -7.746 -10.353
  790    HB3  PRO 105           HB1      PRO 105 -11.980  -6.631  -9.635
  791    HG2  PRO 105           HG2      PRO 105 -12.161  -9.616  -9.358
  792    HG3  PRO 105           HG1      PRO 105 -10.739  -8.625  -9.752
  793    HD2  PRO 105           HD2      PRO 105 -11.259  -9.533  -7.242
  794    HD3  PRO 105           HD1      PRO 105 -10.423  -7.997  -7.554
  795    H    LEU 106           HN       LEU 106 -15.131  -7.886  -6.489
  796    HA   LEU 106           HA       LEU 106 -16.393 -10.110  -7.872
  797    HG   LEU 106           HG       LEU 106 -14.723  -9.967  -5.230
  798    HB2  LEU 106           HB2      LEU 106 -16.979  -8.932  -5.154
  799    HB3  LEU 106           HB1      LEU 106 -17.655 -10.417  -5.794
  800   HD11  LEU 106          HD11      LEU 106 -16.018 -10.008  -3.172
  801   HD12  LEU 106          HD12      LEU 106 -15.067 -11.484  -3.340
  802   HD13  LEU 106          HD13      LEU 106 -16.799 -11.506  -3.678
  803   HD21  LEU 106          HD23      LEU 106 -16.252 -12.451  -5.999
  804   HD22  LEU 106          HD21      LEU 106 -14.546 -12.389  -5.556
  805   HD23  LEU 106          HD22      LEU 106 -15.107 -11.575  -7.015
  806    H    LEU 107           HN       LEU 107 -17.981  -9.746  -9.256
  807    HA   LEU 107           HA       LEU 107 -19.412  -7.263  -9.315
  808    HG   LEU 107           HG       LEU 107 -19.008  -8.448 -12.826
  809    HB2  LEU 107           HB2      LEU 107 -19.612  -9.812 -10.904
  810    HB3  LEU 107           HB1      LEU 107 -20.747  -8.496 -11.124
  811   HD11  LEU 107          HD11      LEU 107 -18.412  -6.138 -12.646
  812   HD12  LEU 107          HD12      LEU 107 -18.656  -6.164 -10.898
  813   HD13  LEU 107          HD13      LEU 107 -20.033  -6.358 -11.984
  814   HD21  LEU 107          HD23      LEU 107 -17.213  -9.504 -11.532
  815   HD22  LEU 107          HD21      LEU 107 -17.072  -8.047 -10.547
  816   HD23  LEU 107          HD22      LEU 107 -16.689  -7.989 -12.268
  817    H    GLU 108           HN       GLU 108 -21.661  -6.969  -9.044
  818    HA   GLU 108           HA       GLU 108 -22.755  -8.308  -6.805
  819    HB2  GLU 108           HB2      GLU 108 -23.275  -5.965  -7.365
  820    HB3  GLU 108           HB1      GLU 108 -24.122  -6.502  -8.808
  821    HG2  GLU 108           HG2      GLU 108 -25.731  -7.703  -7.407
  822    HG3  GLU 108           HG1      GLU 108 -24.889  -7.132  -5.967
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1  -1.394  -9.647  10.838
    2    H2   GLY   1           HT2      GLY   1  -0.911  -9.628   9.217
    3    H3   GLY   1           HT3      GLY   1  -0.200 -10.718  10.298
    4    HA2  GLY   1           HA1      GLY   1  -1.791 -11.857   8.896
    5    HA3  GLY   1           HA2      GLY   1  -2.296 -11.874  10.579
    6    H    SER   2           HN       SER   2  -4.422 -11.681  10.703
    7    HA   SER   2           HA       SER   2  -5.726  -9.521   9.216
    8    HG   SER   2           HG       SER   2  -6.571 -11.957   6.931
    9    HB2  SER   2           HB2      SER   2  -6.732 -12.375   9.302
   10    HB3  SER   2           HB1      SER   2  -7.608 -11.006   8.617
   11    H    HIS   3           HN       HIS   3  -7.364  -8.519  10.295
   12    HA   HIS   3           HA       HIS   3  -8.722  -9.643  12.524
   13    HD1  HIS   3           HD1      HIS   3  -7.700 -10.029  15.647
   14    HD2  HIS   3           HD2      HIS   3  -8.677  -6.116  14.645
   15    HE1  HIS   3           HE1      HIS   3  -8.992  -9.135  17.609
   16    HE2  HIS   3           HE2      HIS   3  -9.635  -6.790  16.951
   17    HB2  HIS   3           HB2      HIS   3  -6.512  -9.212  13.571
   18    HB3  HIS   3           HB1      HIS   3  -6.671  -7.509  13.155
   19    H    GLY   4           HN       GLY   4 -10.615  -8.891  11.703
   20    HA2  GLY   4           HA2      GLY   4 -11.853  -6.661  12.305
   21    HA3  GLY   4           HA1      GLY   4 -10.829  -6.050  11.015
   22    H    TYR   5           HN       TYR   5 -11.529  -6.210   8.974
   23    HA   TYR   5           HA       TYR   5 -14.170  -7.138   8.463
   24    HD1  TYR   5           HD1      TYR   5 -15.317  -4.819   6.968
   25    HD2  TYR   5           HD2      TYR   5 -11.139  -4.432   7.676
   26    HE1  TYR   5           HE1      TYR   5 -15.645  -2.460   7.579
   27    HE2  TYR   5           HE2      TYR   5 -11.455  -2.072   8.291
   28    HH   TYR   5           HH       TYR   5 -13.078  -0.266   7.889
   29    HB2  TYR   5           HB2      TYR   5 -12.016  -6.346   6.490
   30    HB3  TYR   5           HB1      TYR   5 -13.736  -6.492   6.143
   31    H    SER   6           HN       SER   6 -14.872  -8.886   7.245
   32    HA   SER   6           HA       SER   6 -12.877 -10.881   6.458
   33    HG   SER   6           HG       SER   6 -15.558 -11.098   9.236
   34    HB2  SER   6           HB2      SER   6 -14.225 -12.684   7.498
   35    HB3  SER   6           HB1      SER   6 -13.589 -11.553   8.693
   36    H    ASP   7           HN       ASP   7 -13.254 -10.650   4.302
   37    HA   ASP   7           HA       ASP   7 -14.289 -10.829   2.284
   38    HB2  ASP   7           HB2      ASP   7 -16.078 -12.726   3.820
   39    HB3  ASP   7           HB1      ASP   7 -15.962 -12.626   2.066
   40    H    ALA   8           HN       ALA   8 -15.110  -8.663   3.942
   41    HA   ALA   8           HA       ALA   8 -17.985  -8.412   3.494
   42    HB1  ALA   8           HB3      ALA   8 -16.071  -6.537   4.878
   43    HB2  ALA   8           HB1      ALA   8 -17.088  -7.742   5.669
   44    HB3  ALA   8           HB2      ALA   8 -17.826  -6.380   4.827
   45    H    SER   9           HN       SER   9 -18.624  -7.709   1.570
   46    HA   SER   9           HA       SER   9 -18.740  -6.570  -0.395
   47    HG   SER   9           HG       SER   9 -18.741  -3.197  -0.396
   48    HB2  SER   9           HB2      SER   9 -18.999  -4.661   1.159
   49    HB3  SER   9           HB1      SER   9 -17.251  -4.434   1.154
   50    H    GLY  10           HN       GLY  10 -16.306  -8.213   0.266
   51    HA2  GLY  10           HA2      GLY  10 -14.600  -8.904  -1.177
   52    HA3  GLY  10           HA1      GLY  10 -14.769  -7.396  -2.063
   53    H    PHE  11           HN       PHE  11 -14.588  -5.805   0.436
   54    HA   PHE  11           HA       PHE  11 -11.834  -5.292   0.397
   55    HD1  PHE  11           HD2      PHE  11 -11.306  -2.507   0.828
   56    HD2  PHE  11           HD1      PHE  11 -15.433  -3.537   0.702
   57    HE1  PHE  11           HE2      PHE  11 -11.723  -0.634  -0.715
   58    HE2  PHE  11           HE1      PHE  11 -15.858  -1.669  -0.840
   59    HZ   PHE  11           HZ       PHE  11 -13.993  -0.215  -1.554
   60    HB2  PHE  11           HB2      PHE  11 -14.008  -4.505   2.330
   61    HB3  PHE  11           HB1      PHE  11 -12.342  -3.973   2.527
   62    H    SER  12           HN       SER  12 -10.329  -6.670   1.035
   63    HA   SER  12           HA       SER  12 -10.598  -7.915   3.684
   64    HG   SER  12           HG       SER  12  -9.829 -11.000   3.075
   65    HB2  SER  12           HB2      SER  12 -11.063  -9.653   2.044
   66    HB3  SER  12           HB1      SER  12  -9.587  -9.257   1.165
   67    H    LEU  13           HN       LEU  13  -8.681  -8.156   4.852
   68    HA   LEU  13           HA       LEU  13  -6.598  -6.295   4.125
   69    HG   LEU  13           HG       LEU  13  -8.669  -6.496   6.451
   70    HB2  LEU  13           HB2      LEU  13  -6.772  -8.128   6.517
   71    HB3  LEU  13           HB1      LEU  13  -5.667  -6.780   6.319
   72   HD11  LEU  13          HD11      LEU  13  -7.781  -7.341   8.563
   73   HD12  LEU  13          HD12      LEU  13  -8.318  -5.668   8.718
   74   HD13  LEU  13          HD13      LEU  13  -6.597  -6.034   8.594
   75   HD21  LEU  13          HD23      LEU  13  -8.088  -4.114   6.865
   76   HD22  LEU  13          HD21      LEU  13  -7.647  -4.683   5.255
   77   HD23  LEU  13          HD22      LEU  13  -6.407  -4.505   6.495
   78    H    TYR  14           HN       TYR  14  -4.827  -6.782   3.035
   79    HA   TYR  14           HA       TYR  14  -3.878  -9.573   3.050
   80    HD1  TYR  14           HD1      TYR  14  -6.437  -7.895   0.648
   81    HD2  TYR  14           HD2      TYR  14  -3.782 -11.217   0.496
   82    HE1  TYR  14           HE1      TYR  14  -8.262  -9.310  -0.196
   83    HE2  TYR  14           HE2      TYR  14  -5.600 -12.639  -0.349
   84    HH   TYR  14           HH       TYR  14  -8.495 -11.415  -1.530
   85    HB2  TYR  14           HB2      TYR  14  -4.023  -7.583   0.795
   86    HB3  TYR  14           HB1      TYR  14  -2.929  -8.961   0.737
   87    H    SER  15           HN       SER  15  -1.820  -9.902   3.648
   88    HA   SER  15           HA       SER  15  -0.026  -7.569   3.766
   89    HG   SER  15           HG       SER  15   1.595  -7.724   5.435
   90    HB2  SER  15           HB2      SER  15  -0.775  -8.107   6.028
   91    HB3  SER  15           HB1      SER  15  -0.274  -9.784   5.813
   92    H    VAL  16           HN       VAL  16   1.945  -7.818   2.923
   93    HA   VAL  16           HA       VAL  16   2.888 -10.538   2.308
   94    HB   VAL  16           HB       VAL  16   3.220  -8.199   0.428
   95   HG11  VAL  16          HG11      VAL  16   3.867  -9.940  -1.180
   96   HG12  VAL  16          HG12      VAL  16   3.698 -11.157   0.085
   97   HG13  VAL  16          HG13      VAL  16   4.933  -9.906   0.226
   98   HG21  VAL  16          HG23      VAL  16   1.191 -10.427   0.348
   99   HG22  VAL  16          HG21      VAL  16   1.534  -9.336  -0.995
  100   HG23  VAL  16          HG22      VAL  16   0.870  -8.700   0.510
  101    H    GLU  17           HN       GLU  17   5.175 -10.782   2.217
  102    HA   GLU  17           HA       GLU  17   6.590  -8.715   3.742
  103    HB2  GLU  17           HB2      GLU  17   7.283 -11.615   3.251
  104    HB3  GLU  17           HB1      GLU  17   8.265 -10.494   4.187
  105    HG2  GLU  17           HG2      GLU  17   6.428 -10.212   5.773
  106    HG3  GLU  17           HG1      GLU  17   5.452 -11.345   4.838
  107    H    LEU  18           HN       LEU  18   7.877  -7.383   2.701
  108    HA   LEU  18           HA       LEU  18   9.247  -8.325   0.269
  109    HG   LEU  18           HG       LEU  18   7.227  -5.845  -1.545
  110    HB2  LEU  18           HB2      LEU  18   7.792  -5.787   0.829
  111    HB3  LEU  18           HB1      LEU  18   9.227  -5.700  -0.172
  112   HD11  LEU  18          HD11      LEU  18   8.822  -8.399  -1.642
  113   HD12  LEU  18          HD12      LEU  18   9.295  -6.862  -2.362
  114   HD13  LEU  18          HD13      LEU  18   7.868  -7.710  -2.957
  115   HD21  LEU  18          HD23      LEU  18   5.852  -7.085   0.118
  116   HD22  LEU  18          HD21      LEU  18   6.741  -8.547  -0.306
  117   HD23  LEU  18          HD22      LEU  18   5.756  -7.732  -1.519
  118    H    PHE  19           HN       PHE  19  11.259  -7.013  -0.204
  119    HA   PHE  19           HA       PHE  19  12.527  -5.945   2.201
  120    HD1  PHE  19           HD2      PHE  19  11.987  -9.647   0.630
  121    HD2  PHE  19           HD1      PHE  19  15.557  -7.572  -0.393
  122    HE1  PHE  19           HE2      PHE  19  12.237 -11.071  -1.361
  123    HE2  PHE  19           HE1      PHE  19  15.814  -8.990  -2.386
  124    HZ   PHE  19           HZ       PHE  19  14.157 -10.752  -2.867
  125    HB2  PHE  19           HB2      PHE  19  14.580  -7.297   1.754
  126    HB3  PHE  19           HB1      PHE  19  13.194  -8.254   2.264
  127    H    ARG  20           HN       ARG  20  13.755  -4.206   1.815
  128    HA   ARG  20           HA       ARG  20  14.183  -3.477  -0.998
  129    HE   ARG  20           HE       ARG  20  15.185   0.657   1.066
  130    HB2  ARG  20           HB2      ARG  20  12.999  -1.981   0.805
  131    HB3  ARG  20           HB1      ARG  20  14.645  -1.592   1.283
  132    HG2  ARG  20           HG2      ARG  20  13.822  -1.347  -1.578
  133    HG3  ARG  20           HG1      ARG  20  13.405  -0.083  -0.418
  134    HD2  ARG  20           HD2      ARG  20  16.208  -1.111  -0.802
  135    HD3  ARG  20           HD1      ARG  20  15.553   0.253  -1.704
  136   HH11  ARG  20          HH11      ARG  20  17.670   0.642  -1.377
  137   HH12  ARG  20          HH12      ARG  20  18.671   1.788  -0.548
  138   HH21  ARG  20          HH21      ARG  20  16.495   2.166   2.163
  139   HH22  ARG  20          HH22      ARG  20  18.001   2.657   1.462
  140    H    GLU  21           HN       GLU  21  16.086  -4.245  -1.699
  141    HA   GLU  21           HA       GLU  21  18.496  -3.372  -0.309
  142    HB2  GLU  21           HB2      GLU  21  17.852  -5.721   0.457
  143    HB3  GLU  21           HB1      GLU  21  18.225  -6.245  -1.178
  144    HG2  GLU  21           HG2      GLU  21  20.517  -5.404  -0.904
  145    HG3  GLU  21           HG1      GLU  21  20.130  -4.939   0.752
  146    H    LYS  22           HN       LYS  22  16.829  -3.293  -3.005
  147    HA   LYS  22           HA       LYS  22  18.938  -3.964  -4.892
  148    HB2  LYS  22           HB2      LYS  22  16.163  -2.849  -5.342
  149    HB3  LYS  22           HB1      LYS  22  17.277  -3.335  -6.613
  150    HG2  LYS  22           HG2      LYS  22  16.158  -5.169  -4.502
  151    HG3  LYS  22           HG1      LYS  22  15.548  -5.021  -6.151
  152    HD2  LYS  22           HD2      LYS  22  17.671  -5.788  -7.036
  153    HD3  LYS  22           HD1      LYS  22  18.357  -5.844  -5.411
  154    HE2  LYS  22           HE2      LYS  22  16.034  -7.499  -6.396
  155    HE3  LYS  22           HE1      LYS  22  17.693  -8.068  -6.213
  156    HZ1  LYS  22           HZ3      LYS  22  15.954  -7.077  -4.018
  157    HZ2  LYS  22           HZ1      LYS  22  17.546  -7.625  -3.842
  158    HZ3  LYS  22           HZ2      LYS  22  16.330  -8.697  -4.324
  159    H    ASP  23           HN       ASP  23  19.534  -2.377  -6.582
  160    HA   ASP  23           HA       ASP  23  20.218   0.147  -5.347
  161    HB2  ASP  23           HB2      ASP  23  20.902  -0.998  -8.063
  162    HB3  ASP  23           HB1      ASP  23  21.534   0.517  -7.425
  163    H    THR  24           HN       THR  24  17.429  -0.274  -5.892
  164    HA   THR  24           HA       THR  24  16.875   1.541  -8.122
  165    HB   THR  24           HB       THR  24  14.548   0.888  -7.901
  166    HG1  THR  24           HG1      THR  24  13.988   0.384  -5.913
  167   HG21  THR  24          HG23      THR  24  16.021  -0.589  -9.196
  168   HG22  THR  24          HG21      THR  24  14.730  -1.497  -8.409
  169   HG23  THR  24          HG22      THR  24  16.360  -1.524  -7.739
  170    H    SER  25           HN       SER  25  17.369   1.632  -4.824
  171    HA   SER  25           HA       SER  25  17.044   3.181  -3.195
  172    HG   SER  25           HG       SER  25  17.625   5.870  -3.140
  173    HB2  SER  25           HB2      SER  25  18.061   4.681  -4.866
  174    HB3  SER  25           HB1      SER  25  16.463   5.020  -5.530
  175    H    SER  26           HN       SER  26  14.687   1.710  -4.549
  176    HA   SER  26           HA       SER  26  12.655   2.900  -2.888
  177    HG   SER  26           HG       SER  26  12.595   4.917  -5.825
  178    HB2  SER  26           HB2      SER  26  12.290   2.830  -5.894
  179    HB3  SER  26           HB1      SER  26  11.025   3.214  -4.727
  180    H    LEU  27           HN       LEU  27  10.438   1.672  -3.572
  181    HA   LEU  27           HA       LEU  27  11.140  -1.188  -3.676
  182    HG   LEU  27           HG       LEU  27  11.281  -0.254  -1.057
  183    HB2  LEU  27           HB2      LEU  27   9.035   0.292  -2.124
  184    HB3  LEU  27           HB1      LEU  27   8.880  -1.424  -2.450
  185   HD11  LEU  27          HD11      LEU  27   8.783  -1.406   0.179
  186   HD12  LEU  27          HD12      LEU  27   9.283   0.284   0.239
  187   HD13  LEU  27          HD13      LEU  27  10.251  -0.951   1.043
  188   HD21  LEU  27          HD23      LEU  27  10.152  -3.044  -1.253
  189   HD22  LEU  27          HD21      LEU  27  11.536  -2.576  -0.267
  190   HD23  LEU  27          HD22      LEU  27  11.622  -2.449  -2.024
  191    H    GLY  28           HN       GLY  28   9.730   1.267  -5.385
  192    HA2  GLY  28           HA2      GLY  28   8.796   0.975  -7.537
  193    HA3  GLY  28           HA1      GLY  28   8.308  -0.650  -7.080
  194    H    ILE  29           HN       ILE  29   7.575   1.452  -4.608
  195    HA   ILE  29           HA       ILE  29   4.756   1.266  -5.156
  196    HB   ILE  29           HB       ILE  29   6.063   2.801  -2.916
  197   HG12  ILE  29          HG12      ILE  29   6.941   0.525  -2.885
  198   HG13  ILE  29          HG11      ILE  29   5.810   0.753  -1.556
  199   HG21  ILE  29          HG21      ILE  29   3.694   3.255  -3.258
  200   HG22  ILE  29          HG22      ILE  29   3.955   2.377  -1.751
  201   HG23  ILE  29          HG23      ILE  29   3.342   1.529  -3.171
  202   HD11  ILE  29          HD13      ILE  29   5.497  -1.411  -2.577
  203   HD12  ILE  29          HD11      ILE  29   5.245  -0.661  -4.153
  204   HD13  ILE  29          HD12      ILE  29   4.079  -0.401  -2.856
  205    H    SER  30           HN       SER  30   3.874   2.607  -6.594
  206    HA   SER  30           HA       SER  30   4.719   5.430  -6.584
  207    HG   SER  30           HG       SER  30   6.067   4.302  -8.071
  208    HB2  SER  30           HB2      SER  30   3.484   3.824  -8.836
  209    HB3  SER  30           HB1      SER  30   3.934   5.527  -8.920
  210    H    ILE  31           HN       ILE  31   3.294   6.203  -5.054
  211    HA   ILE  31           HA       ILE  31   0.441   5.693  -5.392
  212    HB   ILE  31           HB       ILE  31   0.154   6.889  -3.276
  213   HG12  ILE  31          HG12      ILE  31   3.169   7.179  -3.289
  214   HG13  ILE  31          HG11      ILE  31   2.033   8.490  -3.594
  215   HG21  ILE  31          HG21      ILE  31   0.609   4.493  -3.243
  216   HG22  ILE  31          HG22      ILE  31   1.301   5.287  -1.828
  217   HG23  ILE  31          HG23      ILE  31   2.341   4.815  -3.172
  218   HD11  ILE  31          HD13      ILE  31   1.128   8.205  -1.332
  219   HD12  ILE  31          HD11      ILE  31   2.851   8.584  -1.325
  220   HD13  ILE  31          HD12      ILE  31   2.310   6.930  -1.035
  221    H    SER  32           HN       SER  32  -1.073   7.549  -5.234
  222    HA   SER  32           HA       SER  32  -0.002   9.910  -6.641
  223    HG   SER  32           HG       SER  32  -2.704  10.946  -7.216
  224    HB2  SER  32           HB2      SER  32  -1.439   8.564  -8.106
  225    HB3  SER  32           HB1      SER  32  -2.743   8.652  -6.921
  226    H    GLY  33           HN       GLY  33  -0.343  11.844  -5.732
  227    HA2  GLY  33           HA2      GLY  33  -1.416  12.047  -3.117
  228    HA3  GLY  33           HA1      GLY  33  -0.941  13.391  -4.144
  229    H    MET  34           HN       MET  34  -3.489  11.983  -2.577
  230    HA   MET  34           HA       MET  34  -5.567  12.567  -4.474
  231    HB2  MET  34           HB2      MET  34  -5.853  10.785  -2.821
  232    HB3  MET  34           HB1      MET  34  -5.714  11.955  -1.515
  233    HG2  MET  34           HG2      MET  34  -7.753  13.067  -2.330
  234    HG3  MET  34           HG1      MET  34  -7.904  11.829  -3.575
  235    HE1  MET  34           HE3      MET  34 -10.375  11.307  -2.777
  236    HE2  MET  34           HE1      MET  34 -10.241  12.542  -1.525
  237    HE3  MET  34           HE2      MET  34 -10.806  10.924  -1.110
  238    H    ARG  35           HN       ARG  35  -6.165  14.558  -4.960
  239    HA   ARG  35           HA       ARG  35  -5.442  16.875  -3.615
  240    HE   ARG  35           HE       ARG  35 -10.582  15.521  -6.098
  241    HB2  ARG  35           HB2      ARG  35  -6.860  18.046  -5.088
  242    HB3  ARG  35           HB1      ARG  35  -6.333  16.635  -5.991
  243    HG2  ARG  35           HG2      ARG  35  -8.973  16.844  -4.559
  244    HG3  ARG  35           HG1      ARG  35  -8.734  17.182  -6.272
  245    HD2  ARG  35           HD2      ARG  35  -7.911  14.873  -6.577
  246    HD3  ARG  35           HD1      ARG  35  -8.253  14.552  -4.877
  247   HH11  ARG  35          HH11      ARG  35  -8.520  12.711  -6.128
  248   HH12  ARG  35          HH12      ARG  35  -9.790  11.624  -6.575
  249   HH21  ARG  35          HH21      ARG  35 -12.261  14.095  -6.689
  250   HH22  ARG  35          HH22      ARG  35 -11.919  12.410  -6.893
  251    H    ASP  36           HN       ASP  36  -6.721  18.414  -2.434
  252    HA   ASP  36           HA       ASP  36  -8.673  17.098  -0.671
  253    HB2  ASP  36           HB2      ASP  36  -8.132  18.941   0.926
  254    HB3  ASP  36           HB1      ASP  36  -6.756  17.914   0.539
  255    H    GLN  37           HN       GLN  37  -8.290  19.504  -3.046
  256    HA   GLN  37           HA       GLN  37  -9.718  20.970  -4.036
  257    HB2  GLN  37           HB2      GLN  37 -11.852  19.523  -2.455
  258    HB3  GLN  37           HB1      GLN  37 -12.124  20.573  -3.837
  259    HG2  GLN  37           HG2      GLN  37 -10.913  19.019  -5.270
  260    HG3  GLN  37           HG1      GLN  37 -10.616  17.969  -3.885
  261   HE21  GLN  37          HE21      GLN  37 -12.321  16.793  -3.004
  262   HE22  GLN  37          HE22      GLN  37 -13.798  16.536  -3.863
  263    H    SER  38           HN       SER  38 -11.773  22.482  -3.328
  264    HA   SER  38           HA       SER  38 -10.688  24.083  -1.164
  265    HG   SER  38           HG       SER  38 -13.033  24.205  -4.098
  266    HB2  SER  38           HB2      SER  38 -12.331  25.775  -1.903
  267    HB3  SER  38           HB1      SER  38 -11.340  25.202  -3.244
  268    H    THR  39           HN       THR  39 -12.153  21.486  -0.737
  269    HA   THR  39           HA       THR  39 -14.613  22.213   0.572
  270    HB   THR  39           HB       THR  39 -14.740  19.861   1.238
  271    HG1  THR  39           HG1      THR  39 -12.799  19.031   1.583
  272   HG21  THR  39          HG23      THR  39 -15.482  20.465  -1.012
  273   HG22  THR  39          HG21      THR  39 -14.777  18.848  -0.998
  274   HG23  THR  39          HG22      THR  39 -13.849  20.210  -1.628
  275    H    THR  40           HN       THR  40 -14.986  22.477   2.716
  276    HA   THR  40           HA       THR  40 -12.788  23.139   4.401
  277    HB   THR  40           HB       THR  40 -14.884  24.330   4.649
  278    HG1  THR  40           HG1      THR  40 -13.771  24.257   6.561
  279   HG21  THR  40          HG23      THR  40 -16.878  23.231   5.576
  280   HG22  THR  40          HG21      THR  40 -16.048  21.675   5.502
  281   HG23  THR  40          HG22      THR  40 -16.425  22.546   4.015
  282    H    GLY  41           HN       GLY  41 -14.035  20.197   3.540
  283    HA2  GLY  41           HA2      GLY  41 -13.267  18.973   6.117
  284    HA3  GLY  41           HA1      GLY  41 -14.441  18.278   5.012
  285    H    GLU  42           HN       GLU  42 -11.306  18.120   6.067
  286    HA   GLU  42           HA       GLU  42  -9.944  17.454   3.664
  287    HB2  GLU  42           HB2      GLU  42  -9.255  16.639   6.492
  288    HB3  GLU  42           HB1      GLU  42  -8.165  16.655   5.113
  289    HG2  GLU  42           HG2      GLU  42  -8.376  19.083   4.971
  290    HG3  GLU  42           HG1      GLU  42  -9.470  19.068   6.353
  291    H    ALA  43           HN       ALA  43  -9.593  15.512   2.685
  292    HA   ALA  43           HA       ALA  43 -10.481  13.051   3.949
  293    HB1  ALA  43           HB3      ALA  43 -11.698  13.983   1.350
  294    HB2  ALA  43           HB1      ALA  43 -12.525  13.883   2.905
  295    HB3  ALA  43           HB2      ALA  43 -11.958  12.414   2.112
  296    H    THR  44           HN       THR  44  -7.924  13.978   3.226
  297    HA   THR  44           HA       THR  44  -7.030  13.026   0.728
  298    HB   THR  44           HB       THR  44  -4.772  13.133   1.671
  299    HG1  THR  44           HG1      THR  44  -5.358  14.100   4.115
  300   HG21  THR  44          HG23      THR  44  -4.771  15.496   2.343
  301   HG22  THR  44          HG21      THR  44  -6.520  15.431   2.559
  302   HG23  THR  44          HG22      THR  44  -5.821  15.219   0.954
  303    H    GLY  45           HN       GLY  45  -5.919  11.115   0.174
  304    HA2  GLY  45           HA2      GLY  45  -5.891   8.934   2.118
  305    HA3  GLY  45           HA1      GLY  45  -6.898   8.712   0.695
  306    H    ILE  46           HN       ILE  46  -4.248   7.558   1.831
  307    HA   ILE  46           HA       ILE  46  -2.537   7.969  -0.510
  308    HB   ILE  46           HB       ILE  46  -1.964   6.520   2.079
  309   HG12  ILE  46          HG12      ILE  46  -2.199   8.948   2.369
  310   HG13  ILE  46          HG11      ILE  46  -0.529   8.443   2.595
  311   HG21  ILE  46          HG21      ILE  46  -0.665   5.564   0.295
  312   HG22  ILE  46          HG22      ILE  46   0.388   6.560   1.302
  313   HG23  ILE  46          HG23      ILE  46  -0.174   7.165  -0.257
  314   HD11  ILE  46          HD13      ILE  46   0.018   9.227   0.356
  315   HD12  ILE  46          HD11      ILE  46  -0.680  10.518   1.334
  316   HD13  ILE  46          HD12      ILE  46  -1.660   9.710   0.110
  317    H    TYR  47           HN       TYR  47  -2.804   6.624  -2.163
  318    HA   TYR  47           HA       TYR  47  -3.094   3.765  -1.637
  319    HD1  TYR  47           HD1      TYR  47  -5.621   6.974  -2.106
  320    HD2  TYR  47           HD2      TYR  47  -4.801   4.539  -5.498
  321    HE1  TYR  47           HE1      TYR  47  -6.297   8.817  -3.586
  322    HE2  TYR  47           HE2      TYR  47  -5.476   6.376  -6.988
  323    HH   TYR  47           HH       TYR  47  -6.856   8.395  -6.914
  324    HB2  TYR  47           HB2      TYR  47  -4.906   3.568  -3.312
  325    HB3  TYR  47           HB1      TYR  47  -5.386   4.520  -1.912
  326    H    VAL  48           HN       VAL  48  -2.049   2.487  -3.075
  327    HA   VAL  48           HA       VAL  48  -0.155   3.661  -4.828
  328    HB   VAL  48           HB       VAL  48  -1.046   0.783  -4.593
  329   HG11  VAL  48          HG11      VAL  48   1.350   1.968  -5.992
  330   HG12  VAL  48          HG12      VAL  48  -0.018   1.159  -6.756
  331   HG13  VAL  48          HG13      VAL  48   1.079   0.247  -5.720
  332   HG21  VAL  48          HG23      VAL  48  -0.079   1.713  -2.542
  333   HG22  VAL  48          HG21      VAL  48   1.356   2.201  -3.444
  334   HG23  VAL  48          HG22      VAL  48   0.969   0.490  -3.261
  335    H    LYS  49           HN       LYS  49  -0.311   4.219  -6.891
  336    HA   LYS  49           HA       LYS  49  -2.774   3.563  -8.337
  337    HB2  LYS  49           HB2      LYS  49  -2.278   5.930  -8.154
  338    HB3  LYS  49           HB1      LYS  49  -0.673   5.682  -8.827
  339    HG2  LYS  49           HG2      LYS  49  -1.663   5.021 -10.958
  340    HG3  LYS  49           HG1      LYS  49  -3.277   5.251 -10.280
  341    HD2  LYS  49           HD2      LYS  49  -2.845   7.608  -9.954
  342    HD3  LYS  49           HD1      LYS  49  -1.179   7.409 -10.498
  343    HE2  LYS  49           HE2      LYS  49  -3.643   6.916 -12.169
  344    HE3  LYS  49           HE1      LYS  49  -2.625   8.354 -12.248
  345    HZ1  LYS  49           HZ3      LYS  49  -0.768   6.946 -12.915
  346    HZ2  LYS  49           HZ1      LYS  49  -2.061   6.804 -13.997
  347    HZ3  LYS  49           HZ2      LYS  49  -1.765   5.580 -12.867
  348    H    SER  50           HN       SER  50   0.699   3.170  -8.451
  349    HA   SER  50           HA       SER  50   0.420   1.120 -10.460
  350    HG   SER  50           HG       SER  50   2.929   3.598 -10.405
  351    HB2  SER  50           HB2      SER  50   2.031   2.123 -12.039
  352    HB3  SER  50           HB1      SER  50   0.569   3.097 -11.888
  353    H    LEU  51           HN       LEU  51   2.661   0.219 -11.039
  354    HA   LEU  51           HA       LEU  51   4.448   0.369  -8.706
  355    HG   LEU  51           HG       LEU  51   1.929  -1.270  -8.478
  356    HB2  LEU  51           HB2      LEU  51   3.598  -2.130 -10.169
  357    HB3  LEU  51           HB1      LEU  51   4.809  -2.067  -8.901
  358   HD11  LEU  51          HD11      LEU  51   1.629  -3.447  -7.423
  359   HD12  LEU  51          HD12      LEU  51   3.267  -3.908  -7.888
  360   HD13  LEU  51          HD13      LEU  51   2.046  -3.621  -9.127
  361   HD21  LEU  51          HD23      LEU  51   4.142  -1.951  -6.544
  362   HD22  LEU  51          HD21      LEU  51   2.487  -1.510  -6.121
  363   HD23  LEU  51          HD22      LEU  51   3.546  -0.329  -6.894
  364    H    ILE  52           HN       ILE  52   6.619   0.298  -9.121
  365    HA   ILE  52           HA       ILE  52   7.450   0.861 -11.807
  366    HB   ILE  52           HB       ILE  52   9.104   0.462  -9.311
  367   HG12  ILE  52          HG12      ILE  52   7.542   2.355  -9.150
  368   HG13  ILE  52          HG11      ILE  52   9.210   2.908  -9.234
  369   HG21  ILE  52          HG21      ILE  52  10.447   0.090 -11.283
  370   HG22  ILE  52          HG22      ILE  52  10.876   1.639 -10.558
  371   HG23  ILE  52          HG23      ILE  52   9.864   1.591 -12.001
  372   HD11  ILE  52          HD13      ILE  52   7.258   2.876 -11.525
  373   HD12  ILE  52          HD11      ILE  52   8.918   3.468 -11.580
  374   HD13  ILE  52          HD12      ILE  52   7.722   4.291 -10.578
  375    HA   PRO  53           HA       PRO  53   8.133  -3.496 -12.732
  376    HB2  PRO  53           HB2      PRO  53   9.087  -3.131 -15.252
  377    HB3  PRO  53           HB1      PRO  53   7.366  -3.074 -14.856
  378    HG2  PRO  53           HG2      PRO  53   9.298  -0.820 -15.244
  379    HG3  PRO  53           HG1      PRO  53   7.631  -0.978 -15.831
  380    HD2  PRO  53           HD2      PRO  53   8.259   0.495 -13.656
  381    HD3  PRO  53           HD1      PRO  53   6.722  -0.383 -13.793
  382    H    GLY  54           HN       GLY  54   9.825  -4.275 -11.596
  383    HA2  GLY  54           HA2      GLY  54  12.149  -5.068 -12.153
  384    HA3  GLY  54           HA1      GLY  54  12.528  -3.366 -12.370
  385    H    SER  55           HN       SER  55  10.417  -3.292  -9.933
  386    HA   SER  55           HA       SER  55  12.546  -3.222  -7.939
  387    HG   SER  55           HG       SER  55  10.704  -0.896  -9.106
  388    HB2  SER  55           HB2      SER  55   9.675  -2.277  -7.765
  389    HB3  SER  55           HB1      SER  55  10.915  -2.027  -6.536
  390    H    ALA  56           HN       ALA  56  11.380  -3.721  -5.602
  391    HA   ALA  56           HA       ALA  56  11.146  -6.564  -5.594
  392    HB1  ALA  56           HB3      ALA  56  10.926  -6.352  -3.185
  393    HB2  ALA  56           HB1      ALA  56  10.676  -4.613  -3.343
  394    HB3  ALA  56           HB2      ALA  56  12.232  -5.323  -3.776
  395    H    ALA  57           HN       ALA  57   8.870  -3.898  -5.065
  396    HA   ALA  57           HA       ALA  57   6.658  -5.451  -4.311
  397    HB1  ALA  57           HB3      ALA  57   6.645  -2.792  -5.733
  398    HB2  ALA  57           HB1      ALA  57   6.790  -3.019  -3.990
  399    HB3  ALA  57           HB2      ALA  57   5.311  -3.499  -4.822
  400    H    ALA  58           HN       ALA  58   7.749  -4.342  -7.492
  401    HA   ALA  58           HA       ALA  58   5.527  -5.364  -8.931
  402    HB1  ALA  58           HB3      ALA  58   6.963  -3.593  -9.814
  403    HB2  ALA  58           HB1      ALA  58   6.873  -4.961 -10.922
  404    HB3  ALA  58           HB2      ALA  58   8.305  -4.733  -9.920
  405    H    LEU  59           HN       LEU  59   8.875  -6.567  -8.633
  406    HA   LEU  59           HA       LEU  59   8.490  -8.949 -10.042
  407    HG   LEU  59           HG       LEU  59  10.742  -6.935  -9.891
  408    HB2  LEU  59           HB2      LEU  59  10.441  -8.302  -7.834
  409    HB3  LEU  59           HB1      LEU  59  10.517  -9.750  -8.819
  410   HD11  LEU  59          HD11      LEU  59  12.885  -8.997  -9.397
  411   HD12  LEU  59          HD12      LEU  59  12.650  -7.510  -8.479
  412   HD13  LEU  59          HD13      LEU  59  13.111  -7.433 -10.179
  413   HD21  LEU  59          HD23      LEU  59   9.848  -8.510 -11.516
  414   HD22  LEU  59          HD21      LEU  59  11.186  -9.615 -11.201
  415   HD23  LEU  59          HD22      LEU  59  11.495  -8.044 -11.939
  416    H    ASP  60           HN       ASP  60   7.453  -8.050  -6.901
  417    HA   ASP  60           HA       ASP  60   7.383 -10.533  -5.608
  418    HB2  ASP  60           HB2      ASP  60   6.982  -8.385  -4.461
  419    HB3  ASP  60           HB1      ASP  60   5.449  -8.223  -5.311
  420    H    GLY  61           HN       GLY  61   4.884  -8.903  -7.555
  421    HA2  GLY  61           HA2      GLY  61   3.507 -10.063  -9.109
  422    HA3  GLY  61           HA1      GLY  61   3.787 -11.544  -8.209
  423    H    ARG  62           HN       ARG  62   3.105 -10.889  -5.666
  424    HA   ARG  62           HA       ARG  62   0.311 -11.062  -5.707
  425    HE   ARG  62           HE       ARG  62   0.029 -12.485  -2.048
  426    HB2  ARG  62           HB2      ARG  62   2.032 -10.199  -3.378
  427    HB3  ARG  62           HB1      ARG  62   0.413 -10.878  -3.293
  428    HG2  ARG  62           HG2      ARG  62   1.274 -12.982  -4.248
  429    HG3  ARG  62           HG1      ARG  62   2.899 -12.293  -4.232
  430    HD2  ARG  62           HD2      ARG  62   2.627 -13.670  -2.283
  431    HD3  ARG  62           HD1      ARG  62   2.686 -11.981  -1.780
  432   HH11  ARG  62          HH11      ARG  62   2.621 -14.008  -0.284
  433   HH12  ARG  62          HH12      ARG  62   1.593 -14.577   0.987
  434   HH21  ARG  62          HH21      ARG  62  -1.331 -13.234  -0.380
  435   HH22  ARG  62          HH22      ARG  62  -0.653 -14.137   0.934
  436    H    ILE  63           HN       ILE  63   2.439  -8.313  -4.983
  437    HA   ILE  63           HA       ILE  63   0.347  -6.503  -4.371
  438    HB   ILE  63           HB       ILE  63   3.145  -5.883  -5.335
  439   HG12  ILE  63          HG12      ILE  63   2.049  -6.029  -2.516
  440   HG13  ILE  63          HG11      ILE  63   3.031  -7.279  -3.272
  441   HG21  ILE  63          HG21      ILE  63   2.793  -3.698  -4.288
  442   HG22  ILE  63          HG22      ILE  63   1.134  -4.154  -3.895
  443   HG23  ILE  63          HG23      ILE  63   1.629  -3.988  -5.580
  444   HD11  ILE  63          HD13      ILE  63   3.895  -4.451  -2.711
  445   HD12  ILE  63          HD11      ILE  63   4.878  -5.701  -3.472
  446   HD13  ILE  63          HD12      ILE  63   4.358  -5.888  -1.798
  447    H    GLU  64           HN       GLU  64  -1.153  -5.831  -5.731
  448    HA   GLU  64           HA       GLU  64  -0.418  -5.380  -8.549
  449    HB2  GLU  64           HB2      GLU  64  -2.015  -7.233  -8.241
  450    HB3  GLU  64           HB1      GLU  64  -3.113  -6.144  -7.405
  451    HG2  GLU  64           HG2      GLU  64  -3.369  -4.826  -9.437
  452    HG3  GLU  64           HG1      GLU  64  -2.249  -5.896 -10.278
  453    HA   PRO  65           HA       PRO  65  -1.162  -1.028  -8.067
  454    HB2  PRO  65           HB2      PRO  65  -2.642  -1.358 -10.645
  455    HB3  PRO  65           HB1      PRO  65  -1.419  -0.162 -10.195
  456    HG2  PRO  65           HG2      PRO  65  -0.786  -2.229 -11.749
  457    HG3  PRO  65           HG1      PRO  65   0.337  -1.643 -10.509
  458    HD2  PRO  65           HD2      PRO  65  -1.357  -4.088 -10.531
  459    HD3  PRO  65           HD1      PRO  65   0.225  -3.813  -9.775
  460    H    ASN  66           HN       ASN  66  -2.960   0.537  -8.001
  461    HA   ASN  66           HA       ASN  66  -5.011   1.221  -7.297
  462    HB2  ASN  66           HB2      ASN  66  -5.711   0.039  -9.425
  463    HB3  ASN  66           HB1      ASN  66  -6.097  -1.362  -8.431
  464   HD21  ASN  66          HD21      ASN  66  -7.836   0.269 -10.088
  465   HD22  ASN  66          HD22      ASN  66  -9.066   0.883  -9.042
  466    H    ASP  67           HN       ASP  67  -3.698   0.500  -5.263
  467    HA   ASP  67           HA       ASP  67  -5.503  -1.172  -3.655
  468    HB2  ASP  67           HB2      ASP  67  -3.669  -2.632  -4.062
  469    HB3  ASP  67           HB1      ASP  67  -2.494  -1.345  -3.807
  470    H    LYS  68           HN       LYS  68  -5.443  -0.692  -1.346
  471    HA   LYS  68           HA       LYS  68  -4.596   2.086  -0.865
  472    HB2  LYS  68           HB2      LYS  68  -7.026   1.662  -0.716
  473    HB3  LYS  68           HB1      LYS  68  -6.729   0.492   0.562
  474    HG2  LYS  68           HG2      LYS  68  -5.851   2.232   1.995
  475    HG3  LYS  68           HG1      LYS  68  -6.042   3.419   0.705
  476    HD2  LYS  68           HD2      LYS  68  -8.480   2.971   0.718
  477    HD3  LYS  68           HD1      LYS  68  -8.241   1.893   2.095
  478    HE2  LYS  68           HE2      LYS  68  -7.338   3.750   3.396
  479    HE3  LYS  68           HE1      LYS  68  -7.557   4.829   2.019
  480    HZ1  LYS  68           HZ3      LYS  68  -9.942   4.437   2.143
  481    HZ2  LYS  68           HZ1      LYS  68  -9.358   5.057   3.605
  482    HZ3  LYS  68           HZ2      LYS  68  -9.727   3.412   3.471
  483    H    ILE  69           HN       ILE  69  -2.786   2.239   0.263
  484    HA   ILE  69           HA       ILE  69  -1.775   0.107   1.878
  485    HB   ILE  69           HB       ILE  69  -0.795   2.959   1.777
  486   HG12  ILE  69          HG12      ILE  69  -0.908   2.001  -0.486
  487   HG13  ILE  69          HG11      ILE  69   0.761   2.209   0.034
  488   HG21  ILE  69          HG21      ILE  69   1.352   1.981   2.446
  489   HG22  ILE  69          HG22      ILE  69   0.591   0.392   2.542
  490   HG23  ILE  69          HG23      ILE  69   0.090   1.678   3.641
  491   HD11  ILE  69          HD13      ILE  69   0.478   0.107  -1.124
  492   HD12  ILE  69          HD11      ILE  69  -0.784  -0.374   0.009
  493   HD13  ILE  69          HD12      ILE  69   0.877  -0.178   0.569
  494    H    LEU  70           HN       LEU  70  -1.611  -0.029   4.103
  495    HA   LEU  70           HA       LEU  70  -3.258   1.891   5.613
  496    HG   LEU  70           HG       LEU  70  -4.341  -0.731   4.312
  497    HB2  LEU  70           HB2      LEU  70  -2.777  -1.026   6.223
  498    HB3  LEU  70           HB1      LEU  70  -3.767   0.070   7.168
  499   HD11  LEU  70          HD11      LEU  70  -6.168  -2.057   5.275
  500   HD12  LEU  70          HD12      LEU  70  -5.577  -1.680   6.893
  501   HD13  LEU  70          HD13      LEU  70  -4.584  -2.635   5.793
  502   HD21  LEU  70          HD23      LEU  70  -6.534   0.289   4.744
  503   HD22  LEU  70          HD21      LEU  70  -5.221   1.461   4.861
  504   HD23  LEU  70          HD22      LEU  70  -5.965   0.820   6.327
  505    H    ARG  71           HN       ARG  71  -0.778  -0.575   6.375
  506    HA   ARG  71           HA       ARG  71   0.761   1.496   7.763
  507    HE   ARG  71           HE       ARG  71   0.555   0.569  11.725
  508    HB2  ARG  71           HB2      ARG  71   0.017  -1.153   9.015
  509    HB3  ARG  71           HB1      ARG  71   1.056   0.071   9.730
  510    HG2  ARG  71           HG2      ARG  71  -0.803   1.617   9.859
  511    HG3  ARG  71           HG1      ARG  71  -1.855   0.450   9.058
  512    HD2  ARG  71           HD2      ARG  71  -2.219   0.434  11.463
  513    HD3  ARG  71           HD1      ARG  71  -1.547  -1.104  10.921
  514   HH11  ARG  71          HH11      ARG  71  -2.138  -1.175  13.084
  515   HH12  ARG  71          HH12      ARG  71  -1.378  -1.406  14.623
  516   HH21  ARG  71          HH21      ARG  71   1.564   0.268  13.746
  517   HH22  ARG  71          HH22      ARG  71   0.729  -0.590  14.998
  518    H    VAL  72           HN       VAL  72   2.945   1.198   7.778
  519    HA   VAL  72           HA       VAL  72   3.971  -1.009   6.136
  520    HB   VAL  72           HB       VAL  72   5.560   1.390   7.031
  521   HG11  VAL  72          HG11      VAL  72   5.783  -0.491   4.687
  522   HG12  VAL  72          HG12      VAL  72   6.868  -0.381   6.073
  523   HG13  VAL  72          HG13      VAL  72   6.781   0.945   4.914
  524   HG21  VAL  72          HG23      VAL  72   3.794   1.217   4.593
  525   HG22  VAL  72          HG21      VAL  72   4.943   2.510   4.937
  526   HG23  VAL  72          HG22      VAL  72   3.549   2.267   5.989
  527    H    ASP  73           HN       ASP  73   6.325  -1.655   6.855
  528    HA   ASP  73           HA       ASP  73   6.239  -3.050   9.214
  529    HB2  ASP  73           HB2      ASP  73   7.957  -3.215   7.339
  530    HB3  ASP  73           HB1      ASP  73   8.797  -1.882   8.122
  531    H    ASP  74           HN       ASP  74   5.802  -2.239  11.164
  532    HA   ASP  74           HA       ASP  74   5.882  -0.971  13.051
  533    HB2  ASP  74           HB2      ASP  74   8.723  -0.613  12.086
  534    HB3  ASP  74           HB1      ASP  74   8.154  -0.090  13.668
  535    H    VAL  75           HN       VAL  75   5.018   0.326  10.567
  536    HA   VAL  75           HA       VAL  75   5.262   3.090  11.475
  537    HB   VAL  75           HB       VAL  75   5.831   2.269   8.618
  538   HG11  VAL  75          HG11      VAL  75   5.674   5.006   9.876
  539   HG12  VAL  75          HG12      VAL  75   4.573   4.333   8.672
  540   HG13  VAL  75          HG13      VAL  75   6.251   4.670   8.243
  541   HG21  VAL  75          HG23      VAL  75   7.718   1.871  10.126
  542   HG22  VAL  75          HG21      VAL  75   7.630   3.544  10.678
  543   HG23  VAL  75          HG22      VAL  75   8.057   3.188   9.004
  544    H    ASN  76           HN       ASN  76   3.553   4.450  10.768
  545    HA   ASN  76           HA       ASN  76   1.252   3.019   9.603
  546    HB2  ASN  76           HB2      ASN  76   0.875   3.476  11.977
  547    HB3  ASN  76           HB1      ASN  76   1.238   5.180  11.725
  548   HD21  ASN  76          HD21      ASN  76  -0.581   3.250   9.459
  549   HD22  ASN  76          HD22      ASN  76  -2.100   4.027   9.720
  550    H    VAL  77           HN       VAL  77   0.461   3.867   7.761
  551    HA   VAL  77           HA       VAL  77   1.364   6.575   7.033
  552    HB   VAL  77           HB       VAL  77   0.946   5.951   4.695
  553   HG11  VAL  77          HG11      VAL  77   3.173   5.665   5.535
  554   HG12  VAL  77          HG12      VAL  77   2.793   4.305   4.479
  555   HG13  VAL  77          HG13      VAL  77   2.759   4.098   6.230
  556   HG21  VAL  77          HG23      VAL  77   0.444   3.669   4.069
  557   HG22  VAL  77          HG21      VAL  77  -0.827   4.290   5.121
  558   HG23  VAL  77          HG22      VAL  77   0.389   3.186   5.765
  559    H    GLN  78           HN       GLN  78  -1.094   5.668   8.612
  560    HA   GLN  78           HA       GLN  78  -3.220   6.641   6.864
  561    HB2  GLN  78           HB2      GLN  78  -3.343   5.550   9.682
  562    HB3  GLN  78           HB1      GLN  78  -4.735   6.003   8.708
  563    HG2  GLN  78           HG2      GLN  78  -2.778   3.798   8.114
  564    HG3  GLN  78           HG1      GLN  78  -4.434   3.610   8.685
  565   HE21  GLN  78          HE21      GLN  78  -6.142   4.006   7.269
  566   HE22  GLN  78          HE22      GLN  78  -5.917   4.065   5.557
  567    H    GLY  79           HN       GLY  79  -0.994   8.292   8.040
  568    HA2  GLY  79           HA2      GLY  79  -2.636  10.552   8.751
  569    HA3  GLY  79           HA1      GLY  79  -1.655   9.956  10.081
  570    H    MET  80           HN       MET  80  -0.222   9.453   7.047
  571    HA   MET  80           HA       MET  80   1.439  11.861   7.406
  572    HB2  MET  80           HB2      MET  80   2.296   9.171   6.326
  573    HB3  MET  80           HB1      MET  80   3.326  10.582   6.514
  574    HG2  MET  80           HG2      MET  80   2.865  10.491   8.967
  575    HG3  MET  80           HG1      MET  80   2.042   8.957   8.691
  576    HE1  MET  80           HE3      MET  80   3.970   7.835   6.281
  577    HE2  MET  80           HE1      MET  80   3.280   6.842   7.564
  578    HE3  MET  80           HE2      MET  80   5.012   6.785   7.241
  579    H    ALA  81           HN       ALA  81   2.053  13.012   5.594
  580    HA   ALA  81           HA       ALA  81   0.279  12.881   3.367
  581    HB1  ALA  81           HB3      ALA  81   1.522  14.780   2.501
  582    HB2  ALA  81           HB1      ALA  81   2.791  14.519   3.698
  583    HB3  ALA  81           HB2      ALA  81   1.176  15.003   4.215
  584    H    GLN  82           HN       GLN  82   1.157  12.958   1.082
  585    HA   GLN  82           HA       GLN  82   2.183  10.526   0.329
  586    HB2  GLN  82           HB2      GLN  82   1.068  12.042  -1.222
  587    HB3  GLN  82           HB1      GLN  82   2.421  13.161  -1.133
  588    HG2  GLN  82           HG2      GLN  82   3.876  11.457  -2.133
  589    HG3  GLN  82           HG1      GLN  82   2.494  10.371  -2.258
  590   HE21  GLN  82          HE21      GLN  82   2.641  10.246  -4.486
  591   HE22  GLN  82          HE22      GLN  82   2.198  11.557  -5.520
  592    H    SER  83           HN       SER  83   4.017  13.581   0.443
  593    HA   SER  83           HA       SER  83   6.504  12.623  -0.253
  594    HG   SER  83           HG       SER  83   5.568  14.631  -0.940
  595    HB2  SER  83           HB2      SER  83   5.857  14.818   1.726
  596    HB3  SER  83           HB1      SER  83   7.427  14.571   0.960
  597    H    ASP  84           HN       ASP  84   5.041  12.702   2.978
  598    HA   ASP  84           HA       ASP  84   7.282  11.839   4.421
  599    HB2  ASP  84           HB2      ASP  84   4.350  11.404   5.017
  600    HB3  ASP  84           HB1      ASP  84   5.662  11.177   6.170
  601    H    VAL  85           HN       VAL  85   4.570   9.943   3.105
  602    HA   VAL  85           HA       VAL  85   5.412   7.431   3.976
  603    HB   VAL  85           HB       VAL  85   3.932   7.994   1.404
  604   HG11  VAL  85          HG11      VAL  85   3.976   5.583   3.216
  605   HG12  VAL  85          HG12      VAL  85   4.686   5.696   1.605
  606   HG13  VAL  85          HG13      VAL  85   2.936   5.784   1.806
  607   HG21  VAL  85          HG23      VAL  85   2.854   7.683   4.205
  608   HG22  VAL  85          HG21      VAL  85   1.881   7.779   2.737
  609   HG23  VAL  85          HG22      VAL  85   2.852   9.161   3.243
  610    H    VAL  86           HN       VAL  86   6.322   9.277   1.117
  611    HA   VAL  86           HA       VAL  86   7.657   7.232  -0.275
  612    HB   VAL  86           HB       VAL  86   8.184  10.207  -0.304
  613   HG11  VAL  86          HG11      VAL  86   9.049   8.060  -2.241
  614   HG12  VAL  86          HG12      VAL  86  10.100   8.996  -1.178
  615   HG13  VAL  86          HG13      VAL  86   9.235   9.794  -2.492
  616   HG21  VAL  86          HG23      VAL  86   6.568   8.505  -2.198
  617   HG22  VAL  86          HG21      VAL  86   6.772  10.256  -2.257
  618   HG23  VAL  86          HG22      VAL  86   5.888   9.516  -0.923
  619    H    GLU  87           HN       GLU  87   8.914   9.684   1.980
  620    HA   GLU  87           HA       GLU  87  11.603   8.979   1.872
  621    HB2  GLU  87           HB2      GLU  87  10.050  10.046   4.237
  622    HB3  GLU  87           HB1      GLU  87  11.801  10.059   4.079
  623    HG2  GLU  87           HG2      GLU  87  11.624  11.527   2.142
  624    HG3  GLU  87           HG1      GLU  87   9.867  11.506   2.285
  625    H    VAL  88           HN       VAL  88   9.004   7.686   3.890
  626    HA   VAL  88           HA       VAL  88  10.512   6.073   5.587
  627    HB   VAL  88           HB       VAL  88   7.719   5.662   4.520
  628   HG11  VAL  88          HG11      VAL  88   7.398   4.107   6.398
  629   HG12  VAL  88          HG12      VAL  88   9.115   4.233   6.782
  630   HG13  VAL  88          HG13      VAL  88   8.604   3.521   5.250
  631   HG21  VAL  88          HG23      VAL  88   8.006   7.691   5.822
  632   HG22  VAL  88          HG21      VAL  88   8.750   6.771   7.128
  633   HG23  VAL  88          HG22      VAL  88   7.052   6.516   6.726
  634    H    LEU  89           HN       LEU  89   8.795   5.043   2.634
  635    HA   LEU  89           HA       LEU  89   9.725   2.440   2.548
  636    HG   LEU  89           HG       LEU  89   7.166   4.012   1.778
  637    HB2  LEU  89           HB2      LEU  89   9.082   4.251   0.222
  638    HB3  LEU  89           HB1      LEU  89   9.207   2.504   0.140
  639   HD11  LEU  89          HD11      LEU  89   5.561   3.221   0.099
  640   HD12  LEU  89          HD12      LEU  89   6.894   2.565  -0.853
  641   HD13  LEU  89          HD13      LEU  89   6.767   4.305  -0.597
  642   HD21  LEU  89          HD23      LEU  89   7.705   1.853   2.744
  643   HD22  LEU  89          HD21      LEU  89   7.475   1.071   1.181
  644   HD23  LEU  89          HD22      LEU  89   6.103   1.807   2.009
  645    H    ARG  90           HN       ARG  90  11.315   5.392   1.532
  646    HA   ARG  90           HA       ARG  90  13.436   4.005   0.154
  647    HE   ARG  90           HE       ARG  90  12.151   8.630  -0.023
  648    HB2  ARG  90           HB2      ARG  90  13.131   6.907   0.936
  649    HB3  ARG  90           HB1      ARG  90  14.454   6.271  -0.029
  650    HG2  ARG  90           HG2      ARG  90  12.794   5.515  -1.710
  651    HG3  ARG  90           HG1      ARG  90  11.537   6.312  -0.765
  652    HD2  ARG  90           HD2      ARG  90  13.946   7.646  -1.998
  653    HD3  ARG  90           HD1      ARG  90  12.293   7.725  -2.610
  654   HH11  ARG  90          HH11      ARG  90  13.894   9.545  -2.899
  655   HH12  ARG  90          HH12      ARG  90  13.969  11.222  -2.475
  656   HH21  ARG  90          HH21      ARG  90  12.241  10.837   0.540
  657   HH22  ARG  90          HH22      ARG  90  13.026  11.957  -0.522
  658    H    ASN  91           HN       ASN  91  12.803   5.087   3.367
  659    HA   ASN  91           HA       ASN  91  15.580   5.052   4.180
  660    HB2  ASN  91           HB2      ASN  91  13.006   5.384   5.727
  661    HB3  ASN  91           HB1      ASN  91  14.598   5.393   6.479
  662   HD21  ASN  91          HD21      ASN  91  12.586   7.485   6.366
  663   HD22  ASN  91          HD22      ASN  91  13.344   8.846   5.621
  664    H    ALA  92           HN       ALA  92  13.107   2.781   3.764
  665    HA   ALA  92           HA       ALA  92  13.458   0.952   5.802
  666    HB1  ALA  92           HB3      ALA  92  12.615  -0.733   4.262
  667    HB2  ALA  92           HB1      ALA  92  12.940   0.334   2.896
  668    HB3  ALA  92           HB2      ALA  92  11.718   0.775   4.088
  669    H    GLY  93           HN       GLY  93  14.765   0.136   2.605
  670    HA2  GLY  93           HA2      GLY  93  16.763  -0.822   1.985
  671    HA3  GLY  93           HA1      GLY  93  17.477  -0.018   3.375
  672    H    ASN  94           HN       ASN  94  14.845  -2.031   4.113
  673    HA   ASN  94           HA       ASN  94  16.483  -4.399   4.582
  674    HB2  ASN  94           HB2      ASN  94  15.877  -4.511   6.950
  675    HB3  ASN  94           HB1      ASN  94  16.726  -3.003   6.619
  676   HD21  ASN  94          HD21      ASN  94  13.570  -4.440   7.140
  677   HD22  ASN  94          HD22      ASN  94  12.789  -2.992   7.665
  678    HA   PRO  95           HA       PRO  95  12.741  -6.660   3.790
  679    HB2  PRO  95           HB2      PRO  95  12.960  -8.124   6.352
  680    HB3  PRO  95           HB1      PRO  95  12.949  -8.748   4.700
  681    HG2  PRO  95           HG2      PRO  95  15.195  -8.710   6.150
  682    HG3  PRO  95           HG1      PRO  95  15.216  -8.391   4.405
  683    HD2  PRO  95           HD2      PRO  95  15.391  -6.466   6.689
  684    HD3  PRO  95           HD1      PRO  95  16.261  -6.462   5.142
  685    H    VAL  96           HN       VAL  96  11.165  -5.077   3.997
  686    HA   VAL  96           HA       VAL  96  10.046  -4.635   6.676
  687    HB   VAL  96           HB       VAL  96   8.906  -2.673   5.664
  688   HG11  VAL  96          HG11      VAL  96  11.907  -2.744   5.363
  689   HG12  VAL  96          HG12      VAL  96  11.013  -2.393   6.842
  690   HG13  VAL  96          HG13      VAL  96  10.923  -1.284   5.474
  691   HG21  VAL  96          HG23      VAL  96   8.813  -3.432   3.355
  692   HG22  VAL  96          HG21      VAL  96  10.572  -3.366   3.246
  693   HG23  VAL  96          HG22      VAL  96   9.646  -1.882   3.461
  694    H    ARG  97           HN       ARG  97   7.795  -4.621   6.994
  695    HA   ARG  97           HA       ARG  97   6.370  -6.551   5.349
  696    HE   ARG  97           HE       ARG  97   4.956  -8.668   8.560
  697    HB2  ARG  97           HB2      ARG  97   6.298  -6.996   7.705
  698    HB3  ARG  97           HB1      ARG  97   5.819  -5.343   8.062
  699    HG2  ARG  97           HG2      ARG  97   3.672  -5.735   6.933
  700    HG3  ARG  97           HG1      ARG  97   4.154  -7.406   6.632
  701    HD2  ARG  97           HD2      ARG  97   3.897  -6.135   9.354
  702    HD3  ARG  97           HD1      ARG  97   2.685  -7.172   8.601
  703   HH11  ARG  97          HH11      ARG  97   3.171  -7.016  11.056
  704   HH12  ARG  97          HH12      ARG  97   3.629  -8.132  12.300
  705   HH21  ARG  97          HH21      ARG  97   5.568 -10.138  10.190
  706   HH22  ARG  97          HH22      ARG  97   4.992  -9.907  11.808
  707    H    LEU  98           HN       LEU  98   4.495  -6.100   4.265
  708    HA   LEU  98           HA       LEU  98   3.728  -3.259   4.136
  709    HG   LEU  98           HG       LEU  98   5.886  -4.698   2.355
  710    HB2  LEU  98           HB2      LEU  98   3.501  -5.320   1.948
  711    HB3  LEU  98           HB1      LEU  98   3.120  -3.616   1.818
  712   HD11  LEU  98          HD11      LEU  98   5.084  -5.359   0.139
  713   HD12  LEU  98          HD12      LEU  98   6.368  -4.157   0.034
  714   HD13  LEU  98          HD13      LEU  98   4.690  -3.678  -0.217
  715   HD21  LEU  98          HD23      LEU  98   4.906  -1.939   1.628
  716   HD22  LEU  98          HD21      LEU  98   6.595  -2.422   1.777
  717   HD23  LEU  98          HD22      LEU  98   5.544  -2.439   3.193
  718    H    LEU  99           HN       LEU  99   1.955  -3.115   5.386
  719    HA   LEU  99           HA       LEU  99  -0.125  -5.165   5.146
  720    HG   LEU  99           HG       LEU  99  -2.187  -3.583   6.862
  721    HB2  LEU  99           HB2      LEU  99   0.610  -4.586   7.408
  722    HB3  LEU  99           HB1      LEU  99   0.197  -2.906   7.124
  723   HD11  LEU  99          HD11      LEU  99  -1.864  -5.895   6.208
  724   HD12  LEU  99          HD12      LEU  99  -2.853  -5.804   7.665
  725   HD13  LEU  99          HD13      LEU  99  -1.154  -6.261   7.781
  726   HD21  LEU  99          HD23      LEU  99  -0.885  -4.346   9.473
  727   HD22  LEU  99          HD21      LEU  99  -2.586  -3.941   9.244
  728   HD23  LEU  99          HD22      LEU  99  -1.345  -2.716   8.981
  729    H    LEU 100           HN       LEU 100  -1.278  -4.717   3.344
  730    HA   LEU 100           HA       LEU 100  -2.573  -2.077   3.225
  731    HG   LEU 100           HG       LEU 100  -0.075  -4.055   1.623
  732    HB2  LEU 100           HB2      LEU 100  -2.527  -2.596   0.640
  733    HB3  LEU 100           HB1      LEU 100  -1.189  -1.795   1.438
  734   HD11  LEU 100          HD11      LEU 100  -2.123  -5.394   1.313
  735   HD12  LEU 100          HD12      LEU 100  -0.833  -5.837   0.195
  736   HD13  LEU 100          HD13      LEU 100  -2.189  -4.859  -0.367
  737   HD21  LEU 100          HD23      LEU 100  -0.671  -2.986  -1.133
  738   HD22  LEU 100          HD21      LEU 100   0.663  -4.062  -0.716
  739   HD23  LEU 100          HD22      LEU 100   0.603  -2.431  -0.048
  740    H    ILE 101           HN       ILE 101  -4.570  -2.107   1.833
  741    HA   ILE 101           HA       ILE 101  -5.980  -4.664   2.209
  742    HB   ILE 101           HB       ILE 101  -6.903  -2.965   3.659
  743   HG12  ILE 101          HG12      ILE 101  -8.762  -3.369   1.304
  744   HG13  ILE 101          HG11      ILE 101  -8.429  -4.594   2.523
  745   HG21  ILE 101          HG21      ILE 101  -7.897  -0.910   2.781
  746   HG22  ILE 101          HG22      ILE 101  -7.331  -1.328   1.164
  747   HG23  ILE 101          HG23      ILE 101  -6.167  -0.988   2.445
  748   HD11  ILE 101          HD13      ILE 101  -9.701  -1.914   3.016
  749   HD12  ILE 101          HD11      ILE 101  -9.362  -3.134   4.242
  750   HD13  ILE 101          HD12      ILE 101 -10.528  -3.470   2.962
  751    H    ARG 102           HN       ARG 102  -6.850  -5.625   0.520
  752    HA   ARG 102           HA       ARG 102  -6.867  -4.213  -2.062
  753    HE   ARG 102           HE       ARG 102  -5.408  -6.936  -4.655
  754    HB2  ARG 102           HB2      ARG 102  -6.608  -7.141  -1.379
  755    HB3  ARG 102           HB1      ARG 102  -6.893  -6.563  -3.013
  756    HG2  ARG 102           HG2      ARG 102  -4.561  -5.598  -1.400
  757    HG3  ARG 102           HG1      ARG 102  -4.493  -7.099  -2.325
  758    HD2  ARG 102           HD2      ARG 102  -5.091  -4.350  -3.412
  759    HD3  ARG 102           HD1      ARG 102  -3.593  -5.253  -3.625
  760   HH11  ARG 102          HH11      ARG 102  -4.864  -3.529  -5.142
  761   HH12  ARG 102          HH12      ARG 102  -5.436  -3.540  -6.777
  762   HH21  ARG 102          HH21      ARG 102  -6.164  -6.960  -6.804
  763   HH22  ARG 102          HH22      ARG 102  -6.179  -5.491  -7.720
  764    H    ARG 103           HN       ARG 103  -8.679  -4.353  -3.402
  765    HA   ARG 103           HA       ARG 103 -11.141  -5.122  -2.006
  766    HE   ARG 103           HE       ARG 103 -11.771  -2.273  -5.701
  767    HB2  ARG 103           HB2      ARG 103 -11.015  -2.801  -2.800
  768    HB3  ARG 103           HB1      ARG 103 -10.762  -3.371  -4.444
  769    HG2  ARG 103           HG2      ARG 103 -12.976  -4.381  -4.451
  770    HG3  ARG 103           HG1      ARG 103 -13.229  -3.859  -2.786
  771    HD2  ARG 103           HD2      ARG 103 -14.331  -2.354  -4.354
  772    HD3  ARG 103           HD1      ARG 103 -13.043  -1.528  -3.479
  773   HH11  ARG 103          HH11      ARG 103 -14.885  -0.775  -5.249
  774   HH12  ARG 103          HH12      ARG 103 -14.836   0.080  -6.755
  775   HH21  ARG 103          HH21      ARG 103 -11.697  -1.151  -7.684
  776   HH22  ARG 103          HH22      ARG 103 -13.023  -0.133  -8.138
  777    H    LEU 104           HN       LEU 104 -12.196  -6.888  -2.580
  778    HA   LEU 104           HA       LEU 104 -11.397  -8.301  -5.008
  779    HG   LEU 104           HG       LEU 104 -10.857  -8.737  -1.999
  780    HB2  LEU 104           HB2      LEU 104 -13.223  -9.242  -2.798
  781    HB3  LEU 104           HB1      LEU 104 -12.485 -10.227  -4.047
  782   HD11  LEU 104          HD11      LEU 104 -11.872 -11.572  -1.868
  783   HD12  LEU 104          HD12      LEU 104 -12.350 -10.241  -0.813
  784   HD13  LEU 104          HD13      LEU 104 -10.695 -10.848  -0.772
  785   HD21  LEU 104          HD23      LEU 104  -9.684  -9.436  -4.024
  786   HD22  LEU 104          HD21      LEU 104 -10.238 -11.092  -3.778
  787   HD23  LEU 104          HD22      LEU 104  -9.135 -10.349  -2.618
  788    HA   PRO 105           HA       PRO 105 -15.199  -7.103  -6.997
  789    HB2  PRO 105           HB2      PRO 105 -15.031  -8.588  -9.210
  790    HB3  PRO 105           HB1      PRO 105 -13.893  -7.268  -8.908
  791    HG2  PRO 105           HG2      PRO 105 -13.522 -10.213  -8.530
  792    HG3  PRO 105           HG1      PRO 105 -12.398  -9.021  -9.209
  793    HD2  PRO 105           HD2      PRO 105 -12.301  -9.952  -6.615
  794    HD3  PRO 105           HD1      PRO 105 -11.635  -8.396  -7.148
  795    H    LEU 106           HN       LEU 106 -17.210  -8.073  -7.875
  796    HA   LEU 106           HA       LEU 106 -17.763 -10.756  -6.806
  797    HG   LEU 106           HG       LEU 106 -17.717  -8.376  -4.832
  798    HB2  LEU 106           HB2      LEU 106 -19.541  -8.333  -6.517
  799    HB3  LEU 106           HB1      LEU 106 -19.976  -9.966  -6.052
  800   HD11  LEU 106          HD11      LEU 106 -19.167  -8.176  -2.882
  801   HD12  LEU 106          HD12      LEU 106 -20.466  -8.989  -3.756
  802   HD13  LEU 106          HD13      LEU 106 -19.893  -7.411  -4.296
  803   HD21  LEU 106          HD23      LEU 106 -18.944 -11.024  -4.064
  804   HD22  LEU 106          HD21      LEU 106 -17.716 -10.154  -3.143
  805   HD23  LEU 106          HD22      LEU 106 -17.338 -10.777  -4.749
  806    H    LEU 107           HN       LEU 107 -18.941 -12.054  -8.101
  807    HA   LEU 107           HA       LEU 107 -19.871 -10.907 -10.644
  808    HG   LEU 107           HG       LEU 107 -17.132 -12.248 -10.334
  809    HB2  LEU 107           HB2      LEU 107 -19.070 -13.726  -9.938
  810    HB3  LEU 107           HB1      LEU 107 -19.739 -13.250 -11.488
  811   HD11  LEU 107          HD11      LEU 107 -16.996 -14.587 -10.966
  812   HD12  LEU 107          HD12      LEU 107 -16.102 -13.586 -12.110
  813   HD13  LEU 107          HD13      LEU 107 -17.690 -14.219 -12.544
  814   HD21  LEU 107          HD23      LEU 107 -16.792 -11.290 -12.569
  815   HD22  LEU 107          HD21      LEU 107 -18.194 -10.590 -11.760
  816   HD23  LEU 107          HD22      LEU 107 -18.418 -11.797 -13.025
  817    H    GLU 108           HN       GLU 108 -21.934 -11.196 -11.340
  818    HA   GLU 108           HA       GLU 108 -23.796 -12.400  -9.413
  819    HB2  GLU 108           HB2      GLU 108 -24.306 -10.382 -11.605
  820    HB3  GLU 108           HB1      GLU 108 -25.528 -11.024 -10.515
  821    HG2  GLU 108           HG2      GLU 108 -24.320 -10.051  -8.614
  822    HG3  GLU 108           HG1      GLU 108 -23.135  -9.376  -9.729
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1 -15.416  -1.532  19.448
    2    H2   GLY   1           HT2      GLY   1 -15.962  -1.316  17.862
    3    H3   GLY   1           HT3      GLY   1 -15.778   0.020  18.882
    4    HA2  GLY   1           HA1      GLY   1 -13.961  -0.094  17.296
    5    HA3  GLY   1           HA2      GLY   1 -13.396  -0.289  18.949
    6    H    SER   2           HN       SER   2 -13.154  -1.477  15.882
    7    HA   SER   2           HA       SER   2 -11.755  -3.841  16.814
    8    HG   SER   2           HG       SER   2 -13.670  -4.835  17.544
    9    HB2  SER   2           HB2      SER   2 -14.074  -4.041  14.879
   10    HB3  SER   2           HB1      SER   2 -12.949  -5.348  15.247
   11    H    HIS   3           HN       HIS   3 -10.322  -4.725  15.255
   12    HA   HIS   3           HA       HIS   3  -9.986  -3.139  12.809
   13    HD1  HIS   3           HD1      HIS   3  -8.251  -0.579  13.071
   14    HD2  HIS   3           HD2      HIS   3  -8.589  -2.332  16.824
   15    HE1  HIS   3           HE1      HIS   3  -8.554   1.330  14.679
   16    HE2  HIS   3           HE2      HIS   3  -8.660   0.250  16.954
   17    HB2  HIS   3           HB2      HIS   3  -7.745  -3.917  14.690
   18    HB3  HIS   3           HB1      HIS   3  -7.555  -3.081  13.153
   19    H    GLY   4           HN       GLY   4 -11.134  -5.132  12.046
   20    HA2  GLY   4           HA2      GLY   4  -9.320  -6.849  10.727
   21    HA3  GLY   4           HA1      GLY   4 -10.012  -7.690  12.107
   22    H    TYR   5           HN       TYR   5 -10.384  -7.008   8.867
   23    HA   TYR   5           HA       TYR   5 -13.264  -7.621   8.955
   24    HD1  TYR   5           HD2      TYR   5 -10.969  -4.508   8.532
   25    HD2  TYR   5           HD1      TYR   5 -15.064  -5.301   7.690
   26    HE1  TYR   5           HE2      TYR   5 -11.597  -2.393   9.620
   27    HE2  TYR   5           HE1      TYR   5 -15.702  -3.189   8.774
   28    HH   TYR   5           HH       TYR   5 -14.836  -1.614  10.392
   29    HB2  TYR   5           HB2      TYR   5 -11.666  -6.187   6.826
   30    HB3  TYR   5           HB1      TYR   5 -13.365  -6.619   6.675
   31    H    SER   6           HN       SER   6 -13.135  -9.851   8.970
   32    HA   SER   6           HA       SER   6 -11.496 -11.267   7.074
   33    HG   SER   6           HG       SER   6 -13.833 -11.928  10.032
   34    HB2  SER   6           HB2      SER   6 -12.586 -13.292   8.013
   35    HB3  SER   6           HB1      SER   6 -11.902 -12.254   9.264
   36    H    ASP   7           HN       ASP   7 -12.300 -10.366   5.109
   37    HA   ASP   7           HA       ASP   7 -13.564 -10.334   3.223
   38    HB2  ASP   7           HB2      ASP   7 -13.207 -12.747   3.279
   39    HB3  ASP   7           HB1      ASP   7 -14.586 -12.948   4.355
   40    H    ALA   8           HN       ALA   8 -14.721  -8.478   3.877
   41    HA   ALA   8           HA       ALA   8 -17.553  -9.024   4.420
   42    HB1  ALA   8           HB3      ALA   8 -16.493  -8.371   6.542
   43    HB2  ALA   8           HB1      ALA   8 -17.684  -7.189   6.001
   44    HB3  ALA   8           HB2      ALA   8 -15.963  -6.863   5.798
   45    H    SER   9           HN       SER   9 -18.670  -8.261   2.764
   46    HA   SER   9           HA       SER   9 -19.376  -6.970   1.034
   47    HG   SER   9           HG       SER   9 -20.295  -4.418   1.001
   48    HB2  SER   9           HB2      SER   9 -19.619  -5.294   2.847
   49    HB3  SER   9           HB1      SER   9 -17.974  -4.741   2.529
   50    H    GLY  10           HN       GLY  10 -16.688  -8.240   0.962
   51    HA2  GLY  10           HA2      GLY  10 -15.341  -8.430  -0.981
   52    HA3  GLY  10           HA1      GLY  10 -15.700  -6.753  -1.363
   53    H    PHE  11           HN       PHE  11 -15.071  -5.618   1.153
   54    HA   PHE  11           HA       PHE  11 -12.333  -5.153   0.859
   55    HD1  PHE  11           HD2      PHE  11 -11.981  -2.406   1.345
   56    HD2  PHE  11           HD1      PHE  11 -15.946  -3.658   2.249
   57    HE1  PHE  11           HE2      PHE  11 -12.865  -0.412   0.206
   58    HE2  PHE  11           HE1      PHE  11 -16.839  -1.667   1.109
   59    HZ   PHE  11           HZ       PHE  11 -15.297  -0.041   0.087
   60    HB2  PHE  11           HB2      PHE  11 -14.111  -4.725   3.267
   61    HB3  PHE  11           HB1      PHE  11 -12.477  -4.088   3.114
   62    H    SER  12           HN       SER  12 -10.928  -6.794   0.944
   63    HA   SER  12           HA       SER  12 -10.978  -8.536   3.319
   64    HG   SER  12           HG       SER  12  -8.866 -10.110   2.565
   65    HB2  SER  12           HB2      SER  12 -11.323  -9.769   1.227
   66    HB3  SER  12           HB1      SER  12  -9.831  -9.097   0.572
   67    H    LEU  13           HN       LEU  13  -9.025  -9.001   4.374
   68    HA   LEU  13           HA       LEU  13  -7.072  -6.874   4.204
   69    HG   LEU  13           HG       LEU  13  -7.461  -7.347   7.823
   70    HB2  LEU  13           HB2      LEU  13  -7.687  -9.064   6.122
   71    HB3  LEU  13           HB1      LEU  13  -6.061  -8.406   6.126
   72   HD11  LEU  13          HD11      LEU  13  -6.809  -5.472   5.553
   73   HD12  LEU  13          HD12      LEU  13  -5.673  -6.043   6.776
   74   HD13  LEU  13          HD13      LEU  13  -7.035  -5.025   7.245
   75   HD21  LEU  13          HD23      LEU  13  -9.140  -6.337   5.535
   76   HD22  LEU  13          HD21      LEU  13  -9.380  -6.023   7.254
   77   HD23  LEU  13          HD22      LEU  13  -9.602  -7.653   6.615
   78    H    TYR  14           HN       TYR  14  -5.204  -6.966   3.176
   79    HA   TYR  14           HA       TYR  14  -4.140  -9.606   2.412
   80    HD1  TYR  14           HD1      TYR  14  -6.615  -7.178   0.567
   81    HD2  TYR  14           HD2      TYR  14  -4.069 -10.402  -0.544
   82    HE1  TYR  14           HE1      TYR  14  -8.457  -8.184  -0.714
   83    HE2  TYR  14           HE2      TYR  14  -5.905 -11.415  -1.831
   84    HH   TYR  14           HH       TYR  14  -8.707  -9.765  -2.650
   85    HB2  TYR  14           HB2      TYR  14  -4.187  -7.027   0.840
   86    HB3  TYR  14           HB1      TYR  14  -3.149  -8.383   0.414
   87    H    SER  15           HN       SER  15  -2.024 -10.002   2.823
   88    HA   SER  15           HA       SER  15  -0.333  -7.768   3.694
   89    HG   SER  15           HG       SER  15  -2.126  -8.265   5.356
   90    HB2  SER  15           HB2      SER  15  -0.661 -10.368   5.210
   91    HB3  SER  15           HB1      SER  15   0.494  -9.095   5.601
   92    H    VAL  16           HN       VAL  16   1.606  -7.795   2.787
   93    HA   VAL  16           HA       VAL  16   2.686 -10.351   1.803
   94    HB   VAL  16           HB       VAL  16   2.912  -7.726   0.325
   95   HG11  VAL  16          HG11      VAL  16   3.675 -10.539  -0.453
   96   HG12  VAL  16          HG12      VAL  16   4.785  -9.230  -0.051
   97   HG13  VAL  16          HG13      VAL  16   3.782  -9.122  -1.497
   98   HG21  VAL  16          HG23      VAL  16   0.609  -8.508   0.273
   99   HG22  VAL  16          HG21      VAL  16   1.146 -10.100  -0.264
  100   HG23  VAL  16          HG22      VAL  16   1.363  -8.697  -1.310
  101    H    GLU  17           HN       GLU  17   4.928 -10.577   1.901
  102    HA   GLU  17           HA       GLU  17   6.273  -8.568   3.574
  103    HB2  GLU  17           HB2      GLU  17   6.899 -11.501   3.204
  104    HB3  GLU  17           HB1      GLU  17   7.803 -10.394   4.228
  105    HG2  GLU  17           HG2      GLU  17   5.792 -10.029   5.584
  106    HG3  GLU  17           HG1      GLU  17   4.917 -11.178   4.572
  107    H    LEU  18           HN       LEU  18   7.664  -7.304   2.579
  108    HA   LEU  18           HA       LEU  18   9.057  -8.308   0.187
  109    HG   LEU  18           HG       LEU  18   7.450  -5.417  -1.404
  110    HB2  LEU  18           HB2      LEU  18   7.969  -5.649   0.940
  111    HB3  LEU  18           HB1      LEU  18   9.453  -5.669   0.009
  112   HD11  LEU  18          HD11      LEU  18   9.464  -6.435  -2.322
  113   HD12  LEU  18          HD12      LEU  18   8.013  -7.140  -3.034
  114   HD13  LEU  18          HD13      LEU  18   8.909  -8.025  -1.798
  115   HD21  LEU  18          HD23      LEU  18   6.761  -8.202  -0.474
  116   HD22  LEU  18          HD21      LEU  18   5.906  -7.264  -1.698
  117   HD23  LEU  18          HD22      LEU  18   5.904  -6.729  -0.018
  118    H    PHE  19           HN       PHE  19  11.252  -7.297  -0.157
  119    HA   PHE  19           HA       PHE  19  12.650  -6.483   2.243
  120    HD1  PHE  19           HD2      PHE  19  11.287 -10.038   0.947
  121    HD2  PHE  19           HD1      PHE  19  15.315  -9.061  -0.021
  122    HE1  PHE  19           HE2      PHE  19  11.235 -11.668  -0.896
  123    HE2  PHE  19           HE1      PHE  19  15.270 -10.688  -1.867
  124    HZ   PHE  19           HZ       PHE  19  13.229 -12.015  -2.286
  125    HB2  PHE  19           HB2      PHE  19  14.364  -8.298   1.999
  126    HB3  PHE  19           HB1      PHE  19  12.787  -8.858   2.542
  127    H    ARG  20           HN       ARG  20  14.275  -5.117   1.794
  128    HA   ARG  20           HA       ARG  20  15.230  -5.035  -0.997
  129    HE   ARG  20           HE       ARG  20  14.419  -0.716   0.605
  130    HB2  ARG  20           HB2      ARG  20  13.744  -3.127  -0.481
  131    HB3  ARG  20           HB1      ARG  20  14.805  -2.671   0.844
  132    HG2  ARG  20           HG2      ARG  20  16.551  -2.075  -0.630
  133    HG3  ARG  20           HG1      ARG  20  15.752  -2.844  -2.002
  134    HD2  ARG  20           HD2      ARG  20  15.573  -0.381  -2.035
  135    HD3  ARG  20           HD1      ARG  20  14.005  -1.183  -1.969
  136   HH11  ARG  20          HH11      ARG  20  14.889   1.359  -2.155
  137   HH12  ARG  20          HH12      ARG  20  14.599   2.817  -1.267
  138   HH21  ARG  20          HH21      ARG  20  14.035   1.201   1.777
  139   HH22  ARG  20          HH22      ARG  20  14.114   2.727   0.964
  140    H    GLU  21           HN       GLU  21  17.409  -4.242  -1.296
  141    HA   GLU  21           HA       GLU  21  19.167  -3.804   0.887
  142    HB2  GLU  21           HB2      GLU  21  20.520  -5.861   0.667
  143    HB3  GLU  21           HB1      GLU  21  18.896  -6.186   1.256
  144    HG2  GLU  21           HG2      GLU  21  18.230  -6.866  -1.009
  145    HG3  GLU  21           HG1      GLU  21  19.883  -6.592  -1.557
  146    H    LYS  22           HN       LYS  22  18.425  -2.812  -1.809
  147    HA   LYS  22           HA       LYS  22  21.090  -2.907  -3.066
  148    HB2  LYS  22           HB2      LYS  22  18.396  -2.449  -4.363
  149    HB3  LYS  22           HB1      LYS  22  19.941  -2.347  -5.194
  150    HG2  LYS  22           HG2      LYS  22  18.872  -4.819  -3.848
  151    HG3  LYS  22           HG1      LYS  22  18.768  -4.480  -5.576
  152    HD2  LYS  22           HD2      LYS  22  21.356  -4.650  -4.033
  153    HD3  LYS  22           HD1      LYS  22  20.649  -5.990  -4.936
  154    HE2  LYS  22           HE2      LYS  22  20.762  -4.654  -6.991
  155    HE3  LYS  22           HE1      LYS  22  21.488  -3.328  -6.084
  156    HZ1  LYS  22           HZ3      LYS  22  22.667  -6.034  -6.420
  157    HZ2  LYS  22           HZ1      LYS  22  23.368  -4.750  -5.570
  158    HZ3  LYS  22           HZ2      LYS  22  23.155  -4.640  -7.244
  159    H    ASP  23           HN       ASP  23  21.648  -0.920  -4.307
  160    HA   ASP  23           HA       ASP  23  21.127   1.405  -2.652
  161    HB2  ASP  23           HB2      ASP  23  22.908   2.467  -4.006
  162    HB3  ASP  23           HB1      ASP  23  23.430   0.946  -3.288
  163    H    THR  24           HN       THR  24  19.050   0.290  -4.484
  164    HA   THR  24           HA       THR  24  18.771   2.194  -6.621
  165    HB   THR  24           HB       THR  24  16.561   1.176  -6.990
  166    HG1  THR  24           HG1      THR  24  15.701  -0.215  -5.569
  167   HG21  THR  24          HG23      THR  24  18.544   0.120  -7.970
  168   HG22  THR  24          HG21      THR  24  17.323  -1.081  -7.547
  169   HG23  THR  24          HG22      THR  24  18.738  -0.863  -6.519
  170    H    SER  25           HN       SER  25  17.845   1.992  -3.312
  171    HA   SER  25           HA       SER  25  16.702   3.360  -1.908
  172    HG   SER  25           HG       SER  25  18.721   5.517  -1.725
  173    HB2  SER  25           HB2      SER  25  17.326   5.403  -4.054
  174    HB3  SER  25           HB1      SER  25  16.763   5.783  -2.425
  175    H    SER  26           HN       SER  26  15.284   1.990  -4.204
  176    HA   SER  26           HA       SER  26  12.761   3.443  -3.891
  177    HG   SER  26           HG       SER  26  13.503   5.008  -5.422
  178    HB2  SER  26           HB2      SER  26  13.817   2.441  -6.547
  179    HB3  SER  26           HB1      SER  26  12.216   3.130  -6.276
  180    H    LEU  27           HN       LEU  27  10.932   2.163  -3.858
  181    HA   LEU  27           HA       LEU  27  11.422  -0.742  -3.832
  182    HG   LEU  27           HG       LEU  27  11.855   0.401  -1.277
  183    HB2  LEU  27           HB2      LEU  27   9.589   0.986  -2.198
  184    HB3  LEU  27           HB1      LEU  27   9.286  -0.731  -2.380
  185   HD11  LEU  27          HD11      LEU  27  10.027   1.001   0.196
  186   HD12  LEU  27          HD12      LEU  27  10.992  -0.285   0.919
  187   HD13  LEU  27          HD13      LEU  27   9.436  -0.660   0.177
  188   HD21  LEU  27          HD23      LEU  27  10.693  -2.383  -1.250
  189   HD22  LEU  27          HD21      LEU  27  12.203  -1.885  -0.487
  190   HD23  LEU  27          HD22      LEU  27  12.044  -1.834  -2.242
  191    H    GLY  28           HN       GLY  28  10.413   1.352  -5.919
  192    HA2  GLY  28           HA2      GLY  28   8.969   1.333  -7.699
  193    HA3  GLY  28           HA1      GLY  28   8.846  -0.397  -7.429
  194    H    ILE  29           HN       ILE  29   7.877   2.149  -5.187
  195    HA   ILE  29           HA       ILE  29   5.116   1.146  -5.390
  196    HB   ILE  29           HB       ILE  29   6.403   2.614  -3.084
  197   HG12  ILE  29          HG12      ILE  29   5.643  -0.308  -3.310
  198   HG13  ILE  29          HG11      ILE  29   7.286   0.306  -3.474
  199   HG21  ILE  29          HG21      ILE  29   3.707   1.286  -3.340
  200   HG22  ILE  29          HG22      ILE  29   4.015   3.020  -3.231
  201   HG23  ILE  29          HG23      ILE  29   4.371   1.973  -1.858
  202   HD11  ILE  29          HD13      ILE  29   7.207   1.127  -1.179
  203   HD12  ILE  29          HD11      ILE  29   6.901  -0.608  -1.261
  204   HD13  ILE  29          HD12      ILE  29   5.563   0.513  -1.016
  205    H    SER  30           HN       SER  30   3.926   2.420  -6.650
  206    HA   SER  30           HA       SER  30   4.352   5.327  -6.541
  207    HG   SER  30           HG       SER  30   2.393   6.036  -8.231
  208    HB2  SER  30           HB2      SER  30   4.555   4.324  -8.779
  209    HB3  SER  30           HB1      SER  30   2.924   3.669  -8.636
  210    H    ILE  31           HN       ILE  31   3.023   6.333  -5.195
  211    HA   ILE  31           HA       ILE  31   0.294   5.293  -4.839
  212    HB   ILE  31           HB       ILE  31   0.261   6.637  -2.748
  213   HG12  ILE  31          HG12      ILE  31   3.226   6.980  -3.235
  214   HG13  ILE  31          HG11      ILE  31   2.039   8.248  -3.515
  215   HG21  ILE  31          HG21      ILE  31   1.703   5.131  -1.469
  216   HG22  ILE  31          HG22      ILE  31   2.504   4.631  -2.960
  217   HG23  ILE  31          HG23      ILE  31   0.799   4.259  -2.708
  218   HD11  ILE  31          HD13      ILE  31   1.449   8.243  -1.166
  219   HD12  ILE  31          HD11      ILE  31   3.180   8.506  -1.374
  220   HD13  ILE  31          HD12      ILE  31   2.583   6.925  -0.869
  221    H    SER  32           HN       SER  32  -1.360   6.993  -4.329
  222    HA   SER  32           HA       SER  32  -0.889   9.546  -5.672
  223    HG   SER  32           HG       SER  32  -1.243   8.729  -8.118
  224    HB2  SER  32           HB2      SER  32  -3.179   7.683  -6.354
  225    HB3  SER  32           HB1      SER  32  -2.999   9.335  -6.946
  226    H    GLY  33           HN       GLY  33  -1.891  11.229  -4.710
  227    HA2  GLY  33           HA2      GLY  33  -3.407  10.650  -2.286
  228    HA3  GLY  33           HA1      GLY  33  -2.738  12.207  -2.748
  229    H    MET  34           HN       MET  34  -5.315   9.897  -3.491
  230    HA   MET  34           HA       MET  34  -6.876  12.079  -4.678
  231    HB2  MET  34           HB2      MET  34  -6.493   9.825  -5.872
  232    HB3  MET  34           HB1      MET  34  -7.646   9.171  -4.717
  233    HG2  MET  34           HG2      MET  34  -8.256  11.506  -6.505
  234    HG3  MET  34           HG1      MET  34  -8.577   9.832  -6.952
  235    HE1  MET  34           HE3      MET  34 -11.287   8.740  -4.401
  236    HE2  MET  34           HE1      MET  34  -9.547   8.459  -4.333
  237    HE3  MET  34           HE2      MET  34 -10.404   8.319  -5.868
  238    H    ARG  35           HN       ARG  35  -8.171  13.105  -3.311
  239    HA   ARG  35           HA       ARG  35  -9.268  11.653  -1.012
  240    HE   ARG  35           HE       ARG  35  -8.802  14.121   1.951
  241    HB2  ARG  35           HB2      ARG  35  -9.163  14.623  -1.567
  242    HB3  ARG  35           HB1      ARG  35  -9.777  13.880  -0.096
  243    HG2  ARG  35           HG2      ARG  35  -6.953  13.532  -1.066
  244    HG3  ARG  35           HG1      ARG  35  -7.454  14.809   0.044
  245    HD2  ARG  35           HD2      ARG  35  -7.857  11.863   0.540
  246    HD3  ARG  35           HD1      ARG  35  -6.501  12.800   1.166
  247   HH11  ARG  35          HH11      ARG  35  -7.343  10.997   2.457
  248   HH12  ARG  35          HH12      ARG  35  -8.025  10.791   4.035
  249   HH21  ARG  35          HH21      ARG  35  -9.703  13.860   4.029
  250   HH22  ARG  35          HH22      ARG  35  -9.368  12.418   4.929
  251    H    ASP  36           HN       ASP  36 -11.486  11.824  -0.462
  252    HA   ASP  36           HA       ASP  36 -13.232  12.457  -2.750
  253    HB2  ASP  36           HB2      ASP  36 -13.106  10.034  -2.197
  254    HB3  ASP  36           HB1      ASP  36 -13.715  10.399  -0.586
  255    H    GLN  37           HN       GLN  37 -15.026  13.692  -2.405
  256    HA   GLN  37           HA       GLN  37 -15.197  14.992   0.212
  257    HB2  GLN  37           HB2      GLN  37 -16.475  15.757  -2.420
  258    HB3  GLN  37           HB1      GLN  37 -16.531  16.702  -0.938
  259    HG2  GLN  37           HG2      GLN  37 -14.101  16.963  -1.018
  260    HG3  GLN  37           HG1      GLN  37 -14.055  16.028  -2.511
  261   HE21  GLN  37          HE21      GLN  37 -13.172  17.707  -3.685
  262   HE22  GLN  37          HE22      GLN  37 -14.078  19.111  -4.128
  263    H    SER  38           HN       SER  38 -17.307  15.438   1.142
  264    HA   SER  38           HA       SER  38 -19.281  14.733   2.020
  265    HG   SER  38           HG       SER  38 -19.444  16.253   0.088
  266    HB2  SER  38           HB2      SER  38 -19.783  13.867  -0.837
  267    HB3  SER  38           HB1      SER  38 -21.019  14.023   0.412
  268    H    THR  39           HN       THR  39 -17.540  13.091   2.890
  269    HA   THR  39           HA       THR  39 -17.764  10.382   2.038
  270    HB   THR  39           HB       THR  39 -16.592   9.855   4.184
  271    HG1  THR  39           HG1      THR  39 -17.041  11.362   5.647
  272   HG21  THR  39          HG23      THR  39 -15.323  10.376   2.157
  273   HG22  THR  39          HG21      THR  39 -14.498  10.982   3.593
  274   HG23  THR  39          HG22      THR  39 -15.386  12.093   2.553
  275    H    THR  40           HN       THR  40 -18.726   8.630   3.152
  276    HA   THR  40           HA       THR  40 -20.630   9.195   5.271
  277    HB   THR  40           HB       THR  40 -21.968   9.646   3.280
  278    HG1  THR  40           HG1      THR  40 -23.561   7.911   3.657
  279   HG21  THR  40          HG23      THR  40 -22.416   7.888   1.633
  280   HG22  THR  40          HG21      THR  40 -21.262   6.830   2.446
  281   HG23  THR  40          HG22      THR  40 -20.704   8.310   1.667
  282    H    GLY  41           HN       GLY  41 -18.291   7.329   4.026
  283    HA2  GLY  41           HA2      GLY  41 -18.473   5.286   5.901
  284    HA3  GLY  41           HA1      GLY  41 -19.237   4.687   4.435
  285    H    GLU  42           HN       GLU  42 -17.664   5.770   2.474
  286    HA   GLU  42           HA       GLU  42 -15.244   4.188   2.786
  287    HB2  GLU  42           HB2      GLU  42 -16.546   5.527   0.419
  288    HB3  GLU  42           HB1      GLU  42 -14.957   4.783   0.320
  289    HG2  GLU  42           HG2      GLU  42 -16.650   3.270  -0.495
  290    HG3  GLU  42           HG1      GLU  42 -15.922   2.635   0.980
  291    H    ALA  43           HN       ALA  43 -13.150   5.027   2.114
  292    HA   ALA  43           HA       ALA  43 -12.790   7.896   2.030
  293    HB1  ALA  43           HB3      ALA  43 -11.662   6.306   4.331
  294    HB2  ALA  43           HB1      ALA  43 -12.951   7.504   4.432
  295    HB3  ALA  43           HB2      ALA  43 -11.320   7.999   3.979
  296    H    THR  44           HN       THR  44 -11.288   8.255   0.549
  297    HA   THR  44           HA       THR  44  -9.252   6.187   0.069
  298    HB   THR  44           HB       THR  44  -8.970   7.226  -2.165
  299    HG1  THR  44           HG1      THR  44 -11.205   8.597  -2.392
  300   HG21  THR  44          HG23      THR  44 -10.483   5.324  -1.887
  301   HG22  THR  44          HG21      THR  44 -11.089   6.437  -3.115
  302   HG23  THR  44          HG22      THR  44 -11.808   6.424  -1.503
  303    H    GLY  45           HN       GLY  45  -7.187   6.611   0.499
  304    HA2  GLY  45           HA2      GLY  45  -6.329   9.426   0.686
  305    HA3  GLY  45           HA1      GLY  45  -5.951   8.294   1.977
  306    H    ILE  46           HN       ILE  46  -3.996   7.418   1.892
  307    HA   ILE  46           HA       ILE  46  -2.389   7.689  -0.495
  308    HB   ILE  46           HB       ILE  46  -1.692   6.405   2.152
  309   HG12  ILE  46          HG12      ILE  46  -2.244   8.774   2.422
  310   HG13  ILE  46          HG11      ILE  46  -0.517   8.515   2.638
  311   HG21  ILE  46          HG21      ILE  46   0.055   7.268  -0.149
  312   HG22  ILE  46          HG22      ILE  46  -0.255   5.614   0.378
  313   HG23  ILE  46          HG23      ILE  46   0.641   6.719   1.420
  314   HD11  ILE  46          HD13      ILE  46  -0.085   9.364   0.414
  315   HD12  ILE  46          HD11      ILE  46  -1.008  10.536   1.354
  316   HD13  ILE  46          HD12      ILE  46  -1.816   9.555   0.130
  317    H    TYR  47           HN       TYR  47  -3.008   6.281  -2.065
  318    HA   TYR  47           HA       TYR  47  -2.870   3.418  -1.390
  319    HD1  TYR  47           HD1      TYR  47  -5.389   6.551  -2.481
  320    HD2  TYR  47           HD2      TYR  47  -4.667   3.387  -5.234
  321    HE1  TYR  47           HE1      TYR  47  -6.064   8.016  -4.332
  322    HE2  TYR  47           HE2      TYR  47  -5.342   4.847  -7.095
  323    HH   TYR  47           HH       TYR  47  -5.719   8.206  -6.751
  324    HB2  TYR  47           HB2      TYR  47  -4.690   2.940  -2.907
  325    HB3  TYR  47           HB1      TYR  47  -5.223   4.155  -1.750
  326    H    VAL  48           HN       VAL  48  -1.847   2.092  -2.839
  327    HA   VAL  48           HA       VAL  48  -0.051   3.345  -4.694
  328    HB   VAL  48           HB       VAL  48  -0.569   0.423  -4.115
  329   HG11  VAL  48          HG11      VAL  48   1.593   1.713  -5.776
  330   HG12  VAL  48          HG12      VAL  48   0.316   0.641  -6.351
  331   HG13  VAL  48          HG13      VAL  48   1.572   0.021  -5.281
  332   HG21  VAL  48          HG23      VAL  48   1.517   0.524  -2.868
  333   HG22  VAL  48          HG21      VAL  48   0.360   1.695  -2.234
  334   HG23  VAL  48          HG22      VAL  48   1.687   2.234  -3.263
  335    H    LYS  49           HN       LYS  49  -0.692   3.984  -6.642
  336    HA   LYS  49           HA       LYS  49  -2.968   2.725  -7.929
  337    HB2  LYS  49           HB2      LYS  49  -2.735   5.191  -7.868
  338    HB3  LYS  49           HB1      LYS  49  -1.282   5.059  -8.848
  339    HG2  LYS  49           HG2      LYS  49  -2.574   4.121 -10.679
  340    HG3  LYS  49           HG1      LYS  49  -4.037   4.184  -9.694
  341    HD2  LYS  49           HD2      LYS  49  -2.386   6.604 -10.404
  342    HD3  LYS  49           HD1      LYS  49  -3.789   6.067 -11.330
  343    HE2  LYS  49           HE2      LYS  49  -5.185   6.304  -9.324
  344    HE3  LYS  49           HE1      LYS  49  -3.780   6.868  -8.420
  345    HZ1  LYS  49           HZ3      LYS  49  -3.618   8.756  -9.920
  346    HZ2  LYS  49           HZ1      LYS  49  -5.140   8.711  -9.182
  347    HZ3  LYS  49           HZ2      LYS  49  -4.964   8.214 -10.789
  348    H    SER  50           HN       SER  50   0.509   2.844  -8.253
  349    HA   SER  50           HA       SER  50   0.390   0.700 -10.198
  350    HG   SER  50           HG       SER  50   1.415   4.061 -10.114
  351    HB2  SER  50           HB2      SER  50   1.862   1.847 -11.825
  352    HB3  SER  50           HB1      SER  50   0.300   2.649 -11.661
  353    H    LEU  51           HN       LEU  51   2.778   0.171 -10.899
  354    HA   LEU  51           HA       LEU  51   4.590   0.508  -8.613
  355    HG   LEU  51           HG       LEU  51   2.234  -1.440  -8.308
  356    HB2  LEU  51           HB2      LEU  51   3.977  -2.116  -9.977
  357    HB3  LEU  51           HB1      LEU  51   5.190  -1.874  -8.734
  358   HD11  LEU  51          HD11      LEU  51   3.941  -3.806  -7.550
  359   HD12  LEU  51          HD12      LEU  51   2.711  -3.787  -8.814
  360   HD13  LEU  51          HD13      LEU  51   2.246  -3.565  -7.127
  361   HD21  LEU  51          HD23      LEU  51   4.551  -1.624  -6.386
  362   HD22  LEU  51          HD21      LEU  51   2.852  -1.477  -5.936
  363   HD23  LEU  51          HD22      LEU  51   3.653  -0.163  -6.799
  364    H    ILE  52           HN       ILE  52   6.826   0.211  -9.112
  365    HA   ILE  52           HA       ILE  52   7.446   0.897 -11.869
  366    HB   ILE  52           HB       ILE  52   9.253   0.779  -9.458
  367   HG12  ILE  52          HG12      ILE  52   7.937   3.113 -10.864
  368   HG13  ILE  52          HG11      ILE  52   7.523   2.502  -9.267
  369   HG21  ILE  52          HG21      ILE  52  10.846   2.012 -10.844
  370   HG22  ILE  52          HG22      ILE  52   9.744   1.900 -12.215
  371   HG23  ILE  52          HG23      ILE  52  10.471   0.439 -11.545
  372   HD11  ILE  52          HD13      ILE  52   9.766   3.114  -8.481
  373   HD12  ILE  52          HD11      ILE  52   8.851   4.498  -9.080
  374   HD13  ILE  52          HD12      ILE  52  10.118   3.782 -10.075
  375    HA   PRO  53           HA       PRO  53   8.273  -3.499 -12.610
  376    HB2  PRO  53           HB2      PRO  53   9.218  -3.059 -15.177
  377    HB3  PRO  53           HB1      PRO  53   7.525  -3.334 -14.754
  378    HG2  PRO  53           HG2      PRO  53   8.961  -0.762 -15.259
  379    HG3  PRO  53           HG1      PRO  53   7.325  -1.249 -15.739
  380    HD2  PRO  53           HD2      PRO  53   7.739   0.397 -13.667
  381    HD3  PRO  53           HD1      PRO  53   6.447  -0.821 -13.633
  382    H    GLY  54           HN       GLY  54  10.048  -4.476 -11.899
  383    HA2  GLY  54           HA2      GLY  54  12.369  -5.050 -12.295
  384    HA3  GLY  54           HA1      GLY  54  12.670  -3.356 -12.655
  385    H    SER  55           HN       SER  55  10.648  -3.232 -10.122
  386    HA   SER  55           HA       SER  55  12.874  -2.990  -8.230
  387    HG   SER  55           HG       SER  55  12.237  -0.877  -6.624
  388    HB2  SER  55           HB2      SER  55  11.392  -1.017  -8.586
  389    HB3  SER  55           HB1      SER  55  10.041  -1.961  -7.959
  390    H    ALA  56           HN       ALA  56  12.003  -3.356  -5.840
  391    HA   ALA  56           HA       ALA  56  11.703  -6.112  -5.508
  392    HB1  ALA  56           HB3      ALA  56  12.644  -4.640  -3.796
  393    HB2  ALA  56           HB1      ALA  56  11.336  -5.631  -3.150
  394    HB3  ALA  56           HB2      ALA  56  11.050  -3.932  -3.528
  395    H    ALA  57           HN       ALA  57   9.270  -3.582  -4.848
  396    HA   ALA  57           HA       ALA  57   7.137  -5.230  -4.233
  397    HB1  ALA  57           HB3      ALA  57   7.030  -2.564  -5.634
  398    HB2  ALA  57           HB1      ALA  57   7.111  -2.817  -3.891
  399    HB3  ALA  57           HB2      ALA  57   5.693  -3.348  -4.794
  400    H    ALA  58           HN       ALA  58   7.994  -3.903  -7.428
  401    HA   ALA  58           HA       ALA  58   5.873  -5.013  -8.865
  402    HB1  ALA  58           HB3      ALA  58   7.341  -3.259  -9.739
  403    HB2  ALA  58           HB1      ALA  58   7.212  -4.620 -10.853
  404    HB3  ALA  58           HB2      ALA  58   8.657  -4.426  -9.860
  405    H    LEU  59           HN       LEU  59   9.032  -6.376  -8.051
  406    HA   LEU  59           HA       LEU  59   8.739  -8.699  -9.669
  407    HG   LEU  59           HG       LEU  59  11.093  -6.866  -9.446
  408    HB2  LEU  59           HB2      LEU  59  10.550  -8.061  -7.348
  409    HB3  LEU  59           HB1      LEU  59  10.616  -9.582  -8.215
  410   HD11  LEU  59          HD11      LEU  59  12.877  -7.458  -7.914
  411   HD12  LEU  59          HD12      LEU  59  13.435  -7.587  -9.582
  412   HD13  LEU  59          HD13      LEU  59  13.029  -9.043  -8.672
  413   HD21  LEU  59          HD23      LEU  59  10.179  -8.452 -11.043
  414   HD22  LEU  59          HD21      LEU  59  11.393  -9.644 -10.580
  415   HD23  LEU  59          HD22      LEU  59  11.884  -8.151 -11.380
  416    H    ASP  60           HN       ASP  60   7.582  -7.816  -6.542
  417    HA   ASP  60           HA       ASP  60   7.305 -10.344  -5.364
  418    HB2  ASP  60           HB2      ASP  60   7.001  -8.145  -4.201
  419    HB3  ASP  60           HB1      ASP  60   5.445  -7.989  -5.009
  420    H    GLY  61           HN       GLY  61   4.859  -8.432  -7.131
  421    HA2  GLY  61           HA2      GLY  61   3.434  -9.355  -8.793
  422    HA3  GLY  61           HA1      GLY  61   3.715 -10.948  -8.113
  423    H    ARG  62           HN       ARG  62   3.113 -10.534  -5.450
  424    HA   ARG  62           HA       ARG  62   0.322 -10.768  -5.451
  425    HE   ARG  62           HE       ARG  62   0.180 -11.948  -1.652
  426    HB2  ARG  62           HB2      ARG  62   2.186 -10.175  -3.148
  427    HB3  ARG  62           HB1      ARG  62   0.505 -10.663  -2.982
  428    HG2  ARG  62           HG2      ARG  62   1.032 -12.781  -4.122
  429    HG3  ARG  62           HG1      ARG  62   2.726 -12.291  -4.198
  430    HD2  ARG  62           HD2      ARG  62   2.291 -13.803  -2.318
  431    HD3  ARG  62           HD1      ARG  62   2.838 -12.218  -1.775
  432   HH11  ARG  62          HH11      ARG  62   2.288 -14.480  -0.520
  433   HH12  ARG  62          HH12      ARG  62   1.271 -14.906   0.815
  434   HH21  ARG  62          HH21      ARG  62  -1.164 -12.501   0.105
  435   HH22  ARG  62          HH22      ARG  62  -0.690 -13.781   1.170
  436    H    ILE  63           HN       ILE  63   2.372  -7.974  -5.145
  437    HA   ILE  63           HA       ILE  63   0.404  -6.266  -3.976
  438    HB   ILE  63           HB       ILE  63   2.884  -5.523  -5.536
  439   HG12  ILE  63          HG12      ILE  63   2.448  -5.727  -2.546
  440   HG13  ILE  63          HG11      ILE  63   3.310  -6.914  -3.519
  441   HG21  ILE  63          HG21      ILE  63   1.285  -3.692  -5.432
  442   HG22  ILE  63          HG22      ILE  63   2.678  -3.354  -4.404
  443   HG23  ILE  63          HG23      ILE  63   1.158  -3.882  -3.682
  444   HD11  ILE  63          HD13      ILE  63   4.972  -5.218  -4.097
  445   HD12  ILE  63          HD11      ILE  63   4.853  -5.461  -2.355
  446   HD13  ILE  63          HD12      ILE  63   4.113  -4.045  -3.100
  447    H    GLU  64           HN       GLU  64  -1.466  -6.059  -5.057
  448    HA   GLU  64           HA       GLU  64  -1.448  -5.630  -7.944
  449    HB2  GLU  64           HB2      GLU  64  -3.057  -7.237  -7.079
  450    HB3  GLU  64           HB1      GLU  64  -3.719  -6.028  -5.986
  451    HG2  GLU  64           HG2      GLU  64  -4.507  -4.726  -7.886
  452    HG3  GLU  64           HG1      GLU  64  -3.816  -5.910  -8.994
  453    HA   PRO  65           HA       PRO  65  -1.657  -1.210  -7.560
  454    HB2  PRO  65           HB2      PRO  65  -3.086  -0.701  -9.871
  455    HB3  PRO  65           HB1      PRO  65  -1.338  -0.942  -9.798
  456    HG2  PRO  65           HG2      PRO  65  -3.493  -2.886 -10.515
  457    HG3  PRO  65           HG1      PRO  65  -1.898  -2.656 -11.257
  458    HD2  PRO  65           HD2      PRO  65  -2.364  -4.682  -9.573
  459    HD3  PRO  65           HD1      PRO  65  -0.808  -3.824  -9.570
  460    H    ASN  66           HN       ASN  66  -3.321   0.563  -7.659
  461    HA   ASN  66           HA       ASN  66  -5.225   1.494  -6.846
  462    HB2  ASN  66           HB2      ASN  66  -6.510  -1.011  -7.957
  463    HB3  ASN  66           HB1      ASN  66  -7.359   0.466  -7.506
  464   HD21  ASN  66          HD21      ASN  66  -5.230  -1.035  -9.801
  465   HD22  ASN  66          HD22      ASN  66  -5.362   0.177 -11.025
  466    H    ASP  67           HN       ASP  67  -3.631  -0.273  -5.145
  467    HA   ASP  67           HA       ASP  67  -5.670  -1.350  -3.324
  468    HB2  ASP  67           HB2      ASP  67  -3.731  -2.800  -4.058
  469    HB3  ASP  67           HB1      ASP  67  -2.673  -1.717  -3.160
  470    H    LYS  68           HN       LYS  68  -5.916  -0.586  -1.252
  471    HA   LYS  68           HA       LYS  68  -4.761   2.020  -0.722
  472    HB2  LYS  68           HB2      LYS  68  -7.165   1.632  -0.369
  473    HB3  LYS  68           HB1      LYS  68  -6.787   0.412   0.841
  474    HG2  LYS  68           HG2      LYS  68  -5.758   2.095   2.251
  475    HG3  LYS  68           HG1      LYS  68  -6.065   3.328   1.026
  476    HD2  LYS  68           HD2      LYS  68  -8.500   2.834   1.243
  477    HD3  LYS  68           HD1      LYS  68  -8.112   1.758   2.588
  478    HE2  LYS  68           HE2      LYS  68  -7.406   4.683   2.472
  479    HE3  LYS  68           HE1      LYS  68  -8.821   4.027   3.295
  480    HZ1  LYS  68           HZ3      LYS  68  -5.998   3.363   3.933
  481    HZ2  LYS  68           HZ1      LYS  68  -7.362   2.758   4.733
  482    HZ3  LYS  68           HZ2      LYS  68  -6.987   4.405   4.827
  483    H    ILE  69           HN       ILE  69  -3.111   2.403   0.608
  484    HA   ILE  69           HA       ILE  69  -1.935   0.178   2.076
  485    HB   ILE  69           HB       ILE  69  -0.890   2.997   1.790
  486   HG12  ILE  69          HG12      ILE  69  -1.108   1.954  -0.413
  487   HG13  ILE  69          HG11      ILE  69   0.588   2.094   0.038
  488   HG21  ILE  69          HG21      ILE  69   0.044   1.798   3.683
  489   HG22  ILE  69          HG22      ILE  69   1.259   2.002   2.421
  490   HG23  ILE  69          HG23      ILE  69   0.466   0.442   2.637
  491   HD11  ILE  69          HD13      ILE  69   0.614  -0.268   0.656
  492   HD12  ILE  69          HD11      ILE  69   0.134  -0.036  -1.025
  493   HD13  ILE  69          HD12      ILE  69  -1.083  -0.404   0.197
  494    H    LEU  70           HN       LEU  70  -1.850   0.015   4.262
  495    HA   LEU  70           HA       LEU  70  -3.309   2.066   5.782
  496    HG   LEU  70           HG       LEU  70  -4.521  -0.579   4.701
  497    HB2  LEU  70           HB2      LEU  70  -2.794  -0.831   6.459
  498    HB3  LEU  70           HB1      LEU  70  -3.678   0.301   7.465
  499   HD11  LEU  70          HD11      LEU  70  -4.682  -2.406   6.291
  500   HD12  LEU  70          HD12      LEU  70  -6.288  -1.811   5.872
  501   HD13  LEU  70          HD13      LEU  70  -5.561  -1.371   7.417
  502   HD21  LEU  70          HD23      LEU  70  -6.622   0.545   5.226
  503   HD22  LEU  70          HD21      LEU  70  -5.272   1.678   5.266
  504   HD23  LEU  70          HD22      LEU  70  -5.961   1.075   6.773
  505    H    ARG  71           HN       ARG  71  -0.740  -0.333   6.452
  506    HA   ARG  71           HA       ARG  71   0.908   1.790   7.568
  507    HE   ARG  71           HE       ARG  71   1.646  -0.935  11.158
  508    HB2  ARG  71           HB2      ARG  71   1.266   0.561   9.681
  509    HB3  ARG  71           HB1      ARG  71  -0.393   1.108   9.487
  510    HG2  ARG  71           HG2      ARG  71  -1.054  -1.139   8.794
  511    HG3  ARG  71           HG1      ARG  71   0.612  -1.687   8.993
  512    HD2  ARG  71           HD2      ARG  71  -1.151  -0.560  11.167
  513    HD3  ARG  71           HD1      ARG  71  -0.772  -2.266  10.931
  514   HH11  ARG  71          HH11      ARG  71  -1.172  -1.507  13.130
  515   HH12  ARG  71          HH12      ARG  71  -0.298  -1.440  14.624
  516   HH21  ARG  71          HH21      ARG  71   2.803  -0.848  13.120
  517   HH22  ARG  71          HH22      ARG  71   1.961  -1.067  14.618
  518    H    VAL  72           HN       VAL  72   3.017   1.472   7.289
  519    HA   VAL  72           HA       VAL  72   3.880  -0.941   5.909
  520    HB   VAL  72           HB       VAL  72   5.649   1.399   6.588
  521   HG11  VAL  72          HG11      VAL  72   5.621  -0.618   4.350
  522   HG12  VAL  72          HG12      VAL  72   6.798  -0.485   5.657
  523   HG13  VAL  72          HG13      VAL  72   6.705   0.771   4.424
  524   HG21  VAL  72          HG23      VAL  72   3.635   2.349   5.609
  525   HG22  VAL  72          HG21      VAL  72   3.743   1.222   4.256
  526   HG23  VAL  72          HG22      VAL  72   4.984   2.456   4.477
  527    H    ASP  73           HN       ASP  73   6.239  -1.640   6.573
  528    HA   ASP  73           HA       ASP  73   6.202  -2.962   8.958
  529    HB2  ASP  73           HB2      ASP  73   7.857  -3.275   7.108
  530    HB3  ASP  73           HB1      ASP  73   8.703  -1.843   7.683
  531    H    ASP  74           HN       ASP  74   5.826  -2.128  10.911
  532    HA   ASP  74           HA       ASP  74   5.957  -0.842  12.782
  533    HB2  ASP  74           HB2      ASP  74   8.794  -0.521  11.789
  534    HB3  ASP  74           HB1      ASP  74   8.242  -0.038  13.390
  535    H    VAL  75           HN       VAL  75   5.110   0.463  10.290
  536    HA   VAL  75           HA       VAL  75   5.398   3.218  11.201
  537    HB   VAL  75           HB       VAL  75   5.945   2.414   8.335
  538   HG11  VAL  75          HG11      VAL  75   4.732   4.513   8.452
  539   HG12  VAL  75          HG12      VAL  75   6.406   4.804   7.982
  540   HG13  VAL  75          HG13      VAL  75   5.884   5.137   9.632
  541   HG21  VAL  75          HG23      VAL  75   7.789   3.605  10.407
  542   HG22  VAL  75          HG21      VAL  75   8.196   3.287   8.721
  543   HG23  VAL  75          HG22      VAL  75   7.838   1.947   9.808
  544    H    ASN  76           HN       ASN  76   3.664   4.550  10.643
  545    HA   ASN  76           HA       ASN  76   1.372   3.166   9.409
  546    HB2  ASN  76           HB2      ASN  76  -0.063   4.656  10.798
  547    HB3  ASN  76           HB1      ASN  76   0.942   3.573  11.757
  548   HD21  ASN  76          HD21      ASN  76   0.370   6.854  10.789
  549   HD22  ASN  76          HD22      ASN  76   1.402   7.595  11.960
  550    H    VAL  77           HN       VAL  77   0.520   4.059   7.622
  551    HA   VAL  77           HA       VAL  77   1.438   6.760   6.889
  552    HB   VAL  77           HB       VAL  77   1.020   6.146   4.554
  553   HG11  VAL  77          HG11      VAL  77   2.783   4.187   6.021
  554   HG12  VAL  77          HG12      VAL  77   3.241   5.800   5.475
  555   HG13  VAL  77          HG13      VAL  77   2.861   4.545   4.296
  556   HG21  VAL  77          HG23      VAL  77  -0.779   4.527   4.933
  557   HG22  VAL  77          HG21      VAL  77   0.383   3.402   5.636
  558   HG23  VAL  77          HG22      VAL  77   0.504   3.847   3.934
  559    H    GLN  78           HN       GLN  78  -0.910   6.032   8.557
  560    HA   GLN  78           HA       GLN  78  -3.137   6.857   6.851
  561    HB2  GLN  78           HB2      GLN  78  -3.107   5.926   9.727
  562    HB3  GLN  78           HB1      GLN  78  -4.551   6.314   8.803
  563    HG2  GLN  78           HG2      GLN  78  -2.595   4.123   8.150
  564    HG3  GLN  78           HG1      GLN  78  -4.158   3.908   8.936
  565   HE21  GLN  78          HE21      GLN  78  -2.524   4.690   5.963
  566   HE22  GLN  78          HE22      GLN  78  -3.884   4.466   4.923
  567    H    GLY  79           HN       GLY  79  -0.915   8.653   7.767
  568    HA2  GLY  79           HA2      GLY  79  -2.540  10.920   8.360
  569    HA3  GLY  79           HA1      GLY  79  -1.646  10.397   9.779
  570    H    MET  80           HN       MET  80  -0.070   9.772   6.816
  571    HA   MET  80           HA       MET  80   1.618  12.157   7.212
  572    HB2  MET  80           HB2      MET  80   2.473   9.463   6.140
  573    HB3  MET  80           HB1      MET  80   3.515  10.851   6.421
  574    HG2  MET  80           HG2      MET  80   2.912  10.703   8.843
  575    HG3  MET  80           HG1      MET  80   2.091   9.187   8.478
  576    HE1  MET  80           HE3      MET  80   5.118   7.028   7.126
  577    HE2  MET  80           HE1      MET  80   4.150   8.124   6.141
  578    HE3  MET  80           HE2      MET  80   3.370   7.097   7.343
  579    H    ALA  81           HN       ALA  81   2.254  13.325   5.438
  580    HA   ALA  81           HA       ALA  81   0.575  13.262   3.164
  581    HB1  ALA  81           HB3      ALA  81   1.940  15.066   2.310
  582    HB2  ALA  81           HB1      ALA  81   3.204  14.703   3.486
  583    HB3  ALA  81           HB2      ALA  81   1.642  15.313   4.031
  584    H    GLN  82           HN       GLN  82   1.420  13.168   0.897
  585    HA   GLN  82           HA       GLN  82   2.350  10.668   0.240
  586    HB2  GLN  82           HB2      GLN  82   1.264  12.187  -1.351
  587    HB3  GLN  82           HB1      GLN  82   2.690  13.215  -1.352
  588    HG2  GLN  82           HG2      GLN  82   4.006  11.374  -2.294
  589    HG3  GLN  82           HG1      GLN  82   2.557  10.368  -2.323
  590   HE21  GLN  82          HE21      GLN  82   0.941  10.803  -3.817
  591   HE22  GLN  82          HE22      GLN  82   1.204  11.813  -5.192
  592    H    SER  83           HN       SER  83   4.287  13.668   0.182
  593    HA   SER  83           HA       SER  83   6.732  12.578  -0.479
  594    HG   SER  83           HG       SER  83   8.474  13.769   0.792
  595    HB2  SER  83           HB2      SER  83   6.340  14.990  -0.382
  596    HB3  SER  83           HB1      SER  83   6.194  14.911   1.374
  597    H    ASP  84           HN       ASP  84   5.232  12.814   2.714
  598    HA   ASP  84           HA       ASP  84   7.462  11.949   4.203
  599    HB2  ASP  84           HB2      ASP  84   4.505  11.779   4.801
  600    HB3  ASP  84           HB1      ASP  84   5.769  11.403   5.968
  601    H    VAL  85           HN       VAL  85   4.690  10.160   2.879
  602    HA   VAL  85           HA       VAL  85   5.341   7.638   3.880
  603    HB   VAL  85           HB       VAL  85   3.983   8.254   1.250
  604   HG11  VAL  85          HG11      VAL  85   2.921   6.049   1.566
  605   HG12  VAL  85          HG12      VAL  85   3.944   5.783   2.979
  606   HG13  VAL  85          HG13      VAL  85   4.671   5.937   1.380
  607   HG21  VAL  85          HG23      VAL  85   2.901   9.380   3.132
  608   HG22  VAL  85          HG21      VAL  85   2.793   7.844   3.991
  609   HG23  VAL  85          HG22      VAL  85   1.890   8.083   2.495
  610    H    VAL  86           HN       VAL  86   6.556   9.389   1.102
  611    HA   VAL  86           HA       VAL  86   7.867   7.205  -0.147
  612    HB   VAL  86           HB       VAL  86   8.485  10.159  -0.339
  613   HG11  VAL  86          HG11      VAL  86   9.571   9.579  -2.464
  614   HG12  VAL  86          HG12      VAL  86   9.289   7.870  -2.132
  615   HG13  VAL  86          HG13      VAL  86  10.361   8.806  -1.091
  616   HG21  VAL  86          HG23      VAL  86   6.187   9.610  -0.983
  617   HG22  VAL  86          HG21      VAL  86   6.793   8.396  -2.109
  618   HG23  VAL  86          HG22      VAL  86   7.146  10.103  -2.377
  619    H    GLU  87           HN       GLU  87   8.929   9.663   2.179
  620    HA   GLU  87           HA       GLU  87  11.646   9.049   2.233
  621    HB2  GLU  87           HB2      GLU  87   9.866  10.028   4.472
  622    HB3  GLU  87           HB1      GLU  87  11.624  10.005   4.537
  623    HG2  GLU  87           HG2      GLU  87  11.711  11.537   2.636
  624    HG3  GLU  87           HG1      GLU  87   9.949  11.568   2.584
  625    H    VAL  88           HN       VAL  88   8.991   7.698   4.164
  626    HA   VAL  88           HA       VAL  88  10.510   5.978   5.764
  627    HB   VAL  88           HB       VAL  88   7.668   5.718   4.778
  628   HG11  VAL  88          HG11      VAL  88   9.072   4.097   6.903
  629   HG12  VAL  88          HG12      VAL  88   8.521   3.503   5.335
  630   HG13  VAL  88          HG13      VAL  88   7.348   4.043   6.536
  631   HG21  VAL  88          HG23      VAL  88   8.836   6.623   7.409
  632   HG22  VAL  88          HG21      VAL  88   7.115   6.427   7.073
  633   HG23  VAL  88          HG22      VAL  88   8.052   7.641   6.200
  634    H    LEU  89           HN       LEU  89   8.719   5.213   2.781
  635    HA   LEU  89           HA       LEU  89   9.581   2.573   2.545
  636    HG   LEU  89           HG       LEU  89   6.990   4.019   2.095
  637    HB2  LEU  89           HB2      LEU  89   8.767   4.521   0.389
  638    HB3  LEU  89           HB1      LEU  89   8.946   2.793   0.151
  639   HD11  LEU  89          HD11      LEU  89   6.425   4.687  -0.175
  640   HD12  LEU  89          HD12      LEU  89   5.271   3.501   0.436
  641   HD13  LEU  89          HD13      LEU  89   6.522   3.009  -0.707
  642   HD21  LEU  89          HD23      LEU  89   7.647   1.733   2.625
  643   HD22  LEU  89          HD21      LEU  89   7.258   1.228   0.981
  644   HD23  LEU  89          HD22      LEU  89   5.979   1.791   2.057
  645    H    ARG  90           HN       ARG  90  11.256   5.521   1.907
  646    HA   ARG  90           HA       ARG  90  13.244   4.230   0.222
  647    HE   ARG  90           HE       ARG  90  12.086   8.806   0.302
  648    HB2  ARG  90           HB2      ARG  90  12.894   7.058   1.198
  649    HB3  ARG  90           HB1      ARG  90  14.343   6.535   0.353
  650    HG2  ARG  90           HG2      ARG  90  12.911   5.834  -1.551
  651    HG3  ARG  90           HG1      ARG  90  11.528   6.534  -0.709
  652    HD2  ARG  90           HD2      ARG  90  14.007   8.000  -1.608
  653    HD3  ARG  90           HD1      ARG  90  12.411   8.095  -2.351
  654   HH11  ARG  90          HH11      ARG  90  13.846   9.983  -2.468
  655   HH12  ARG  90          HH12      ARG  90  13.803  11.636  -1.951
  656   HH21  ARG  90          HH21      ARG  90  12.027  10.978   0.987
  657   HH22  ARG  90          HH22      ARG  90  12.772  12.201   0.014
  658    H    ASN  91           HN       ASN  91  12.755   4.985   3.543
  659    HA   ASN  91           HA       ASN  91  15.570   4.809   4.221
  660    HB2  ASN  91           HB2      ASN  91  13.102   5.063   5.952
  661    HB3  ASN  91           HB1      ASN  91  14.751   5.035   6.571
  662   HD21  ASN  91          HD21      ASN  91  12.702   7.114   6.724
  663   HD22  ASN  91          HD22      ASN  91  13.409   8.527   6.024
  664    H    ALA  92           HN       ALA  92  12.961   2.680   3.777
  665    HA   ALA  92           HA       ALA  92  13.435   0.675   5.648
  666    HB1  ALA  92           HB3      ALA  92  12.459   0.402   2.808
  667    HB2  ALA  92           HB1      ALA  92  11.467   0.680   4.238
  668    HB3  ALA  92           HB2      ALA  92  12.337  -0.843   4.050
  669    H    GLY  93           HN       GLY  93  14.156  -0.122   2.292
  670    HA2  GLY  93           HA2      GLY  93  15.955  -1.171   1.324
  671    HA3  GLY  93           HA1      GLY  93  16.951  -0.331   2.501
  672    H    ASN  94           HN       ASN  94  14.453  -2.388   3.679
  673    HA   ASN  94           HA       ASN  94  16.232  -4.675   3.981
  674    HB2  ASN  94           HB2      ASN  94  15.276  -2.931   6.228
  675    HB3  ASN  94           HB1      ASN  94  15.525  -4.650   6.511
  676   HD21  ASN  94          HD21      ASN  94  17.705  -4.852   4.615
  677   HD22  ASN  94          HD22      ASN  94  19.068  -4.096   5.352
  678    HA   PRO  95           HA       PRO  95  12.578  -7.202   3.860
  679    HB2  PRO  95           HB2      PRO  95  13.031  -8.226   6.610
  680    HB3  PRO  95           HB1      PRO  95  12.867  -9.115   5.093
  681    HG2  PRO  95           HG2      PRO  95  15.244  -8.844   6.264
  682    HG3  PRO  95           HG1      PRO  95  15.081  -8.774   4.500
  683    HD2  PRO  95           HD2      PRO  95  15.454  -6.549   6.462
  684    HD3  PRO  95           HD1      PRO  95  16.146  -6.749   4.840
  685    H    VAL  96           HN       VAL  96  11.116  -5.435   3.940
  686    HA   VAL  96           HA       VAL  96   9.966  -4.829   6.575
  687    HB   VAL  96           HB       VAL  96   8.900  -2.892   5.444
  688   HG11  VAL  96          HG11      VAL  96  11.898  -3.028   5.144
  689   HG12  VAL  96          HG12      VAL  96  11.029  -2.653   6.631
  690   HG13  VAL  96          HG13      VAL  96  10.929  -1.559   5.253
  691   HG21  VAL  96          HG23      VAL  96  10.574  -3.771   3.093
  692   HG22  VAL  96          HG21      VAL  96   9.696  -2.246   3.211
  693   HG23  VAL  96          HG22      VAL  96   8.812  -3.771   3.182
  694    H    ARG  97           HN       ARG  97   7.702  -4.745   6.850
  695    HA   ARG  97           HA       ARG  97   6.258  -6.654   5.169
  696    HE   ARG  97           HE       ARG  97   4.064  -5.434   9.111
  697    HB2  ARG  97           HB2      ARG  97   6.324  -7.125   7.577
  698    HB3  ARG  97           HB1      ARG  97   5.608  -5.556   7.914
  699    HG2  ARG  97           HG2      ARG  97   3.585  -6.251   6.684
  700    HG3  ARG  97           HG1      ARG  97   4.304  -7.847   6.458
  701    HD2  ARG  97           HD2      ARG  97   2.737  -7.797   8.350
  702    HD3  ARG  97           HD1      ARG  97   4.381  -8.182   8.859
  703   HH11  ARG  97          HH11      ARG  97   2.713  -8.337  10.486
  704   HH12  ARG  97          HH12      ARG  97   2.362  -7.602  12.015
  705   HH21  ARG  97          HH21      ARG  97   3.607  -4.460  11.118
  706   HH22  ARG  97          HH22      ARG  97   2.870  -5.398  12.375
  707    H    LEU  98           HN       LEU  98   4.270  -6.163   4.247
  708    HA   LEU  98           HA       LEU  98   3.551  -3.304   4.234
  709    HG   LEU  98           HG       LEU  98   5.637  -4.708   2.305
  710    HB2  LEU  98           HB2      LEU  98   3.229  -5.254   1.957
  711    HB3  LEU  98           HB1      LEU  98   2.881  -3.536   1.922
  712   HD11  LEU  98          HD11      LEU  98   4.756  -5.222   0.086
  713   HD12  LEU  98          HD12      LEU  98   6.051  -4.030   0.000
  714   HD13  LEU  98          HD13      LEU  98   4.371  -3.518  -0.161
  715   HD21  LEU  98          HD23      LEU  98   6.397  -2.431   1.863
  716   HD22  LEU  98          HD21      LEU  98   5.357  -2.488   3.286
  717   HD23  LEU  98          HD22      LEU  98   4.723  -1.887   1.754
  718    H    LEU  99           HN       LEU  99   1.771  -3.149   5.473
  719    HA   LEU  99           HA       LEU  99  -0.313  -5.199   5.236
  720    HG   LEU  99           HG       LEU  99  -2.391  -4.090   7.007
  721    HB2  LEU  99           HB2      LEU  99   0.567  -4.464   7.492
  722    HB3  LEU  99           HB1      LEU  99  -0.189  -2.910   7.196
  723   HD11  LEU  99          HD11      LEU  99  -0.789  -6.437   8.010
  724   HD12  LEU  99          HD12      LEU  99  -1.585  -6.308   6.443
  725   HD13  LEU  99          HD13      LEU  99  -2.548  -6.362   7.919
  726   HD21  LEU  99          HD23      LEU  99  -1.817  -2.968   9.052
  727   HD22  LEU  99          HD21      LEU  99  -0.859  -4.348   9.589
  728   HD23  LEU  99          HD22      LEU  99  -2.610  -4.494   9.442
  729    H    LEU 100           HN       LEU 100  -1.693  -4.792   3.616
  730    HA   LEU 100           HA       LEU 100  -2.861  -2.103   3.461
  731    HG   LEU 100           HG       LEU 100  -0.377  -4.037   1.814
  732    HB2  LEU 100           HB2      LEU 100  -2.902  -2.673   0.873
  733    HB3  LEU 100           HB1      LEU 100  -1.557  -1.840   1.625
  734   HD11  LEU 100          HD11      LEU 100  -2.582  -5.024   0.013
  735   HD12  LEU 100          HD12      LEU 100  -2.393  -5.456   1.713
  736   HD13  LEU 100          HD13      LEU 100  -1.160  -5.925   0.542
  737   HD21  LEU 100          HD23      LEU 100  -1.178  -3.126  -0.945
  738   HD22  LEU 100          HD21      LEU 100   0.195  -4.171  -0.580
  739   HD23  LEU 100          HD22      LEU 100   0.164  -2.514   0.020
  740    H    ILE 101           HN       ILE 101  -4.902  -2.048   2.223
  741    HA   ILE 101           HA       ILE 101  -6.359  -4.600   2.439
  742    HB   ILE 101           HB       ILE 101  -7.080  -3.065   4.188
  743   HG12  ILE 101          HG12      ILE 101  -9.167  -3.227   2.003
  744   HG13  ILE 101          HG11      ILE 101  -8.735  -4.561   3.067
  745   HG21  ILE 101          HG21      ILE 101  -6.450  -0.968   3.125
  746   HG22  ILE 101          HG22      ILE 101  -8.134  -0.924   3.648
  747   HG23  ILE 101          HG23      ILE 101  -7.745  -1.164   1.944
  748   HD11  ILE 101          HD13      ILE 101 -10.773  -3.466   3.798
  749   HD12  ILE 101          HD11      ILE 101  -9.916  -1.930   3.927
  750   HD13  ILE 101          HD12      ILE 101  -9.490  -3.270   4.992
  751    H    ARG 102           HN       ARG 102  -7.724  -5.163   0.794
  752    HA   ARG 102           HA       ARG 102  -8.062  -3.287  -1.434
  753    HE   ARG 102           HE       ARG 102  -7.780  -4.571  -6.049
  754    HB2  ARG 102           HB2      ARG 102  -6.160  -4.696  -2.023
  755    HB3  ARG 102           HB1      ARG 102  -7.102  -6.143  -1.689
  756    HG2  ARG 102           HG2      ARG 102  -6.958  -5.790  -4.064
  757    HG3  ARG 102           HG1      ARG 102  -8.623  -5.552  -3.530
  758    HD2  ARG 102           HD2      ARG 102  -8.297  -3.136  -3.559
  759    HD3  ARG 102           HD1      ARG 102  -6.618  -3.359  -4.050
  760   HH11  ARG 102          HH11      ARG 102  -8.833  -1.669  -4.433
  761   HH12  ARG 102          HH12      ARG 102  -9.594  -1.007  -5.841
  762   HH21  ARG 102          HH21      ARG 102  -8.781  -3.708  -7.907
  763   HH22  ARG 102          HH22      ARG 102  -9.565  -2.166  -7.816
  764    H    ARG 103           HN       ARG 103 -10.032  -3.347  -2.377
  765    HA   ARG 103           HA       ARG 103 -12.033  -5.063  -1.158
  766    HE   ARG 103           HE       ARG 103 -13.640  -2.232  -4.444
  767    HB2  ARG 103           HB2      ARG 103 -12.496  -2.663  -1.461
  768    HB3  ARG 103           HB1      ARG 103 -12.332  -2.854  -3.201
  769    HG2  ARG 103           HG2      ARG 103 -14.238  -4.465  -3.126
  770    HG3  ARG 103           HG1      ARG 103 -14.455  -4.034  -1.428
  771    HD2  ARG 103           HD2      ARG 103 -15.971  -2.766  -2.858
  772    HD3  ARG 103           HD1      ARG 103 -14.812  -1.705  -2.059
  773   HH11  ARG 103          HH11      ARG 103 -16.791  -1.052  -3.525
  774   HH12  ARG 103          HH12      ARG 103 -16.996  -0.110  -4.963
  775   HH21  ARG 103          HH21      ARG 103 -13.907  -0.992  -6.337
  776   HH22  ARG 103          HH22      ARG 103 -15.359  -0.074  -6.560
  777    H    LEU 104           HN       LEU 104 -13.235  -6.602  -2.205
  778    HA   LEU 104           HA       LEU 104 -12.054  -7.717  -4.592
  779    HG   LEU 104           HG       LEU 104 -12.118  -8.767  -1.830
  780    HB2  LEU 104           HB2      LEU 104 -14.411  -8.622  -2.935
  781    HB3  LEU 104           HB1      LEU 104 -13.715  -9.526  -4.267
  782   HD11  LEU 104          HD11      LEU 104 -13.678 -11.297  -2.330
  783   HD12  LEU 104          HD12      LEU 104 -14.006 -10.093  -1.084
  784   HD13  LEU 104          HD13      LEU 104 -12.523 -11.046  -1.020
  785   HD21  LEU 104          HD23      LEU 104 -11.733 -10.901  -3.925
  786   HD22  LEU 104          HD21      LEU 104 -10.655 -10.556  -2.572
  787   HD23  LEU 104          HD22      LEU 104 -10.866  -9.366  -3.857
  788    HA   PRO 105           HA       PRO 105 -14.983  -5.934  -7.410
  789    HB2  PRO 105           HB2      PRO 105 -14.631  -7.485  -9.549
  790    HB3  PRO 105           HB1      PRO 105 -13.309  -6.470  -8.951
  791    HG2  PRO 105           HG2      PRO 105 -13.821  -9.384  -8.445
  792    HG3  PRO 105           HG1      PRO 105 -12.313  -8.601  -8.963
  793    HD2  PRO 105           HD2      PRO 105 -12.813  -9.257  -6.377
  794    HD3  PRO 105           HD1      PRO 105 -11.834  -7.846  -6.833
  795    H    LEU 106           HN       LEU 106 -16.470  -7.108  -5.637
  796    HA   LEU 106           HA       LEU 106 -18.043  -9.248  -6.832
  797    HG   LEU 106           HG       LEU 106 -16.220  -9.194  -4.284
  798    HB2  LEU 106           HB2      LEU 106 -18.327  -7.895  -4.147
  799    HB3  LEU 106           HB1      LEU 106 -19.213  -9.313  -4.680
  800   HD11  LEU 106          HD11      LEU 106 -18.372 -10.428  -2.572
  801   HD12  LEU 106          HD12      LEU 106 -17.402  -9.012  -2.168
  802   HD13  LEU 106          HD13      LEU 106 -16.635 -10.593  -2.322
  803   HD21  LEU 106          HD23      LEU 106 -16.892 -10.806  -5.988
  804   HD22  LEU 106          HD21      LEU 106 -18.055 -11.516  -4.870
  805   HD23  LEU 106          HD22      LEU 106 -16.328 -11.624  -4.532
  806    H    LEU 107           HN       LEU 107 -19.755  -8.838  -8.042
  807    HA   LEU 107           HA       LEU 107 -20.883  -6.173  -8.130
  808    HG   LEU 107           HG       LEU 107 -20.684  -7.373 -11.653
  809    HB2  LEU 107           HB2      LEU 107 -21.373  -8.683  -9.718
  810    HB3  LEU 107           HB1      LEU 107 -22.371  -7.255  -9.907
  811   HD11  LEU 107          HD11      LEU 107 -19.817  -5.140 -11.454
  812   HD12  LEU 107          HD12      LEU 107 -20.064  -5.161  -9.708
  813   HD13  LEU 107          HD13      LEU 107 -21.452  -5.193 -10.794
  814   HD21  LEU 107          HD23      LEU 107 -18.650  -7.191  -9.433
  815   HD22  LEU 107          HD21      LEU 107 -18.317  -7.181 -11.165
  816   HD23  LEU 107          HD22      LEU 107 -18.979  -8.627 -10.401
  817    H    GLU 108           HN       GLU 108 -22.957  -5.589  -7.577
  818    HA   GLU 108           HA       GLU 108 -24.152  -6.932  -5.412
  819    HB2  GLU 108           HB2      GLU 108 -24.391  -4.522  -5.766
  820    HB3  GLU 108           HB1      GLU 108 -25.309  -4.816  -7.237
  821    HG2  GLU 108           HG2      GLU 108 -26.786  -4.226  -5.422
  822    HG3  GLU 108           HG1      GLU 108 -27.067  -5.893  -5.921
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1  -9.063  -3.506  19.724
    2    H2   GLY   1           HT2      GLY   1 -10.147  -3.897  20.960
    3    H3   GLY   1           HT3      GLY   1 -10.457  -2.574  19.953
    4    HA2  GLY   1           HA1      GLY   1 -10.406  -5.423  19.117
    5    HA3  GLY   1           HA2      GLY   1 -11.852  -4.455  19.354
    6    H    SER   2           HN       SER   2  -8.987  -4.891  17.367
    7    HA   SER   2           HA       SER   2 -10.434  -3.709  15.117
    8    HG   SER   2           HG       SER   2 -10.025  -1.847  16.433
    9    HB2  SER   2           HB2      SER   2  -7.615  -2.929  15.903
   10    HB3  SER   2           HB1      SER   2  -8.419  -2.452  14.409
   11    H    HIS   3           HN       HIS   3  -8.962  -3.999  13.058
   12    HA   HIS   3           HA       HIS   3  -8.172  -5.481  11.529
   13    HD1  HIS   3           HD1      HIS   3  -5.367  -4.281  14.622
   14    HD2  HIS   3           HD2      HIS   3  -5.571  -4.643  10.487
   15    HE1  HIS   3           HE1      HIS   3  -3.999  -2.378  13.712
   16    HE2  HIS   3           HE2      HIS   3  -4.190  -2.578  11.208
   17    HB2  HIS   3           HB2      HIS   3  -6.541  -6.357  13.920
   18    HB3  HIS   3           HB1      HIS   3  -6.243  -6.894  12.270
   19    H    GLY   4           HN       GLY   4  -9.993  -6.655  11.045
   20    HA2  GLY   4           HA2      GLY   4  -9.943  -9.420  11.568
   21    HA3  GLY   4           HA1      GLY   4 -11.129  -8.672  12.628
   22    H    TYR   5           HN       TYR   5 -10.307  -7.765   9.306
   23    HA   TYR   5           HA       TYR   5 -13.121  -8.150   8.588
   24    HD1  TYR   5           HD1      TYR   5 -14.388  -5.667   7.953
   25    HD2  TYR   5           HD2      TYR   5 -10.270  -5.121   8.872
   26    HE1  TYR   5           HE1      TYR   5 -14.958  -3.697   9.310
   27    HE2  TYR   5           HE2      TYR   5 -10.829  -3.150  10.232
   28    HH   TYR   5           HH       TYR   5 -14.002  -2.397  11.165
   29    HB2  TYR   5           HB2      TYR   5 -10.917  -6.644   7.163
   30    HB3  TYR   5           HB1      TYR   5 -12.587  -6.748   6.617
   31    H    SER   6           HN       SER   6 -12.114 -10.547   8.773
   32    HA   SER   6           HA       SER   6 -10.713 -11.516   6.501
   33    HG   SER   6           HG       SER   6 -11.549 -14.822   7.714
   34    HB2  SER   6           HB2      SER   6 -10.695 -12.737   8.619
   35    HB3  SER   6           HB1      SER   6 -12.436 -12.991   8.508
   36    H    ASP   7           HN       ASP   7 -11.693 -10.935   4.601
   37    HA   ASP   7           HA       ASP   7 -13.152 -10.990   2.857
   38    HB2  ASP   7           HB2      ASP   7 -12.765 -13.412   3.044
   39    HB3  ASP   7           HB1      ASP   7 -14.081 -13.537   4.207
   40    H    ALA   8           HN       ALA   8 -14.262  -9.105   3.525
   41    HA   ALA   8           HA       ALA   8 -16.989  -9.646   4.480
   42    HB1  ALA   8           HB3      ALA   8 -16.935  -7.563   5.788
   43    HB2  ALA   8           HB1      ALA   8 -15.231  -7.366   5.379
   44    HB3  ALA   8           HB2      ALA   8 -15.751  -8.740   6.357
   45    H    SER   9           HN       SER   9 -18.051  -9.386   2.595
   46    HA   SER   9           HA       SER   9 -18.997  -8.378   0.795
   47    HG   SER   9           HG       SER   9 -20.154  -6.362   0.242
   48    HB2  SER   9           HB2      SER   9 -19.677  -6.726   2.500
   49    HB3  SER   9           HB1      SER   9 -18.187  -5.829   2.216
   50    H    GLY  10           HN       GLY  10 -15.990  -8.864   0.921
   51    HA2  GLY  10           HA2      GLY  10 -14.697  -8.842  -1.122
   52    HA3  GLY  10           HA1      GLY  10 -15.367  -7.257  -1.472
   53    H    PHE  11           HN       PHE  11 -14.951  -6.339   1.311
   54    HA   PHE  11           HA       PHE  11 -12.252  -5.420   0.960
   55    HD1  PHE  11           HD2      PHE  11 -11.814  -2.713   1.530
   56    HD2  PHE  11           HD1      PHE  11 -15.919  -3.835   1.614
   57    HE1  PHE  11           HE2      PHE  11 -12.372  -0.755   0.151
   58    HE2  PHE  11           HE1      PHE  11 -16.484  -1.876   0.234
   59    HZ   PHE  11           HZ       PHE  11 -14.711  -0.334  -0.499
   60    HB2  PHE  11           HB2      PHE  11 -14.375  -4.904   3.033
   61    HB3  PHE  11           HB1      PHE  11 -12.735  -4.294   3.226
   62    H    SER  12           HN       SER  12 -10.817  -7.058   1.226
   63    HA   SER  12           HA       SER  12 -10.775  -8.368   3.865
   64    HG   SER  12           HG       SER  12  -9.886 -11.159   3.282
   65    HB2  SER  12           HB2      SER  12 -11.159  -9.995   2.093
   66    HB3  SER  12           HB1      SER  12  -9.753  -9.403   1.208
   67    H    LEU  13           HN       LEU  13  -8.816  -8.514   4.958
   68    HA   LEU  13           HA       LEU  13  -6.895  -6.462   4.268
   69    HG   LEU  13           HG       LEU  13  -8.891  -6.760   6.604
   70    HB2  LEU  13           HB2      LEU  13  -6.960  -8.354   6.621
   71    HB3  LEU  13           HB1      LEU  13  -5.887  -6.979   6.440
   72   HD11  LEU  13          HD11      LEU  13  -7.972  -7.625   8.694
   73   HD12  LEU  13          HD12      LEU  13  -8.534  -5.964   8.885
   74   HD13  LEU  13          HD13      LEU  13  -6.809  -6.299   8.737
   75   HD21  LEU  13          HD23      LEU  13  -6.672  -4.723   6.669
   76   HD22  LEU  13          HD21      LEU  13  -8.359  -4.375   7.053
   77   HD23  LEU  13          HD22      LEU  13  -7.915  -4.906   5.431
   78    H    TYR  14           HN       TYR  14  -5.103  -6.797   3.157
   79    HA   TYR  14           HA       TYR  14  -4.033  -9.538   2.998
   80    HD1  TYR  14           HD1      TYR  14  -6.520  -7.451   0.757
   81    HD2  TYR  14           HD2      TYR  14  -4.117 -10.934   0.281
   82    HE1  TYR  14           HE1      TYR  14  -8.435  -8.633  -0.228
   83    HE2  TYR  14           HE2      TYR  14  -6.029 -12.123  -0.707
   84    HH   TYR  14           HH       TYR  14  -8.529 -11.962  -0.641
   85    HB2  TYR  14           HB2      TYR  14  -4.071  -7.343   0.925
   86    HB3  TYR  14           HB1      TYR  14  -3.096  -8.800   0.769
   87    H    SER  15           HN       SER  15  -1.777  -9.821   3.008
   88    HA   SER  15           HA       SER  15  -0.083  -7.511   3.501
   89    HG   SER  15           HG       SER  15  -0.013 -10.224   6.506
   90    HB2  SER  15           HB2      SER  15   0.823  -8.437   5.601
   91    HB3  SER  15           HB1      SER  15  -0.897  -8.073   5.744
   92    H    VAL  16           HN       VAL  16   1.859  -7.770   2.604
   93    HA   VAL  16           HA       VAL  16   2.769 -10.509   1.994
   94    HB   VAL  16           HB       VAL  16   3.241  -8.118   0.212
   95   HG11  VAL  16          HG11      VAL  16   3.862  -9.852  -1.438
   96   HG12  VAL  16          HG12      VAL  16   3.673 -11.076  -0.183
   97   HG13  VAL  16          HG13      VAL  16   4.918  -9.835  -0.026
   98   HG21  VAL  16          HG23      VAL  16   1.552  -9.066  -1.285
   99   HG22  VAL  16          HG21      VAL  16   0.857  -8.618   0.272
  100   HG23  VAL  16          HG22      VAL  16   1.192 -10.310  -0.090
  101    H    GLU  17           HN       GLU  17   5.068 -10.805   1.911
  102    HA   GLU  17           HA       GLU  17   6.482  -8.894   3.628
  103    HB2  GLU  17           HB2      GLU  17   7.127 -11.766   2.951
  104    HB3  GLU  17           HB1      GLU  17   8.079 -10.743   4.019
  105    HG2  GLU  17           HG2      GLU  17   6.138 -10.526   5.508
  106    HG3  GLU  17           HG1      GLU  17   5.231 -11.610   4.454
  107    H    LEU  18           HN       LEU  18   7.807  -7.515   2.710
  108    HA   LEU  18           HA       LEU  18   9.166  -8.281   0.212
  109    HG   LEU  18           HG       LEU  18   7.324  -5.381  -1.118
  110    HB2  LEU  18           HB2      LEU  18   8.014  -5.704   1.172
  111    HB3  LEU  18           HB1      LEU  18   9.428  -5.643   0.137
  112   HD11  LEU  18          HD11      LEU  18   9.277  -6.307  -2.233
  113   HD12  LEU  18          HD12      LEU  18   7.796  -7.036  -2.853
  114   HD13  LEU  18          HD13      LEU  18   8.813  -7.930  -1.724
  115   HD21  LEU  18          HD23      LEU  18   6.758  -8.220  -0.272
  116   HD22  LEU  18          HD21      LEU  18   5.796  -7.244  -1.382
  117   HD23  LEU  18          HD22      LEU  18   5.910  -6.792   0.319
  118    H    PHE  19           HN       PHE  19  11.315  -7.137  -0.091
  119    HA   PHE  19           HA       PHE  19  12.703  -6.372   2.318
  120    HD1  PHE  19           HD2      PHE  19  11.526  -9.957   0.767
  121    HD2  PHE  19           HD1      PHE  19  15.567  -8.754   0.181
  122    HE1  PHE  19           HE2      PHE  19  11.703 -11.494  -1.145
  123    HE2  PHE  19           HE1      PHE  19  15.750 -10.289  -1.733
  124    HZ   PHE  19           HZ       PHE  19  13.826 -11.663  -2.397
  125    HB2  PHE  19           HB2      PHE  19  14.415  -8.149   2.162
  126    HB3  PHE  19           HB1      PHE  19  12.819  -8.794   2.530
  127    H    ARG  20           HN       ARG  20  14.416  -5.064   1.907
  128    HA   ARG  20           HA       ARG  20  15.398  -4.964  -0.871
  129    HE   ARG  20           HE       ARG  20  14.438  -0.534   0.532
  130    HB2  ARG  20           HB2      ARG  20  13.821  -3.103  -0.467
  131    HB3  ARG  20           HB1      ARG  20  14.825  -2.561   0.871
  132    HG2  ARG  20           HG2      ARG  20  16.593  -1.956  -0.569
  133    HG3  ARG  20           HG1      ARG  20  15.871  -2.810  -1.933
  134    HD2  ARG  20           HD2      ARG  20  15.575  -0.400  -2.149
  135    HD3  ARG  20           HD1      ARG  20  14.024  -1.217  -1.962
  136   HH11  ARG  20          HH11      ARG  20  15.090   1.329  -2.339
  137   HH12  ARG  20          HH12      ARG  20  14.840   2.855  -1.559
  138   HH21  ARG  20          HH21      ARG  20  14.102   1.471   1.563
  139   HH22  ARG  20          HH22      ARG  20  14.279   2.937   0.658
  140    H    GLU  21           HN       GLU  21  17.543  -4.191  -1.147
  141    HA   GLU  21           HA       GLU  21  19.191  -3.708   1.167
  142    HB2  GLU  21           HB2      GLU  21  19.096  -6.160   1.146
  143    HB3  GLU  21           HB1      GLU  21  19.653  -6.169  -0.522
  144    HG2  GLU  21           HG2      GLU  21  21.776  -5.218   0.153
  145    HG3  GLU  21           HG1      GLU  21  21.220  -5.116   1.823
  146    H    LYS  22           HN       LYS  22  18.894  -4.166  -2.282
  147    HA   LYS  22           HA       LYS  22  21.411  -3.253  -3.092
  148    HB2  LYS  22           HB2      LYS  22  18.740  -3.030  -4.493
  149    HB3  LYS  22           HB1      LYS  22  20.293  -2.724  -5.256
  150    HG2  LYS  22           HG2      LYS  22  19.439  -5.350  -4.055
  151    HG3  LYS  22           HG1      LYS  22  19.408  -4.951  -5.773
  152    HD2  LYS  22           HD2      LYS  22  21.858  -4.557  -5.671
  153    HD3  LYS  22           HD1      LYS  22  21.840  -5.106  -3.994
  154    HE2  LYS  22           HE2      LYS  22  22.523  -6.906  -5.480
  155    HE3  LYS  22           HE1      LYS  22  20.978  -7.279  -4.716
  156    HZ1  LYS  22           HZ3      LYS  22  21.334  -6.228  -7.473
  157    HZ2  LYS  22           HZ1      LYS  22  19.852  -6.594  -6.741
  158    HZ3  LYS  22           HZ2      LYS  22  20.961  -7.828  -7.068
  159    H    ASP  23           HN       ASP  23  21.845  -1.179  -4.245
  160    HA   ASP  23           HA       ASP  23  20.898   1.039  -2.601
  161    HB2  ASP  23           HB2      ASP  23  23.148   0.910  -4.621
  162    HB3  ASP  23           HB1      ASP  23  22.768   2.300  -3.608
  163    H    THR  24           HN       THR  24  19.117  -0.085  -4.562
  164    HA   THR  24           HA       THR  24  19.069   1.670  -6.840
  165    HB   THR  24           HB       THR  24  16.897   0.612  -7.356
  166    HG1  THR  24           HG1      THR  24  16.869   0.095  -4.775
  167   HG21  THR  24          HG23      THR  24  19.065  -1.341  -6.585
  168   HG22  THR  24          HG21      THR  24  18.960  -0.460  -8.108
  169   HG23  THR  24          HG22      THR  24  17.740  -1.666  -7.701
  170    H    SER  25           HN       SER  25  18.086   1.899  -3.631
  171    HA   SER  25           HA       SER  25  16.767   3.310  -2.437
  172    HG   SER  25           HG       SER  25  18.306   5.344  -5.371
  173    HB2  SER  25           HB2      SER  25  16.853   5.658  -3.113
  174    HB3  SER  25           HB1      SER  25  18.429   4.898  -3.331
  175    H    SER  26           HN       SER  26  15.455   1.658  -4.572
  176    HA   SER  26           HA       SER  26  12.906   3.093  -4.527
  177    HG   SER  26           HG       SER  26  11.816   3.355  -7.246
  178    HB2  SER  26           HB2      SER  26  13.843   3.566  -6.737
  179    HB3  SER  26           HB1      SER  26  14.082   1.841  -7.020
  180    H    LEU  27           HN       LEU  27  11.188   1.821  -4.107
  181    HA   LEU  27           HA       LEU  27  11.700  -1.056  -3.817
  182    HG   LEU  27           HG       LEU  27  12.020   0.212  -1.368
  183    HB2  LEU  27           HB2      LEU  27   9.863   0.869  -2.458
  184    HB3  LEU  27           HB1      LEU  27   9.428  -0.828  -2.512
  185   HD11  LEU  27          HD11      LEU  27   9.481  -0.612   0.034
  186   HD12  LEU  27          HD12      LEU  27  10.149   1.018  -0.047
  187   HD13  LEU  27          HD13      LEU  27  11.017  -0.249   0.821
  188   HD21  LEU  27          HD23      LEU  27  12.147  -2.086  -2.152
  189   HD22  LEU  27          HD21      LEU  27  10.691  -2.494  -1.243
  190   HD23  LEU  27          HD22      LEU  27  12.165  -2.035  -0.389
  191    H    GLY  28           HN       GLY  28   9.904   1.245  -5.620
  192    HA2  GLY  28           HA2      GLY  28   8.863   0.680  -7.678
  193    HA3  GLY  28           HA1      GLY  28   8.608  -0.949  -7.072
  194    H    ILE  29           HN       ILE  29   7.840   1.382  -4.764
  195    HA   ILE  29           HA       ILE  29   4.992   0.890  -5.176
  196    HB   ILE  29           HB       ILE  29   6.391   2.215  -2.848
  197   HG12  ILE  29          HG12      ILE  29   5.274  -0.589  -3.082
  198   HG13  ILE  29          HG11      ILE  29   6.984  -0.184  -3.171
  199   HG21  ILE  29          HG21      ILE  29   4.270   1.885  -1.668
  200   HG22  ILE  29          HG22      ILE  29   3.553   1.232  -3.141
  201   HG23  ILE  29          HG23      ILE  29   4.068   2.918  -3.083
  202   HD11  ILE  29          HD13      ILE  29   5.179   0.232  -0.799
  203   HD12  ILE  29          HD11      ILE  29   6.881   0.684  -0.881
  204   HD13  ILE  29          HD12      ILE  29   6.414  -1.014  -0.974
  205    H    SER  30           HN       SER  30   3.968   2.294  -6.456
  206    HA   SER  30           HA       SER  30   4.684   5.145  -6.254
  207    HG   SER  30           HG       SER  30   4.076   6.379  -8.164
  208    HB2  SER  30           HB2      SER  30   5.063   4.216  -8.491
  209    HB3  SER  30           HB1      SER  30   3.388   3.665  -8.557
  210    H    ILE  31           HN       ILE  31   3.290   6.267  -5.073
  211    HA   ILE  31           HA       ILE  31   0.497   5.381  -4.916
  212    HB   ILE  31           HB       ILE  31   0.309   6.909  -2.986
  213   HG12  ILE  31          HG12      ILE  31   3.300   7.266  -3.258
  214   HG13  ILE  31          HG11      ILE  31   2.125   8.468  -3.778
  215   HG21  ILE  31          HG21      ILE  31   1.696   5.589  -1.446
  216   HG22  ILE  31          HG22      ILE  31   2.571   4.922  -2.824
  217   HG23  ILE  31          HG23      ILE  31   0.853   4.577  -2.619
  218   HD11  ILE  31          HD13      ILE  31   3.083   8.969  -1.582
  219   HD12  ILE  31          HD11      ILE  31   2.433   7.451  -0.964
  220   HD13  ILE  31          HD12      ILE  31   1.337   8.722  -1.508
  221    H    SER  32           HN       SER  32  -1.017   7.381  -4.459
  222    HA   SER  32           HA       SER  32  -0.418   9.731  -6.013
  223    HG   SER  32           HG       SER  32  -0.732   8.724  -8.755
  224    HB2  SER  32           HB2      SER  32  -2.566   7.816  -6.955
  225    HB3  SER  32           HB1      SER  32  -2.316   9.445  -7.581
  226    H    GLY  33           HN       GLY  33  -1.503  11.443  -5.230
  227    HA2  GLY  33           HA2      GLY  33  -3.349  10.986  -3.040
  228    HA3  GLY  33           HA1      GLY  33  -2.690  12.535  -3.545
  229    H    MET  34           HN       MET  34  -5.471  10.860  -3.274
  230    HA   MET  34           HA       MET  34  -6.775  11.455  -5.730
  231    HB2  MET  34           HB2      MET  34  -7.576   9.697  -4.215
  232    HB3  MET  34           HB1      MET  34  -7.949  10.910  -2.996
  233    HG2  MET  34           HG2      MET  34  -9.644  11.872  -4.409
  234    HG3  MET  34           HG1      MET  34  -9.216  10.777  -5.723
  235    HE1  MET  34           HE3      MET  34 -11.122   9.404  -1.750
  236    HE2  MET  34           HE1      MET  34 -10.817  11.096  -2.147
  237    HE3  MET  34           HE2      MET  34  -9.465   9.995  -1.878
  238    H    ARG  35           HN       ARG  35  -7.971  13.203  -6.343
  239    HA   ARG  35           HA       ARG  35  -7.649  15.610  -4.740
  240    HE   ARG  35           HE       ARG  35  -7.784  14.382  -8.990
  241    HB2  ARG  35           HB2      ARG  35  -8.671  15.173  -7.548
  242    HB3  ARG  35           HB1      ARG  35  -8.614  16.746  -6.766
  243    HG2  ARG  35           HG2      ARG  35  -6.693  16.654  -8.094
  244    HG3  ARG  35           HG1      ARG  35  -6.126  16.331  -6.454
  245    HD2  ARG  35           HD2      ARG  35  -5.103  14.822  -8.096
  246    HD3  ARG  35           HD1      ARG  35  -6.079  13.949  -6.916
  247   HH11  ARG  35          HH11      ARG  35  -4.626  12.936  -8.704
  248   HH12  ARG  35          HH12      ARG  35  -4.877  11.826 -10.011
  249   HH21  ARG  35          HH21      ARG  35  -8.120  12.928 -10.709
  250   HH22  ARG  35          HH22      ARG  35  -6.862  11.823 -11.151
  251    H    ASP  36           HN       ASP  36  -9.273  16.770  -3.826
  252    HA   ASP  36           HA       ASP  36 -12.041  15.942  -4.256
  253    HB2  ASP  36           HB2      ASP  36 -10.781  16.090  -1.509
  254    HB3  ASP  36           HB1      ASP  36 -12.481  15.783  -1.846
  255    H    GLN  37           HN       GLN  37 -12.963  17.785  -4.890
  256    HA   GLN  37           HA       GLN  37 -12.159  20.301  -3.613
  257    HB2  GLN  37           HB2      GLN  37 -13.305  21.403  -5.490
  258    HB3  GLN  37           HB1      GLN  37 -12.063  20.290  -6.048
  259    HG2  GLN  37           HG2      GLN  37 -13.768  18.626  -6.554
  260    HG3  GLN  37           HG1      GLN  37 -15.019  19.724  -5.972
  261   HE21  GLN  37          HE21      GLN  37 -15.555  21.537  -7.193
  262   HE22  GLN  37          HE22      GLN  37 -15.112  21.686  -8.855
  263    H    SER  38           HN       SER  38 -14.119  18.073  -2.718
  264    HA   SER  38           HA       SER  38 -16.223  19.935  -1.870
  265    HG   SER  38           HG       SER  38 -17.401  19.671  -3.916
  266    HB2  SER  38           HB2      SER  38 -16.699  17.122  -2.889
  267    HB3  SER  38           HB1      SER  38 -17.927  18.173  -2.183
  268    H    THR  39           HN       THR  39 -16.514  19.919   0.261
  269    HA   THR  39           HA       THR  39 -15.228  17.812   1.831
  270    HB   THR  39           HB       THR  39 -15.483  19.304   3.749
  271    HG1  THR  39           HG1      THR  39 -16.714  21.059   3.666
  272   HG21  THR  39          HG23      THR  39 -14.394  20.741   1.324
  273   HG22  THR  39          HG21      THR  39 -13.513  19.583   2.321
  274   HG23  THR  39          HG22      THR  39 -14.023  21.126   3.004
  275    H    THR  40           HN       THR  40 -16.311  16.427   3.131
  276    HA   THR  40           HA       THR  40 -19.036  16.853   3.923
  277    HB   THR  40           HB       THR  40 -19.442  16.087   1.640
  278    HG1  THR  40           HG1      THR  40 -21.052  15.283   2.809
  279   HG21  THR  40          HG23      THR  40 -17.369  14.835   1.286
  280   HG22  THR  40          HG21      THR  40 -18.779  13.835   0.931
  281   HG23  THR  40          HG22      THR  40 -17.901  13.615   2.444
  282    H    GLY  41           HN       GLY  41 -16.096  15.793   4.578
  283    HA2  GLY  41           HA2      GLY  41 -16.178  14.782   6.952
  284    HA3  GLY  41           HA1      GLY  41 -16.937  13.433   6.122
  285    H    GLU  42           HN       GLU  42 -15.690  12.267   4.538
  286    HA   GLU  42           HA       GLU  42 -13.072  11.701   5.407
  287    HB2  GLU  42           HB2      GLU  42 -14.496  10.970   2.844
  288    HB3  GLU  42           HB1      GLU  42 -12.945  10.304   3.336
  289    HG2  GLU  42           HG2      GLU  42 -15.516  10.033   4.878
  290    HG3  GLU  42           HG1      GLU  42 -14.824   8.803   3.821
  291    H    ALA  43           HN       ALA  43 -11.121  11.770   4.015
  292    HA   ALA  43           HA       ALA  43 -11.052  14.068   2.204
  293    HB1  ALA  43           HB3      ALA  43 -10.335  14.734   4.516
  294    HB2  ALA  43           HB1      ALA  43  -9.130  15.004   3.258
  295    HB3  ALA  43           HB2      ALA  43  -8.978  13.621   4.343
  296    H    THR  44           HN       THR  44  -8.232  13.986   1.905
  297    HA   THR  44           HA       THR  44  -7.955  12.106  -0.144
  298    HB   THR  44           HB       THR  44  -5.571  12.663  -0.156
  299    HG1  THR  44           HG1      THR  44  -5.849  12.985   2.393
  300   HG21  THR  44          HG23      THR  44  -7.142  14.236  -1.182
  301   HG22  THR  44          HG21      THR  44  -5.767  15.084  -0.476
  302   HG23  THR  44          HG22      THR  44  -7.319  15.072   0.360
  303    H    GLY  45           HN       GLY  45  -5.928  10.579  -0.143
  304    HA2  GLY  45           HA2      GLY  45  -5.417   9.209   2.339
  305    HA3  GLY  45           HA1      GLY  45  -6.465   8.308   1.253
  306    H    ILE  46           HN       ILE  46  -3.933   7.418   2.116
  307    HA   ILE  46           HA       ILE  46  -2.200   7.765  -0.222
  308    HB   ILE  46           HB       ILE  46  -1.612   6.344   2.378
  309   HG12  ILE  46          HG12      ILE  46  -1.978   8.750   2.721
  310   HG13  ILE  46          HG11      ILE  46  -0.285   8.328   2.956
  311   HG21  ILE  46          HG21      ILE  46   0.732   6.484   1.642
  312   HG22  ILE  46          HG22      ILE  46   0.193   7.160   0.105
  313   HG23  ILE  46          HG23      ILE  46  -0.258   5.515   0.551
  314   HD11  ILE  46          HD13      ILE  46  -0.507  10.413   1.743
  315   HD12  ILE  46          HD11      ILE  46  -1.468   9.609   0.502
  316   HD13  ILE  46          HD12      ILE  46   0.228   9.178   0.720
  317    H    TYR  47           HN       TYR  47  -2.704   6.425  -1.838
  318    HA   TYR  47           HA       TYR  47  -2.864   3.560  -1.248
  319    HD1  TYR  47           HD1      TYR  47  -5.427   6.742  -1.702
  320    HD2  TYR  47           HD2      TYR  47  -4.746   4.210  -5.053
  321    HE1  TYR  47           HE1      TYR  47  -6.180   8.536  -3.204
  322    HE2  TYR  47           HE2      TYR  47  -5.494   5.997  -6.563
  323    HH   TYR  47           HH       TYR  47  -5.917   9.211  -5.540
  324    HB2  TYR  47           HB2      TYR  47  -4.743   3.304  -2.833
  325    HB3  TYR  47           HB1      TYR  47  -5.176   4.294  -1.445
  326    H    VAL  48           HN       VAL  48  -1.881   2.258  -2.727
  327    HA   VAL  48           HA       VAL  48  -0.128   3.484  -4.629
  328    HB   VAL  48           HB       VAL  48  -0.754   0.562  -4.175
  329   HG11  VAL  48          HG11      VAL  48   1.338   0.125  -5.380
  330   HG12  VAL  48          HG12      VAL  48   1.488   1.848  -5.729
  331   HG13  VAL  48          HG13      VAL  48   0.146   0.925  -6.405
  332   HG21  VAL  48          HG23      VAL  48   1.575   2.224  -3.223
  333   HG22  VAL  48          HG21      VAL  48   1.317   0.507  -2.914
  334   HG23  VAL  48          HG22      VAL  48   0.218   1.703  -2.226
  335    H    LYS  49           HN       LYS  49  -0.622   4.059  -6.629
  336    HA   LYS  49           HA       LYS  49  -3.013   2.924  -7.886
  337    HB2  LYS  49           HB2      LYS  49  -2.850   5.383  -7.683
  338    HB3  LYS  49           HB1      LYS  49  -1.393   5.354  -8.665
  339    HG2  LYS  49           HG2      LYS  49  -2.673   4.471 -10.548
  340    HG3  LYS  49           HG1      LYS  49  -4.135   4.491  -9.561
  341    HD2  LYS  49           HD2      LYS  49  -2.482   6.946 -10.128
  342    HD3  LYS  49           HD1      LYS  49  -3.852   6.448 -11.123
  343    HE2  LYS  49           HE2      LYS  49  -5.342   6.632  -9.225
  344    HE3  LYS  49           HE1      LYS  49  -3.988   7.009  -8.162
  345    HZ1  LYS  49           HZ3      LYS  49  -5.197   8.997  -8.808
  346    HZ2  LYS  49           HZ1      LYS  49  -4.904   8.676 -10.443
  347    HZ3  LYS  49           HZ2      LYS  49  -3.617   9.041  -9.409
  348    H    SER  50           HN       SER  50   0.432   2.940  -8.122
  349    HA   SER  50           HA       SER  50   0.310   1.045 -10.301
  350    HG   SER  50           HG       SER  50   1.370   4.717 -10.561
  351    HB2  SER  50           HB2      SER  50   1.839   2.301 -11.769
  352    HB3  SER  50           HB1      SER  50   0.322   3.167 -11.526
  353    H    LEU  51           HN       LEU  51   2.567   0.316 -10.921
  354    HA   LEU  51           HA       LEU  51   4.390   0.422  -8.613
  355    HG   LEU  51           HG       LEU  51   1.977  -1.487  -8.497
  356    HB2  LEU  51           HB2      LEU  51   3.672  -2.018 -10.244
  357    HB3  LEU  51           HB1      LEU  51   4.915  -1.964  -9.010
  358   HD11  LEU  51          HD11      LEU  51   2.390  -3.789  -9.182
  359   HD12  LEU  51          HD12      LEU  51   1.991  -3.699  -7.467
  360   HD13  LEU  51          HD13      LEU  51   3.665  -3.929  -7.972
  361   HD21  LEU  51          HD23      LEU  51   2.622  -1.733  -6.140
  362   HD22  LEU  51          HD21      LEU  51   3.414  -0.352  -6.900
  363   HD23  LEU  51          HD22      LEU  51   4.315  -1.843  -6.624
  364    H    ILE  52           HN       ILE  52   6.616  -0.475  -9.259
  365    HA   ILE  52           HA       ILE  52   7.304   0.631 -11.899
  366    HB   ILE  52           HB       ILE  52   9.117   0.281  -9.511
  367   HG12  ILE  52          HG12      ILE  52   7.405   1.979  -9.075
  368   HG13  ILE  52          HG11      ILE  52   8.984   2.727  -9.281
  369   HG21  ILE  52          HG21      ILE  52  10.661   1.711 -10.788
  370   HG22  ILE  52          HG22      ILE  52   9.541   1.679 -12.150
  371   HG23  ILE  52          HG23      ILE  52  10.319   0.189 -11.611
  372   HD11  ILE  52          HD13      ILE  52   7.268   4.024 -10.383
  373   HD12  ILE  52          HD11      ILE  52   6.787   2.619 -11.334
  374   HD13  ILE  52          HD12      ILE  52   8.378   3.343 -11.572
  375    HA   PRO  53           HA       PRO  53   7.923  -3.839 -12.715
  376    HB2  PRO  53           HB2      PRO  53   8.550  -2.636 -15.366
  377    HB3  PRO  53           HB1      PRO  53   7.511  -4.009 -14.970
  378    HG2  PRO  53           HG2      PRO  53   6.453  -1.661 -15.634
  379    HG3  PRO  53           HG1      PRO  53   5.730  -2.654 -14.354
  380    HD2  PRO  53           HD2      PRO  53   7.421  -0.201 -14.127
  381    HD3  PRO  53           HD1      PRO  53   6.031  -0.711 -13.147
  382    H    GLY  54           HN       GLY  54   9.810  -4.501 -11.852
  383    HA2  GLY  54           HA2      GLY  54  12.093  -5.107 -12.694
  384    HA3  GLY  54           HA1      GLY  54  12.301  -3.387 -12.988
  385    H    SER  55           HN       SER  55  10.508  -3.669 -10.235
  386    HA   SER  55           HA       SER  55  12.914  -3.483  -8.547
  387    HG   SER  55           HG       SER  55  11.308  -2.462  -6.119
  388    HB2  SER  55           HB2      SER  55  11.542  -1.403  -8.726
  389    HB3  SER  55           HB1      SER  55  10.189  -2.279  -8.011
  390    H    ALA  56           HN       ALA  56  12.040  -3.803  -6.078
  391    HA   ALA  56           HA       ALA  56  11.652  -6.562  -5.800
  392    HB1  ALA  56           HB3      ALA  56  11.132  -4.402  -3.761
  393    HB2  ALA  56           HB1      ALA  56  12.691  -5.164  -4.079
  394    HB3  ALA  56           HB2      ALA  56  11.358  -6.118  -3.425
  395    H    ALA  57           HN       ALA  57   9.353  -3.901  -5.213
  396    HA   ALA  57           HA       ALA  57   7.136  -5.398  -4.508
  397    HB1  ALA  57           HB3      ALA  57   7.254  -2.955  -4.341
  398    HB2  ALA  57           HB1      ALA  57   5.794  -3.486  -5.176
  399    HB3  ALA  57           HB2      ALA  57   7.150  -2.835  -6.097
  400    H    ALA  58           HN       ALA  58   8.171  -4.387  -7.755
  401    HA   ALA  58           HA       ALA  58   5.996  -5.520  -9.148
  402    HB1  ALA  58           HB3      ALA  58   8.785  -4.961 -10.152
  403    HB2  ALA  58           HB1      ALA  58   7.456  -3.802 -10.108
  404    HB3  ALA  58           HB2      ALA  58   7.351  -5.224 -11.147
  405    H    LEU  59           HN       LEU  59   9.132  -6.810  -8.186
  406    HA   LEU  59           HA       LEU  59   8.864  -9.246  -9.658
  407    HG   LEU  59           HG       LEU  59  11.157  -7.426  -9.682
  408    HB2  LEU  59           HB2      LEU  59  10.693  -8.401  -7.419
  409    HB3  LEU  59           HB1      LEU  59  10.761  -9.994  -8.145
  410   HD11  LEU  59          HD11      LEU  59  13.198  -9.341  -8.559
  411   HD12  LEU  59          HD12      LEU  59  12.930  -7.675  -8.048
  412   HD13  LEU  59          HD13      LEU  59  13.543  -8.013  -9.667
  413   HD21  LEU  59          HD23      LEU  59  11.679 -10.309 -10.401
  414   HD22  LEU  59          HD21      LEU  59  12.071  -8.911 -11.402
  415   HD23  LEU  59          HD22      LEU  59  10.387  -9.296 -11.044
  416    H    ASP  60           HN       ASP  60   7.658  -8.093  -6.674
  417    HA   ASP  60           HA       ASP  60   7.406 -10.542  -5.284
  418    HB2  ASP  60           HB2      ASP  60   7.247  -8.384  -4.145
  419    HB3  ASP  60           HB1      ASP  60   5.782  -8.001  -5.040
  420    H    GLY  61           HN       GLY  61   5.043  -8.676  -7.199
  421    HA2  GLY  61           HA2      GLY  61   3.464  -9.583  -8.679
  422    HA3  GLY  61           HA1      GLY  61   3.786 -11.175  -8.014
  423    H    ARG  62           HN       ARG  62   3.340 -10.703  -5.308
  424    HA   ARG  62           HA       ARG  62   0.562 -10.994  -5.144
  425    HE   ARG  62           HE       ARG  62   0.133 -12.671  -2.206
  426    HB2  ARG  62           HB2      ARG  62   2.439 -10.185  -2.918
  427    HB3  ARG  62           HB1      ARG  62   0.848 -10.905  -2.732
  428    HG2  ARG  62           HG2      ARG  62   3.174 -12.258  -4.079
  429    HG3  ARG  62           HG1      ARG  62   2.716 -12.492  -2.390
  430    HD2  ARG  62           HD2      ARG  62   0.983 -13.071  -4.791
  431    HD3  ARG  62           HD1      ARG  62   1.834 -14.273  -3.820
  432   HH11  ARG  62          HH11      ARG  62   0.104 -15.300  -4.494
  433   HH12  ARG  62          HH12      ARG  62  -1.347 -16.003  -3.863
  434   HH21  ARG  62          HH21      ARG  62  -1.774 -13.593  -1.366
  435   HH22  ARG  62          HH22      ARG  62  -2.416 -15.032  -2.086
  436    H    ILE  63           HN       ILE  63   2.520  -8.160  -5.222
  437    HA   ILE  63           HA       ILE  63   0.535  -6.436  -4.022
  438    HB   ILE  63           HB       ILE  63   3.003  -5.652  -5.576
  439   HG12  ILE  63          HG12      ILE  63   2.651  -5.971  -2.586
  440   HG13  ILE  63          HG11      ILE  63   3.512  -7.105  -3.622
  441   HG21  ILE  63          HG21      ILE  63   1.352  -3.868  -5.354
  442   HG22  ILE  63          HG22      ILE  63   2.784  -3.527  -4.381
  443   HG23  ILE  63          HG23      ILE  63   1.312  -4.114  -3.607
  444   HD11  ILE  63          HD13      ILE  63   5.073  -5.270  -4.221
  445   HD12  ILE  63          HD11      ILE  63   5.103  -5.715  -2.515
  446   HD13  ILE  63          HD12      ILE  63   4.260  -4.255  -3.030
  447    H    GLU  64           HN       GLU  64  -1.274  -6.019  -5.108
  448    HA   GLU  64           HA       GLU  64  -1.174  -5.767  -8.028
  449    HB2  GLU  64           HB2      GLU  64  -2.811  -7.351  -7.089
  450    HB3  GLU  64           HB1      GLU  64  -3.551  -6.043  -6.177
  451    HG2  GLU  64           HG2      GLU  64  -4.184  -4.937  -8.251
  452    HG3  GLU  64           HG1      GLU  64  -3.417  -6.226  -9.178
  453    HA   PRO  65           HA       PRO  65  -1.362  -1.332  -7.775
  454    HB2  PRO  65           HB2      PRO  65  -2.951  -1.544 -10.276
  455    HB3  PRO  65           HB1      PRO  65  -1.476  -0.628  -9.954
  456    HG2  PRO  65           HG2      PRO  65  -1.403  -2.857 -11.411
  457    HG3  PRO  65           HG1      PRO  65  -0.106  -2.474 -10.263
  458    HD2  PRO  65           HD2      PRO  65  -2.363  -4.418  -9.994
  459    HD3  PRO  65           HD1      PRO  65  -0.673  -4.571  -9.471
  460    H    ASN  66           HN       ASN  66  -3.015   0.444  -7.957
  461    HA   ASN  66           HA       ASN  66  -4.935   1.411  -7.235
  462    HB2  ASN  66           HB2      ASN  66  -6.138  -1.130  -8.348
  463    HB3  ASN  66           HB1      ASN  66  -7.073   0.275  -7.844
  464   HD21  ASN  66          HD21      ASN  66  -6.830  -0.991 -10.466
  465   HD22  ASN  66          HD22      ASN  66  -6.283   0.244 -11.542
  466    H    ASP  67           HN       ASP  67  -3.399  -0.377  -5.437
  467    HA   ASP  67           HA       ASP  67  -5.473  -1.418  -3.659
  468    HB2  ASP  67           HB2      ASP  67  -3.633  -2.417  -2.399
  469    HB3  ASP  67           HB1      ASP  67  -3.497  -2.826  -4.106
  470    H    LYS  68           HN       LYS  68  -5.416  -0.882  -1.351
  471    HA   LYS  68           HA       LYS  68  -4.616   1.921  -0.956
  472    HB2  LYS  68           HB2      LYS  68  -7.033   1.449  -0.757
  473    HB3  LYS  68           HB1      LYS  68  -6.693   0.307   0.535
  474    HG2  LYS  68           HG2      LYS  68  -5.827   2.095   1.924
  475    HG3  LYS  68           HG1      LYS  68  -6.084   3.255   0.619
  476    HD2  LYS  68           HD2      LYS  68  -8.501   2.763   0.700
  477    HD3  LYS  68           HD1      LYS  68  -8.213   1.673   2.058
  478    HE2  LYS  68           HE2      LYS  68  -7.342   3.526   3.375
  479    HE3  LYS  68           HE1      LYS  68  -7.581   4.620   2.013
  480    HZ1  LYS  68           HZ3      LYS  68  -9.731   3.153   3.444
  481    HZ2  LYS  68           HZ1      LYS  68  -9.957   4.214   2.145
  482    HZ3  LYS  68           HZ2      LYS  68  -9.374   4.796   3.622
  483    H    ILE  69           HN       ILE  69  -3.007   2.349   0.394
  484    HA   ILE  69           HA       ILE  69  -1.879   0.214   2.009
  485    HB   ILE  69           HB       ILE  69  -0.914   3.057   1.658
  486   HG12  ILE  69          HG12      ILE  69  -0.927   1.844  -0.474
  487   HG13  ILE  69          HG11      ILE  69   0.721   2.111   0.084
  488   HG21  ILE  69          HG21      ILE  69   0.467   0.625   2.783
  489   HG22  ILE  69          HG22      ILE  69  -0.079   2.032   3.694
  490   HG23  ILE  69          HG23      ILE  69   1.219   2.197   2.510
  491   HD11  ILE  69          HD13      ILE  69   0.816  -0.197   0.881
  492   HD12  ILE  69          HD11      ILE  69   0.457  -0.112  -0.844
  493   HD13  ILE  69          HD12      ILE  69  -0.832  -0.457   0.309
  494    H    LEU  70           HN       LEU  70  -1.793   0.155   4.213
  495    HA   LEU  70           HA       LEU  70  -3.345   2.217   5.638
  496    HG   LEU  70           HG       LEU  70  -4.530  -0.423   4.447
  497    HB2  LEU  70           HB2      LEU  70  -2.988  -0.688   6.380
  498    HB3  LEU  70           HB1      LEU  70  -3.939   0.490   7.263
  499   HD11  LEU  70          HD11      LEU  70  -6.386  -1.659   5.437
  500   HD12  LEU  70          HD12      LEU  70  -5.849  -1.186   7.049
  501   HD13  LEU  70          HD13      LEU  70  -4.837  -2.233   6.054
  502   HD21  LEU  70          HD23      LEU  70  -6.664   0.715   4.786
  503   HD22  LEU  70          HD21      LEU  70  -5.311   1.837   4.924
  504   HD23  LEU  70          HD22      LEU  70  -6.126   1.257   6.376
  505    H    ARG  71           HN       ARG  71  -0.883  -0.280   6.315
  506    HA   ARG  71           HA       ARG  71   0.733   1.735   7.674
  507    HE   ARG  71           HE       ARG  71  -3.156   1.383  11.077
  508    HB2  ARG  71           HB2      ARG  71  -0.119  -0.845   9.002
  509    HB3  ARG  71           HB1      ARG  71   1.023   0.317   9.662
  510    HG2  ARG  71           HG2      ARG  71  -0.737   1.996   9.791
  511    HG3  ARG  71           HG1      ARG  71  -1.887   0.851   9.098
  512    HD2  ARG  71           HD2      ARG  71  -1.454  -0.657  11.027
  513    HD3  ARG  71           HD1      ARG  71  -0.443   0.603  11.734
  514   HH11  ARG  71          HH11      ARG  71  -0.947   0.225  13.509
  515   HH12  ARG  71          HH12      ARG  71  -1.946   0.720  14.835
  516   HH21  ARG  71          HH21      ARG  71  -4.477   2.036  12.815
  517   HH22  ARG  71          HH22      ARG  71  -3.953   1.747  14.440
  518    H    VAL  72           HN       VAL  72   2.883   1.395   7.524
  519    HA   VAL  72           HA       VAL  72   3.760  -0.869   5.897
  520    HB   VAL  72           HB       VAL  72   5.486   1.429   6.814
  521   HG11  VAL  72          HG11      VAL  72   6.663   0.950   4.675
  522   HG12  VAL  72          HG12      VAL  72   5.607  -0.446   4.457
  523   HG13  VAL  72          HG13      VAL  72   6.712  -0.382   5.830
  524   HG21  VAL  72          HG23      VAL  72   4.899   2.626   4.777
  525   HG22  VAL  72          HG21      VAL  72   3.473   2.369   5.783
  526   HG23  VAL  72          HG22      VAL  72   3.738   1.367   4.356
  527    H    ASP  73           HN       ASP  73   6.071  -1.690   6.550
  528    HA   ASP  73           HA       ASP  73   5.953  -3.164   8.844
  529    HB2  ASP  73           HB2      ASP  73   7.632  -3.387   6.987
  530    HB3  ASP  73           HB1      ASP  73   8.520  -2.049   7.706
  531    H    ASP  74           HN       ASP  74   5.568  -2.438  10.841
  532    HA   ASP  74           HA       ASP  74   5.713  -1.271  12.787
  533    HB2  ASP  74           HB2      ASP  74   8.571  -0.906  11.864
  534    HB3  ASP  74           HB1      ASP  74   7.990  -0.620  13.501
  535    H    VAL  75           HN       VAL  75   4.924   0.181  10.372
  536    HA   VAL  75           HA       VAL  75   5.276   2.887  11.404
  537    HB   VAL  75           HB       VAL  75   5.836   2.162   8.519
  538   HG11  VAL  75          HG11      VAL  75   4.632   4.261   8.646
  539   HG12  VAL  75          HG12      VAL  75   6.319   4.559   8.225
  540   HG13  VAL  75          HG13      VAL  75   5.754   4.858   9.868
  541   HG21  VAL  75          HG23      VAL  75   8.080   3.053   8.967
  542   HG22  VAL  75          HG21      VAL  75   7.713   1.652   9.973
  543   HG23  VAL  75          HG22      VAL  75   7.644   3.274  10.662
  544    H    ASN  76           HN       ASN  76   3.606   4.330  10.776
  545    HA   ASN  76           HA       ASN  76   1.282   3.027   9.511
  546    HB2  ASN  76           HB2      ASN  76  -0.119   4.547  10.952
  547    HB3  ASN  76           HB1      ASN  76   0.771   3.309  11.834
  548   HD21  ASN  76          HD21      ASN  76   0.513   6.698  11.118
  549   HD22  ASN  76          HD22      ASN  76   1.549   7.251  12.385
  550    H    VAL  77           HN       VAL  77   0.438   4.021   7.774
  551    HA   VAL  77           HA       VAL  77   1.453   6.712   7.139
  552    HB   VAL  77           HB       VAL  77   0.915   6.226   4.797
  553   HG11  VAL  77          HG11      VAL  77   2.629   4.121   6.109
  554   HG12  VAL  77          HG12      VAL  77   3.148   5.730   5.610
  555   HG13  VAL  77          HG13      VAL  77   2.658   4.547   4.398
  556   HG21  VAL  77          HG23      VAL  77   0.192   3.463   5.770
  557   HG22  VAL  77          HG21      VAL  77   0.247   3.999   4.092
  558   HG23  VAL  77          HG22      VAL  77  -0.951   4.677   5.195
  559    H    GLN  78           HN       GLN  78  -0.915   5.961   8.835
  560    HA   GLN  78           HA       GLN  78  -3.110   7.050   7.239
  561    HB2  GLN  78           HB2      GLN  78  -3.116   5.906  10.039
  562    HB3  GLN  78           HB1      GLN  78  -4.539   6.421   9.142
  563    HG2  GLN  78           HG2      GLN  78  -2.688   4.170   8.392
  564    HG3  GLN  78           HG1      GLN  78  -4.299   4.010   9.093
  565   HE21  GLN  78          HE21      GLN  78  -6.103   4.432   7.823
  566   HE22  GLN  78          HE22      GLN  78  -6.015   4.525   6.100
  567    H    GLY  79           HN       GLY  79  -0.991   8.809   7.857
  568    HA2  GLY  79           HA2      GLY  79  -2.376  11.048   8.780
  569    HA3  GLY  79           HA1      GLY  79  -1.493  10.388  10.148
  570    H    MET  80           HN       MET  80  -0.262  10.144   6.886
  571    HA   MET  80           HA       MET  80   1.636  12.320   7.443
  572    HB2  MET  80           HB2      MET  80   2.348   9.600   6.333
  573    HB3  MET  80           HB1      MET  80   3.456  10.957   6.486
  574    HG2  MET  80           HG2      MET  80   3.020  10.912   8.953
  575    HG3  MET  80           HG1      MET  80   2.139   9.407   8.697
  576    HE1  MET  80           HE3      MET  80   4.999   7.121   7.217
  577    HE2  MET  80           HE1      MET  80   3.942   8.183   6.286
  578    HE3  MET  80           HE2      MET  80   3.282   7.225   7.610
  579    H    ALA  81           HN       ALA  81   2.262  13.539   5.708
  580    HA   ALA  81           HA       ALA  81   0.550  13.561   3.443
  581    HB1  ALA  81           HB3      ALA  81   3.138  15.046   3.881
  582    HB2  ALA  81           HB1      ALA  81   1.537  15.603   4.367
  583    HB3  ALA  81           HB2      ALA  81   1.922  15.412   2.657
  584    H    GLN  82           HN       GLN  82   1.315  13.508   1.185
  585    HA   GLN  82           HA       GLN  82   2.297  11.089   0.401
  586    HB2  GLN  82           HB2      GLN  82   1.219  12.599  -1.155
  587    HB3  GLN  82           HB1      GLN  82   2.556  13.735  -1.034
  588    HG2  GLN  82           HG2      GLN  82   4.043  12.019  -2.021
  589    HG3  GLN  82           HG1      GLN  82   2.637  10.976  -2.235
  590   HE21  GLN  82          HE21      GLN  82   1.094  11.508  -3.783
  591   HE22  GLN  82          HE22      GLN  82   1.413  12.646  -5.043
  592    H    SER  83           HN       SER  83   4.233  14.085   0.481
  593    HA   SER  83           HA       SER  83   6.675  13.046  -0.241
  594    HG   SER  83           HG       SER  83   6.317  15.181  -1.041
  595    HB2  SER  83           HB2      SER  83   6.149  15.243   1.773
  596    HB3  SER  83           HB1      SER  83   7.684  14.952   0.957
  597    H    ASP  84           HN       ASP  84   5.247  13.164   3.002
  598    HA   ASP  84           HA       ASP  84   7.481  12.151   4.381
  599    HB2  ASP  84           HB2      ASP  84   4.541  12.038   5.074
  600    HB3  ASP  84           HB1      ASP  84   5.841  11.610   6.182
  601    H    VAL  85           HN       VAL  85   4.675  10.521   2.943
  602    HA   VAL  85           HA       VAL  85   5.210   7.940   3.885
  603    HB   VAL  85           HB       VAL  85   3.945   8.634   1.230
  604   HG11  VAL  85          HG11      VAL  85   2.786   6.500   1.490
  605   HG12  VAL  85          HG12      VAL  85   3.653   6.208   2.998
  606   HG13  VAL  85          HG13      VAL  85   4.535   6.277   1.473
  607   HG21  VAL  85          HG23      VAL  85   2.681   8.377   3.957
  608   HG22  VAL  85          HG21      VAL  85   1.803   8.550   2.438
  609   HG23  VAL  85          HG22      VAL  85   2.838   9.856   3.011
  610    H    VAL  86           HN       VAL  86   6.401   9.667   1.049
  611    HA   VAL  86           HA       VAL  86   7.720   7.472  -0.155
  612    HB   VAL  86           HB       VAL  86   8.389  10.410  -0.404
  613   HG11  VAL  86          HG11      VAL  86   9.020   8.078  -2.213
  614   HG12  VAL  86          HG12      VAL  86  10.174   8.967  -1.218
  615   HG13  VAL  86          HG13      VAL  86   9.363   9.772  -2.562
  616   HG21  VAL  86          HG23      VAL  86   6.556   8.703  -2.085
  617   HG22  VAL  86          HG21      VAL  86   6.961  10.394  -2.377
  618   HG23  VAL  86          HG22      VAL  86   6.044   9.941  -0.939
  619    H    GLU  87           HN       GLU  87   8.701   9.860   2.241
  620    HA   GLU  87           HA       GLU  87  11.454   9.343   2.257
  621    HB2  GLU  87           HB2      GLU  87   9.623  10.274   4.471
  622    HB3  GLU  87           HB1      GLU  87  11.375  10.240   4.604
  623    HG2  GLU  87           HG2      GLU  87  11.551  11.805   2.738
  624    HG3  GLU  87           HG1      GLU  87   9.794  11.838   2.600
  625    H    VAL  88           HN       VAL  88   8.853   7.948   4.239
  626    HA   VAL  88           HA       VAL  88  10.393   6.233   5.796
  627    HB   VAL  88           HB       VAL  88   7.557   5.932   4.812
  628   HG11  VAL  88          HG11      VAL  88   8.400   3.724   5.333
  629   HG12  VAL  88          HG12      VAL  88   7.284   4.248   6.596
  630   HG13  VAL  88          HG13      VAL  88   9.024   4.298   6.882
  631   HG21  VAL  88          HG23      VAL  88   8.710   6.819   7.456
  632   HG22  VAL  88          HG21      VAL  88   6.993   6.621   7.105
  633   HG23  VAL  88          HG22      VAL  88   7.930   7.849   6.255
  634    H    LEU  89           HN       LEU  89   8.680   5.494   2.762
  635    HA   LEU  89           HA       LEU  89   9.449   2.853   2.497
  636    HG   LEU  89           HG       LEU  89   7.051   4.686   1.754
  637    HB2  LEU  89           HB2      LEU  89   9.049   4.870   0.286
  638    HB3  LEU  89           HB1      LEU  89   9.033   3.128   0.091
  639   HD11  LEU  89          HD11      LEU  89   5.465   4.221  -0.036
  640   HD12  LEU  89          HD12      LEU  89   6.742   3.457  -0.982
  641   HD13  LEU  89          HD13      LEU  89   6.820   5.183  -0.627
  642   HD21  LEU  89          HD23      LEU  89   7.398   2.395   2.531
  643   HD22  LEU  89          HD21      LEU  89   7.092   1.792   0.902
  644   HD23  LEU  89          HD22      LEU  89   5.803   2.589   1.805
  645    H    ARG  90           HN       ARG  90  11.246   5.774   1.782
  646    HA   ARG  90           HA       ARG  90  13.363   4.377   0.408
  647    HE   ARG  90           HE       ARG  90  12.232   8.951   0.480
  648    HB2  ARG  90           HB2      ARG  90  13.070   7.230   1.351
  649    HB3  ARG  90           HB1      ARG  90  14.511   6.629   0.543
  650    HG2  ARG  90           HG2      ARG  90  13.140   6.034  -1.412
  651    HG3  ARG  90           HG1      ARG  90  11.727   6.710  -0.600
  652    HD2  ARG  90           HD2      ARG  90  14.239   8.227  -1.299
  653    HD3  ARG  90           HD1      ARG  90  12.729   8.282  -2.208
  654   HH11  ARG  90          HH11      ARG  90  13.750  10.234  -2.384
  655   HH12  ARG  90          HH12      ARG  90  13.494  11.886  -1.934
  656   HH21  ARG  90          HH21      ARG  90  11.894  11.124   1.080
  657   HH22  ARG  90          HH22      ARG  90  12.441  12.393   0.035
  658    H    ASN  91           HN       ASN  91  12.616   5.280   3.656
  659    HA   ASN  91           HA       ASN  91  15.312   5.107   4.641
  660    HB2  ASN  91           HB2      ASN  91  12.660   5.133   6.097
  661    HB3  ASN  91           HB1      ASN  91  14.235   5.215   6.882
  662   HD21  ASN  91          HD21      ASN  91  12.020   7.121   6.878
  663   HD22  ASN  91          HD22      ASN  91  12.673   8.606   6.286
  664    H    ALA  92           HN       ALA  92  12.841   2.886   3.878
  665    HA   ALA  92           HA       ALA  92  13.303   0.832   5.716
  666    HB1  ALA  92           HB3      ALA  92  11.380   0.882   4.206
  667    HB2  ALA  92           HB1      ALA  92  12.252  -0.646   4.093
  668    HB3  ALA  92           HB2      ALA  92  12.447   0.576   2.837
  669    H    GLY  93           HN       GLY  93  14.122   0.131   2.368
  670    HA2  GLY  93           HA2      GLY  93  15.972  -0.856   1.427
  671    HA3  GLY  93           HA1      GLY  93  16.917   0.037   2.610
  672    H    ASN  94           HN       ASN  94  14.496  -2.122   3.763
  673    HA   ASN  94           HA       ASN  94  16.372  -4.323   4.126
  674    HB2  ASN  94           HB2      ASN  94  15.833  -2.392   6.168
  675    HB3  ASN  94           HB1      ASN  94  15.112  -3.922   6.653
  676   HD21  ASN  94          HD21      ASN  94  17.884  -3.879   4.579
  677   HD22  ASN  94          HD22      ASN  94  19.023  -4.437   5.748
  678    HA   PRO  95           HA       PRO  95  12.822  -7.001   3.954
  679    HB2  PRO  95           HB2      PRO  95  13.217  -7.948   6.740
  680    HB3  PRO  95           HB1      PRO  95  13.135  -8.875   5.238
  681    HG2  PRO  95           HG2      PRO  95  15.462  -8.497   6.481
  682    HG3  PRO  95           HG1      PRO  95  15.356  -8.468   4.709
  683    HD2  PRO  95           HD2      PRO  95  15.586  -6.189   6.633
  684    HD3  PRO  95           HD1      PRO  95  16.336  -6.400   5.037
  685    H    VAL  96           HN       VAL  96  11.169  -5.477   3.920
  686    HA   VAL  96           HA       VAL  96   9.937  -4.844   6.521
  687    HB   VAL  96           HB       VAL  96   8.906  -2.891   5.399
  688   HG11  VAL  96          HG11      VAL  96  10.949  -2.601   6.674
  689   HG12  VAL  96          HG12      VAL  96  10.958  -1.540   5.265
  690   HG13  VAL  96          HG13      VAL  96  11.916  -3.020   5.260
  691   HG21  VAL  96          HG23      VAL  96   9.746  -2.172   3.216
  692   HG22  VAL  96          HG21      VAL  96   8.931  -3.732   3.108
  693   HG23  VAL  96          HG22      VAL  96  10.693  -3.655   3.090
  694    H    ARG  97           HN       ARG  97   7.676  -4.870   6.697
  695    HA   ARG  97           HA       ARG  97   6.348  -6.687   4.823
  696    HE   ARG  97           HE       ARG  97   2.093  -8.480   6.958
  697    HB2  ARG  97           HB2      ARG  97   6.378  -7.414   7.155
  698    HB3  ARG  97           HB1      ARG  97   5.645  -5.898   7.658
  699    HG2  ARG  97           HG2      ARG  97   3.621  -6.465   6.405
  700    HG3  ARG  97           HG1      ARG  97   4.358  -7.993   5.918
  701    HD2  ARG  97           HD2      ARG  97   4.491  -8.700   8.231
  702    HD3  ARG  97           HD1      ARG  97   3.857  -7.145   8.769
  703   HH11  ARG  97          HH11      ARG  97   3.128  -8.313  10.282
  704   HH12  ARG  97          HH12      ARG  97   1.640  -8.934  10.911
  705   HH21  ARG  97          HH21      ARG  97   0.128  -9.303   7.781
  706   HH22  ARG  97          HH22      ARG  97  -0.064  -9.495   9.492
  707    H    LEU  98           HN       LEU  98   4.359  -6.170   3.921
  708    HA   LEU  98           HA       LEU  98   3.620  -3.325   4.100
  709    HG   LEU  98           HG       LEU  98   5.504  -5.027   1.984
  710    HB2  LEU  98           HB2      LEU  98   3.042  -5.118   1.763
  711    HB3  LEU  98           HB1      LEU  98   2.985  -3.368   1.826
  712   HD11  LEU  98          HD11      LEU  98   4.466  -5.141  -0.221
  713   HD12  LEU  98          HD12      LEU  98   5.948  -4.186  -0.264
  714   HD13  LEU  98          HD13      LEU  98   4.380  -3.381  -0.279
  715   HD21  LEU  98          HD23      LEU  98   5.739  -2.935   3.178
  716   HD22  LEU  98          HD21      LEU  98   5.073  -2.046   1.808
  717   HD23  LEU  98          HD22      LEU  98   6.632  -2.858   1.658
  718    H    LEU  99           HN       LEU  99   1.777  -3.010   5.150
  719    HA   LEU  99           HA       LEU  99  -0.285  -5.104   5.086
  720    HG   LEU  99           HG       LEU  99  -2.294  -3.350   6.768
  721    HB2  LEU  99           HB2      LEU  99   0.453  -4.477   7.317
  722    HB3  LEU  99           HB1      LEU  99   0.127  -2.790   6.983
  723   HD11  LEU  99          HD11      LEU  99  -1.402  -6.040   7.799
  724   HD12  LEU  99          HD12      LEU  99  -2.072  -5.707   6.202
  725   HD13  LEU  99          HD13      LEU  99  -3.073  -5.498   7.639
  726   HD21  LEU  99          HD23      LEU  99  -0.995  -4.077   9.391
  727   HD22  LEU  99          HD21      LEU  99  -2.677  -3.594   9.169
  728   HD23  LEU  99          HD22      LEU  99  -1.379  -2.446   8.842
  729    H    LEU 100           HN       LEU 100  -1.484  -4.717   3.298
  730    HA   LEU 100           HA       LEU 100  -2.778  -2.081   3.120
  731    HG   LEU 100           HG       LEU 100  -0.285  -4.078   1.471
  732    HB2  LEU 100           HB2      LEU 100  -2.781  -2.646   0.554
  733    HB3  LEU 100           HB1      LEU 100  -1.412  -1.856   1.308
  734   HD11  LEU 100          HD11      LEU 100  -2.606  -4.988  -0.223
  735   HD12  LEU 100          HD12      LEU 100  -2.239  -5.516   1.419
  736   HD13  LEU 100          HD13      LEU 100  -1.141  -5.917   0.099
  737   HD21  LEU 100          HD23      LEU 100   0.289  -4.205  -0.906
  738   HD22  LEU 100          HD21      LEU 100   0.231  -2.537  -0.337
  739   HD23  LEU 100          HD22      LEU 100  -1.101  -3.189  -1.292
  740    H    ILE 101           HN       ILE 101  -4.847  -2.080   2.019
  741    HA   ILE 101           HA       ILE 101  -6.236  -4.656   2.335
  742    HB   ILE 101           HB       ILE 101  -7.051  -2.950   3.868
  743   HG12  ILE 101          HG12      ILE 101  -9.055  -3.399   1.643
  744   HG13  ILE 101          HG11      ILE 101  -8.638  -4.599   2.862
  745   HG21  ILE 101          HG21      ILE 101  -8.123  -0.909   3.052
  746   HG22  ILE 101          HG22      ILE 101  -7.665  -1.328   1.402
  747   HG23  ILE 101          HG23      ILE 101  -6.419  -0.974   2.600
  748   HD11  ILE 101          HD13      ILE 101  -9.884  -1.912   3.398
  749   HD12  ILE 101          HD11      ILE 101  -9.488  -3.135   4.607
  750   HD13  ILE 101          HD12      ILE 101 -10.722  -3.464   3.392
  751    H    ARG 102           HN       ARG 102  -7.510  -5.446   0.719
  752    HA   ARG 102           HA       ARG 102  -7.652  -3.880  -1.772
  753    HE   ARG 102           HE       ARG 102  -6.715  -5.977  -4.961
  754    HB2  ARG 102           HB2      ARG 102  -6.686  -6.670  -1.341
  755    HB3  ARG 102           HB1      ARG 102  -7.554  -6.309  -2.826
  756    HG2  ARG 102           HG2      ARG 102  -5.125  -4.802  -1.887
  757    HG3  ARG 102           HG1      ARG 102  -5.081  -6.162  -3.013
  758    HD2  ARG 102           HD2      ARG 102  -6.481  -3.518  -3.408
  759    HD3  ARG 102           HD1      ARG 102  -5.041  -4.090  -4.251
  760   HH11  ARG 102          HH11      ARG 102  -7.331  -2.559  -4.681
  761   HH12  ARG 102          HH12      ARG 102  -8.544  -2.547  -5.917
  762   HH21  ARG 102          HH21      ARG 102  -8.314  -5.969  -6.588
  763   HH22  ARG 102          HH22      ARG 102  -9.103  -4.482  -6.999
  764    H    ARG 103           HN       ARG 103  -9.502  -4.108  -2.999
  765    HA   ARG 103           HA       ARG 103 -11.746  -5.377  -1.602
  766    HE   ARG 103           HE       ARG 103 -13.083  -2.296  -4.968
  767    HB2  ARG 103           HB2      ARG 103 -12.003  -2.987  -2.046
  768    HB3  ARG 103           HB1      ARG 103 -11.727  -3.259  -3.761
  769    HG2  ARG 103           HG2      ARG 103 -13.775  -4.542  -3.918
  770    HG3  ARG 103           HG1      ARG 103 -14.041  -4.364  -2.183
  771    HD2  ARG 103           HD2      ARG 103 -15.396  -2.785  -3.473
  772    HD3  ARG 103           HD1      ARG 103 -14.233  -1.954  -2.442
  773   HH11  ARG 103          HH11      ARG 103 -15.690  -0.546  -3.459
  774   HH12  ARG 103          HH12      ARG 103 -15.630   0.769  -4.584
  775   HH21  ARG 103          HH21      ARG 103 -12.994  -0.566  -6.453
  776   HH22  ARG 103          HH22      ARG 103 -14.097   0.760  -6.285
  777    H    LEU 104           HN       LEU 104 -13.073  -6.848  -2.592
  778    HA   LEU 104           HA       LEU 104 -11.971  -8.133  -4.964
  779    HG   LEU 104           HG       LEU 104 -12.114  -8.923  -1.904
  780    HB2  LEU 104           HB2      LEU 104 -14.242  -9.033  -3.191
  781    HB3  LEU 104           HB1      LEU 104 -13.422  -9.993  -4.407
  782   HD11  LEU 104          HD11      LEU 104 -12.197 -11.197  -1.076
  783   HD12  LEU 104          HD12      LEU 104 -13.038 -11.722  -2.534
  784   HD13  LEU 104          HD13      LEU 104 -13.828 -10.614  -1.411
  785   HD21  LEU 104          HD23      LEU 104 -10.559  -9.234  -3.755
  786   HD22  LEU 104          HD21      LEU 104 -11.144 -10.882  -3.982
  787   HD23  LEU 104          HD22      LEU 104 -10.295 -10.445  -2.499
  788    HA   PRO 105           HA       PRO 105 -15.150  -6.522  -7.608
  789    HB2  PRO 105           HB2      PRO 105 -14.983  -8.180  -9.683
  790    HB3  PRO 105           HB1      PRO 105 -13.608  -7.151  -9.250
  791    HG2  PRO 105           HG2      PRO 105 -14.101 -10.029  -8.550
  792    HG3  PRO 105           HG1      PRO 105 -12.636  -9.296  -9.239
  793    HD2  PRO 105           HD2      PRO 105 -12.916  -9.806  -6.587
  794    HD3  PRO 105           HD1      PRO 105 -11.966  -8.437  -7.201
  795    H    LEU 106           HN       LEU 106 -16.516  -7.549  -5.676
  796    HA   LEU 106           HA       LEU 106 -18.242  -9.679  -6.716
  797    HG   LEU 106           HG       LEU 106 -16.091  -9.850  -4.420
  798    HB2  LEU 106           HB2      LEU 106 -18.091  -8.497  -3.942
  799    HB3  LEU 106           HB1      LEU 106 -19.111  -9.838  -4.424
  800   HD11  LEU 106          HD11      LEU 106 -18.068 -11.198  -2.587
  801   HD12  LEU 106          HD12      LEU 106 -17.026  -9.837  -2.171
  802   HD13  LEU 106          HD13      LEU 106 -16.317 -11.406  -2.553
  803   HD21  LEU 106          HD23      LEU 106 -18.088 -12.023  -5.038
  804   HD22  LEU 106          HD21      LEU 106 -16.353 -12.267  -4.840
  805   HD23  LEU 106          HD22      LEU 106 -16.958 -11.278  -6.168
  806    H    LEU 107           HN       LEU 107 -19.750  -8.807  -8.011
  807    HA   LEU 107           HA       LEU 107 -20.980  -6.267  -7.403
  808    HG   LEU 107           HG       LEU 107 -20.717  -6.445 -11.105
  809    HB2  LEU 107           HB2      LEU 107 -21.305  -8.273  -9.616
  810    HB3  LEU 107           HB1      LEU 107 -22.423  -6.936  -9.436
  811   HD11  LEU 107          HD11      LEU 107 -20.287  -4.768  -8.645
  812   HD12  LEU 107          HD12      LEU 107 -21.700  -4.655  -9.694
  813   HD13  LEU 107          HD13      LEU 107 -20.099  -4.273 -10.329
  814   HD21  LEU 107          HD23      LEU 107 -18.378  -6.140 -10.458
  815   HD22  LEU 107          HD21      LEU 107 -18.902  -7.807 -10.221
  816   HD23  LEU 107          HD22      LEU 107 -18.749  -6.725  -8.837
  817    H    GLU 108           HN       GLU 108 -22.306  -6.307  -5.679
  818    HA   GLU 108           HA       GLU 108 -24.466  -8.312  -5.684
  819    HB2  GLU 108           HB2      GLU 108 -23.144  -7.035  -3.282
  820    HB3  GLU 108           HB1      GLU 108 -24.498  -8.155  -3.226
  821    HG2  GLU 108           HG2      GLU 108 -23.112  -9.910  -4.171
  822    HG3  GLU 108           HG1      GLU 108 -21.755  -8.790  -4.290
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1  -7.122 -12.510  19.298
    2    H2   GLY   1           HT2      GLY   1  -7.574 -10.909  18.994
    3    H3   GLY   1           HT3      GLY   1  -7.573 -12.041  17.737
    4    HA2  GLY   1           HA1      GLY   1  -9.354 -13.277  18.794
    5    HA3  GLY   1           HA2      GLY   1  -9.347 -12.119  20.117
    6    H    SER   2           HN       SER   2  -8.679 -10.162  17.718
    7    HA   SER   2           HA       SER   2 -11.339  -9.951  16.551
    8    HG   SER   2           HG       SER   2 -10.178  -6.831  18.895
    9    HB2  SER   2           HB2      SER   2 -11.514  -7.549  17.202
   10    HB3  SER   2           HB1      SER   2 -11.590  -8.649  18.578
   11    H    HIS   3           HN       HIS   3 -11.299  -7.720  15.206
   12    HA   HIS   3           HA       HIS   3 -10.541  -6.747  13.299
   13    HD1  HIS   3           HD1      HIS   3  -8.222  -5.984  16.926
   14    HD2  HIS   3           HD2      HIS   3 -10.098  -3.864  13.884
   15    HE1  HIS   3           HE1      HIS   3  -9.103  -3.894  18.010
   16    HE2  HIS   3           HE2      HIS   3 -10.241  -2.627  16.152
   17    HB2  HIS   3           HB2      HIS   3  -7.874  -7.031  14.697
   18    HB3  HIS   3           HB1      HIS   3  -8.179  -6.011  13.297
   19    H    GLY   4           HN       GLY   4 -11.142  -8.566  12.015
   20    HA2  GLY   4           HA2      GLY   4  -8.904  -9.680  10.572
   21    HA3  GLY   4           HA1      GLY   4  -9.819 -10.870  11.483
   22    H    TYR   5           HN       TYR   5 -10.338  -8.202   9.178
   23    HA   TYR   5           HA       TYR   5 -12.835  -9.210   8.261
   24    HD1  TYR   5           HD1      TYR   5 -14.491  -6.778   7.785
   25    HD2  TYR   5           HD2      TYR   5 -10.498  -5.954   9.002
   26    HE1  TYR   5           HE1      TYR   5 -15.326  -5.092   9.367
   27    HE2  TYR   5           HE2      TYR   5 -11.323  -4.267  10.588
   28    HH   TYR   5           HH       TYR   5 -14.587  -3.990  11.445
   29    HB2  TYR   5           HB2      TYR   5 -10.935  -7.224   6.994
   30    HB3  TYR   5           HB1      TYR   5 -12.583  -7.530   6.452
   31    H    SER   6           HN       SER   6 -13.347 -10.396   6.463
   32    HA   SER   6           HA       SER   6 -11.297 -11.214   4.591
   33    HG   SER   6           HG       SER   6 -12.241 -14.583   4.816
   34    HB2  SER   6           HB2      SER   6 -10.954 -12.835   6.391
   35    HB3  SER   6           HB1      SER   6 -12.667 -13.249   6.367
   36    H    ASP   7           HN       ASP   7 -12.325 -10.762   2.756
   37    HA   ASP   7           HA       ASP   7 -13.905 -10.680   1.123
   38    HB2  ASP   7           HB2      ASP   7 -14.848 -13.232   2.448
   39    HB3  ASP   7           HB1      ASP   7 -15.301 -12.692   0.836
   40    H    ALA   8           HN       ALA   8 -14.447  -9.197   3.486
   41    HA   ALA   8           HA       ALA   8 -17.357  -9.435   3.790
   42    HB1  ALA   8           HB3      ALA   8 -15.421  -7.801   5.423
   43    HB2  ALA   8           HB1      ALA   8 -15.992  -9.415   5.846
   44    HB3  ALA   8           HB2      ALA   8 -17.129  -8.069   5.769
   45    H    SER   9           HN       SER   9 -18.599  -8.146   2.624
   46    HA   SER   9           HA       SER   9 -19.343  -6.416   1.357
   47    HG   SER   9           HG       SER   9 -19.754  -6.091   3.674
   48    HB2  SER   9           HB2      SER   9 -17.501  -4.859   3.183
   49    HB3  SER   9           HB1      SER   9 -18.691  -4.129   2.106
   50    H    GLY  10           HN       GLY  10 -16.777  -7.852   0.649
   51    HA2  GLY  10           HA2      GLY  10 -15.545  -7.794  -1.323
   52    HA3  GLY  10           HA1      GLY  10 -16.126  -6.161  -1.607
   53    H    PHE  11           HN       PHE  11 -14.571  -7.219   1.356
   54    HA   PHE  11           HA       PHE  11 -12.105  -5.823   0.586
   55    HD1  PHE  11           HD2      PHE  11 -11.962  -3.139   0.722
   56    HD2  PHE  11           HD1      PHE  11 -15.554  -4.303   2.685
   57    HE1  PHE  11           HE2      PHE  11 -13.125  -1.213  -0.272
   58    HE2  PHE  11           HE1      PHE  11 -16.723  -2.378   1.696
   59    HZ   PHE  11           HZ       PHE  11 -15.510  -0.830   0.215
   60    HB2  PHE  11           HB2      PHE  11 -13.570  -5.386   3.199
   61    HB3  PHE  11           HB1      PHE  11 -12.019  -4.683   2.756
   62    H    SER  12           HN       SER  12 -10.308  -6.861   1.167
   63    HA   SER  12           HA       SER  12 -10.455  -8.880   3.290
   64    HG   SER  12           HG       SER  12  -9.376 -11.163   2.668
   65    HB2  SER  12           HB2      SER  12 -10.721 -10.126   1.226
   66    HB3  SER  12           HB1      SER  12  -9.321  -9.323   0.518
   67    H    LEU  13           HN       LEU  13  -8.718  -8.949   4.595
   68    HA   LEU  13           HA       LEU  13  -6.738  -6.891   4.345
   69    HG   LEU  13           HG       LEU  13  -8.851  -7.529   6.458
   70    HB2  LEU  13           HB2      LEU  13  -6.960  -9.166   6.320
   71    HB3  LEU  13           HB1      LEU  13  -5.848  -7.816   6.451
   72   HD11  LEU  13          HD11      LEU  13  -8.627  -7.147   8.866
   73   HD12  LEU  13          HD12      LEU  13  -6.910  -7.545   8.768
   74   HD13  LEU  13          HD13      LEU  13  -8.122  -8.777   8.416
   75   HD21  LEU  13          HD23      LEU  13  -8.299  -5.282   7.360
   76   HD22  LEU  13          HD21      LEU  13  -7.747  -5.534   5.703
   77   HD23  LEU  13          HD22      LEU  13  -6.596  -5.615   7.037
   78    H    TYR  14           HN       TYR  14  -4.938  -7.032   3.201
   79    HA   TYR  14           HA       TYR  14  -3.741  -9.692   2.781
   80    HD1  TYR  14           HD2      TYR  14  -3.425 -10.941   0.213
   81    HD2  TYR  14           HD1      TYR  14  -6.352  -7.848   0.373
   82    HE1  TYR  14           HE2      TYR  14  -5.030 -12.406  -0.935
   83    HE2  TYR  14           HE1      TYR  14  -7.958  -9.310  -0.777
   84    HH   TYR  14           HH       TYR  14  -7.924 -11.273  -2.271
   85    HB2  TYR  14           HB2      TYR  14  -4.061  -7.372   0.896
   86    HB3  TYR  14           HB1      TYR  14  -2.800  -8.573   0.643
   87    H    SER  15           HN       SER  15  -1.657  -9.948   3.333
   88    HA   SER  15           HA       SER  15   0.003  -7.567   3.751
   89    HG   SER  15           HG       SER  15  -1.171 -10.435   5.423
   90    HB2  SER  15           HB2      SER  15   0.842  -8.496   5.887
   91    HB3  SER  15           HB1      SER  15  -0.886  -8.147   5.953
   92    H    VAL  16           HN       VAL  16   1.945  -7.762   2.849
   93    HA   VAL  16           HA       VAL  16   3.003 -10.472   2.366
   94    HB   VAL  16           HB       VAL  16   3.332  -8.153   0.462
   95   HG11  VAL  16          HG11      VAL  16   4.134  -9.885  -1.081
   96   HG12  VAL  16          HG12      VAL  16   3.953 -11.092   0.192
   97   HG13  VAL  16          HG13      VAL  16   5.128  -9.788   0.373
   98   HG21  VAL  16          HG23      VAL  16   1.453 -10.507   0.267
   99   HG22  VAL  16          HG21      VAL  16   1.734  -9.307  -0.995
  100   HG23  VAL  16          HG22      VAL  16   0.989  -8.825   0.530
  101    H    GLU  17           HN       GLU  17   5.180 -10.766   2.663
  102    HA   GLU  17           HA       GLU  17   6.561  -8.591   4.042
  103    HB2  GLU  17           HB2      GLU  17   7.223 -11.530   3.823
  104    HB3  GLU  17           HB1      GLU  17   8.151 -10.356   4.746
  105    HG2  GLU  17           HG2      GLU  17   6.238  -9.945   6.183
  106    HG3  GLU  17           HG1      GLU  17   5.272 -11.077   5.238
  107    H    LEU  18           HN       LEU  18   7.878  -7.344   2.931
  108    HA   LEU  18           HA       LEU  18   9.353  -8.494   0.654
  109    HG   LEU  18           HG       LEU  18   7.502  -5.919  -1.244
  110    HB2  LEU  18           HB2      LEU  18   8.167  -5.781   1.101
  111    HB3  LEU  18           HB1      LEU  18   9.558  -5.952   0.051
  112   HD11  LEU  18          HD11      LEU  18   7.813  -7.980  -2.517
  113   HD12  LEU  18          HD12      LEU  18   8.777  -8.648  -1.201
  114   HD13  LEU  18          HD13      LEU  18   9.356  -7.241  -2.091
  115   HD21  LEU  18          HD23      LEU  18   5.821  -7.642  -1.046
  116   HD22  LEU  18          HD21      LEU  18   6.013  -6.816   0.501
  117   HD23  LEU  18          HD22      LEU  18   6.723  -8.412   0.259
  118    H    PHE  19           HN       PHE  19  11.482  -7.344   0.238
  119    HA   PHE  19           HA       PHE  19  12.721  -6.249   2.634
  120    HD1  PHE  19           HD2      PHE  19  11.708  -9.940   1.599
  121    HD2  PHE  19           HD1      PHE  19  15.563  -8.662   0.330
  122    HE1  PHE  19           HE2      PHE  19  11.707 -11.678  -0.143
  123    HE2  PHE  19           HE1      PHE  19  15.568 -10.397  -1.415
  124    HZ   PHE  19           HZ       PHE  19  13.631 -11.915  -1.645
  125    HB2  PHE  19           HB2      PHE  19  14.663  -7.869   2.361
  126    HB3  PHE  19           HB1      PHE  19  13.181  -8.538   3.033
  127    H    ARG  20           HN       ARG  20  13.913  -4.547   2.086
  128    HA   ARG  20           HA       ARG  20  14.730  -4.281  -0.716
  129    HE   ARG  20           HE       ARG  20  15.764  -0.183   1.296
  130    HB2  ARG  20           HB2      ARG  20  13.491  -2.451   0.642
  131    HB3  ARG  20           HB1      ARG  20  15.065  -2.139   1.364
  132    HG2  ARG  20           HG2      ARG  20  15.993  -1.749  -0.882
  133    HG3  ARG  20           HG1      ARG  20  14.386  -1.993  -1.568
  134    HD2  ARG  20           HD2      ARG  20  14.735   0.355  -1.378
  135    HD3  ARG  20           HD1      ARG  20  13.583  -0.110  -0.127
  136   HH11  ARG  20          HH11      ARG  20  14.932   2.127  -1.172
  137   HH12  ARG  20          HH12      ARG  20  15.842   3.414  -0.455
  138   HH21  ARG  20          HH21      ARG  20  16.967   1.503   2.248
  139   HH22  ARG  20          HH22      ARG  20  17.001   3.058   1.487
  140    H    GLU  21           HN       GLU  21  16.557  -5.467  -0.952
  141    HA   GLU  21           HA       GLU  21  18.799  -4.900   0.864
  142    HB2  GLU  21           HB2      GLU  21  18.043  -7.279   0.625
  143    HB3  GLU  21           HB1      GLU  21  18.512  -7.205  -1.068
  144    HG2  GLU  21           HG2      GLU  21  20.228  -8.288   0.237
  145    HG3  GLU  21           HG1      GLU  21  20.824  -6.759  -0.406
  146    H    LYS  22           HN       LYS  22  17.635  -4.514  -2.324
  147    HA   LYS  22           HA       LYS  22  20.222  -4.115  -3.545
  148    HB2  LYS  22           HB2      LYS  22  17.396  -3.728  -4.532
  149    HB3  LYS  22           HB1      LYS  22  18.804  -3.321  -5.502
  150    HG2  LYS  22           HG2      LYS  22  18.127  -5.454  -6.208
  151    HG3  LYS  22           HG1      LYS  22  19.546  -5.717  -5.196
  152    HD2  LYS  22           HD2      LYS  22  18.174  -6.398  -3.347
  153    HD3  LYS  22           HD1      LYS  22  16.704  -5.953  -4.217
  154    HE2  LYS  22           HE2      LYS  22  17.098  -8.382  -4.229
  155    HE3  LYS  22           HE1      LYS  22  17.105  -7.693  -5.852
  156    HZ1  LYS  22           HZ3      LYS  22  19.531  -7.698  -5.792
  157    HZ2  LYS  22           HZ1      LYS  22  18.908  -9.258  -5.577
  158    HZ3  LYS  22           HZ2      LYS  22  19.505  -8.396  -4.250
  159    H    ASP  23           HN       ASP  23  21.046  -2.145  -4.307
  160    HA   ASP  23           HA       ASP  23  20.305   0.140  -2.684
  161    HB2  ASP  23           HB2      ASP  23  22.314   1.195  -3.728
  162    HB3  ASP  23           HB1      ASP  23  22.663  -0.325  -2.908
  163    H    THR  24           HN       THR  24  18.233  -0.408  -4.331
  164    HA   THR  24           HA       THR  24  18.413   1.238  -6.716
  165    HB   THR  24           HB       THR  24  16.106   0.557  -7.148
  166    HG1  THR  24           HG1      THR  24  15.577   0.462  -4.807
  167   HG21  THR  24          HG23      THR  24  17.857  -1.745  -6.272
  168   HG22  THR  24          HG21      THR  24  17.887  -0.958  -7.849
  169   HG23  THR  24          HG22      THR  24  16.463  -1.870  -7.346
  170    H    SER  25           HN       SER  25  17.765   1.721  -3.466
  171    HA   SER  25           HA       SER  25  16.922   3.440  -2.243
  172    HG   SER  25           HG       SER  25  16.280   5.703  -2.443
  173    HB2  SER  25           HB2      SER  25  18.486   4.749  -3.637
  174    HB3  SER  25           HB1      SER  25  17.212   4.983  -4.832
  175    H    SER  26           HN       SER  26  15.123   1.730  -4.003
  176    HA   SER  26           HA       SER  26  12.690   3.147  -3.382
  177    HG   SER  26           HG       SER  26  13.988   4.470  -6.274
  178    HB2  SER  26           HB2      SER  26  13.352   2.478  -6.260
  179    HB3  SER  26           HB1      SER  26  11.778   3.025  -5.683
  180    H    LEU  27           HN       LEU  27  10.761   1.810  -3.747
  181    HA   LEU  27           HA       LEU  27  11.421  -1.059  -3.633
  182    HG   LEU  27           HG       LEU  27  11.461   0.316  -1.072
  183    HB2  LEU  27           HB2      LEU  27   9.259   0.527  -2.262
  184    HB3  LEU  27           HB1      LEU  27   9.213  -1.221  -2.372
  185   HD11  LEU  27          HD11      LEU  27   9.385   0.688   0.146
  186   HD12  LEU  27          HD12      LEU  27  10.469  -0.364   1.057
  187   HD13  LEU  27          HD13      LEU  27   9.091  -1.051   0.197
  188   HD21  LEU  27          HD23      LEU  27  10.716  -2.605  -1.093
  189   HD22  LEU  27          HD21      LEU  27  11.977  -1.892  -0.088
  190   HD23  LEU  27          HD22      LEU  27  12.131  -1.870  -1.844
  191    H    GLY  28           HN       GLY  28   9.796   1.355  -5.363
  192    HA2  GLY  28           HA2      GLY  28   8.861   1.013  -7.502
  193    HA3  GLY  28           HA1      GLY  28   8.594  -0.674  -7.091
  194    H    ILE  29           HN       ILE  29   7.676   1.944  -4.973
  195    HA   ILE  29           HA       ILE  29   4.850   1.262  -5.447
  196    HB   ILE  29           HB       ILE  29   6.125   2.464  -2.985
  197   HG12  ILE  29          HG12      ILE  29   4.938  -0.289  -3.399
  198   HG13  ILE  29          HG11      ILE  29   6.663   0.061  -3.400
  199   HG21  ILE  29          HG21      ILE  29   3.843   3.248  -3.308
  200   HG22  ILE  29          HG22      ILE  29   3.935   2.140  -1.940
  201   HG23  ILE  29          HG23      ILE  29   3.285   1.584  -3.482
  202   HD11  ILE  29          HD13      ILE  29   5.978  -0.843  -1.269
  203   HD12  ILE  29          HD11      ILE  29   4.771   0.431  -1.089
  204   HD13  ILE  29          HD12      ILE  29   6.488   0.835  -1.079
  205    H    SER  30           HN       SER  30   3.927   2.714  -6.761
  206    HA   SER  30           HA       SER  30   4.614   5.554  -6.395
  207    HG   SER  30           HG       SER  30   4.397   6.603  -9.310
  208    HB2  SER  30           HB2      SER  30   5.157   4.783  -8.629
  209    HB3  SER  30           HB1      SER  30   3.535   4.121  -8.832
  210    H    ILE  31           HN       ILE  31   3.168   6.286  -4.941
  211    HA   ILE  31           HA       ILE  31   0.353   5.565  -5.192
  212    HB   ILE  31           HB       ILE  31   0.068   6.838  -3.080
  213   HG12  ILE  31          HG12      ILE  31   3.086   7.071  -3.138
  214   HG13  ILE  31          HG11      ILE  31   1.982   8.401  -3.471
  215   HG21  ILE  31          HG21      ILE  31   0.471   4.445  -3.025
  216   HG22  ILE  31          HG22      ILE  31   1.252   5.230  -1.653
  217   HG23  ILE  31          HG23      ILE  31   2.213   4.718  -3.042
  218   HD11  ILE  31          HD13      ILE  31   2.849   8.483  -1.196
  219   HD12  ILE  31          HD11      ILE  31   2.170   6.887  -0.876
  220   HD13  ILE  31          HD12      ILE  31   1.100   8.250  -1.212
  221    H    SER  32           HN       SER  32  -1.119   7.574  -4.522
  222    HA   SER  32           HA       SER  32  -0.338   9.909  -6.122
  223    HG   SER  32           HG       SER  32  -3.489   7.581  -6.835
  224    HB2  SER  32           HB2      SER  32  -2.586   9.981  -7.138
  225    HB3  SER  32           HB1      SER  32  -1.737   8.495  -7.559
  226    H    GLY  33           HN       GLY  33  -0.944  11.843  -5.290
  227    HA2  GLY  33           HA2      GLY  33  -1.772  11.978  -2.584
  228    HA3  GLY  33           HA1      GLY  33  -1.618  13.341  -3.683
  229    H    MET  34           HN       MET  34  -3.761  11.166  -2.128
  230    HA   MET  34           HA       MET  34  -6.062  11.558  -3.729
  231    HB2  MET  34           HB2      MET  34  -5.815   9.706  -2.108
  232    HB3  MET  34           HB1      MET  34  -5.890  10.866  -0.789
  233    HG2  MET  34           HG2      MET  34  -8.158  11.471  -1.435
  234    HG3  MET  34           HG1      MET  34  -8.084  10.332  -2.779
  235    HE1  MET  34           HE3      MET  34 -10.462  10.252  -0.677
  236    HE2  MET  34           HE1      MET  34 -10.575   8.512  -0.406
  237    HE3  MET  34           HE2      MET  34 -10.282   9.136  -2.030
  238    H    ARG  35           HN       ARG  35  -7.851  12.912  -3.413
  239    HA   ARG  35           HA       ARG  35  -7.639  15.042  -1.439
  240    HE   ARG  35           HE       ARG  35  -8.471  14.784  -7.220
  241    HB2  ARG  35           HB2      ARG  35  -7.919  16.826  -3.061
  242    HB3  ARG  35           HB1      ARG  35  -6.461  15.913  -3.422
  243    HG2  ARG  35           HG2      ARG  35  -9.032  15.272  -4.807
  244    HG3  ARG  35           HG1      ARG  35  -8.025  16.615  -5.348
  245    HD2  ARG  35           HD2      ARG  35  -6.122  15.041  -5.553
  246    HD3  ARG  35           HD1      ARG  35  -7.208  13.720  -5.127
  247   HH11  ARG  35          HH11      ARG  35  -5.118  13.951  -6.760
  248   HH12  ARG  35          HH12      ARG  35  -4.843  13.606  -8.435
  249   HH21  ARG  35          HH21      ARG  35  -8.115  14.334  -9.423
  250   HH22  ARG  35          HH22      ARG  35  -6.546  13.821  -9.947
  251    H    ASP  36           HN       ASP  36  -9.620  16.380  -1.354
  252    HA   ASP  36           HA       ASP  36 -11.994  15.032  -2.425
  253    HB2  ASP  36           HB2      ASP  36 -13.119  15.254  -0.230
  254    HB3  ASP  36           HB1      ASP  36 -11.728  14.176  -0.164
  255    H    GLN  37           HN       GLN  37 -13.477  16.401  -3.217
  256    HA   GLN  37           HA       GLN  37 -13.258  19.243  -2.496
  257    HB2  GLN  37           HB2      GLN  37 -12.404  19.073  -4.696
  258    HB3  GLN  37           HB1      GLN  37 -13.664  17.949  -5.183
  259    HG2  GLN  37           HG2      GLN  37 -15.317  19.703  -5.059
  260    HG3  GLN  37           HG1      GLN  37 -14.096  20.842  -4.495
  261   HE21  GLN  37          HE21      GLN  37 -14.397  22.231  -6.225
  262   HE22  GLN  37          HE22      GLN  37 -13.873  21.848  -7.827
  263    H    SER  38           HN       SER  38 -14.965  19.654  -1.241
  264    HA   SER  38           HA       SER  38 -17.100  19.799  -0.472
  265    HG   SER  38           HG       SER  38 -17.840  21.804  -3.300
  266    HB2  SER  38           HB2      SER  38 -17.742  19.521  -3.420
  267    HB3  SER  38           HB1      SER  38 -18.870  20.072  -2.182
  268    H    THR  39           HN       THR  39 -15.980  17.269  -0.258
  269    HA   THR  39           HA       THR  39 -18.014  15.356  -1.099
  270    HB   THR  39           HB       THR  39 -16.512  13.638  -0.181
  271    HG1  THR  39           HG1      THR  39 -14.382  14.428   0.509
  272   HG21  THR  39          HG23      THR  39 -15.088  15.631  -1.950
  273   HG22  THR  39          HG21      THR  39 -16.196  14.371  -2.496
  274   HG23  THR  39          HG22      THR  39 -14.657  13.932  -1.754
  275    H    THR  40           HN       THR  40 -19.379  14.285   0.255
  276    HA   THR  40           HA       THR  40 -19.732  15.420   2.908
  277    HB   THR  40           HB       THR  40 -21.717  15.167   1.510
  278    HG1  THR  40           HG1      THR  40 -22.527  13.287   3.217
  279   HG21  THR  40          HG23      THR  40 -21.031  13.245   0.182
  280   HG22  THR  40          HG21      THR  40 -22.583  12.929   0.956
  281   HG23  THR  40          HG22      THR  40 -21.111  12.209   1.608
  282    H    GLY  41           HN       GLY  41 -17.596  13.364   2.013
  283    HA2  GLY  41           HA2      GLY  41 -17.880  11.704   4.411
  284    HA3  GLY  41           HA1      GLY  41 -17.670  10.886   2.870
  285    H    GLU  42           HN       GLU  42 -16.158  12.885   5.296
  286    HA   GLU  42           HA       GLU  42 -13.663  13.219   3.987
  287    HB2  GLU  42           HB2      GLU  42 -14.311  13.274   6.941
  288    HB3  GLU  42           HB1      GLU  42 -12.825  13.865   6.211
  289    HG2  GLU  42           HG2      GLU  42 -14.060  15.565   5.005
  290    HG3  GLU  42           HG1      GLU  42 -15.577  14.949   5.659
  291    H    ALA  43           HN       ALA  43 -12.936  11.252   3.203
  292    HA   ALA  43           HA       ALA  43 -11.890   9.426   5.248
  293    HB1  ALA  43           HB3      ALA  43 -12.535   7.481   3.906
  294    HB2  ALA  43           HB1      ALA  43 -13.345   8.545   2.756
  295    HB3  ALA  43           HB2      ALA  43 -13.943   8.415   4.411
  296    H    THR  44           HN       THR  44 -10.144  11.096   4.432
  297    HA   THR  44           HA       THR  44  -8.900  10.454   1.924
  298    HB   THR  44           HB       THR  44  -7.087  11.968   2.683
  299    HG1  THR  44           HG1      THR  44  -7.737  13.154   4.719
  300   HG21  THR  44          HG23      THR  44  -9.105  12.836   1.539
  301   HG22  THR  44          HG21      THR  44  -8.397  14.004   2.654
  302   HG23  THR  44          HG22      THR  44  -9.848  13.113   3.114
  303    H    GLY  45           HN       GLY  45  -6.794   9.569   1.646
  304    HA2  GLY  45           HA2      GLY  45  -5.338   8.377   3.780
  305    HA3  GLY  45           HA1      GLY  45  -6.309   7.175   2.945
  306    H    ILE  46           HN       ILE  46  -4.182   6.224   2.482
  307    HA   ILE  46           HA       ILE  46  -2.978   7.469   0.095
  308    HB   ILE  46           HB       ILE  46  -1.554   5.888   2.240
  309   HG12  ILE  46          HG12      ILE  46  -2.067   8.207   2.889
  310   HG13  ILE  46          HG11      ILE  46  -0.337   7.968   2.672
  311   HG21  ILE  46          HG21      ILE  46  -0.520   7.051  -0.340
  312   HG22  ILE  46          HG22      ILE  46  -0.620   5.343   0.091
  313   HG23  ILE  46          HG23      ILE  46   0.494   6.407   0.952
  314   HD11  ILE  46          HD13      ILE  46  -1.026  10.090   1.749
  315   HD12  ILE  46          HD11      ILE  46  -2.213   9.286   0.722
  316   HD13  ILE  46          HD12      ILE  46  -0.490   9.015   0.458
  317    H    TYR  47           HN       TYR  47  -2.890   6.225  -1.681
  318    HA   TYR  47           HA       TYR  47  -3.015   3.323  -1.435
  319    HD1  TYR  47           HD1      TYR  47  -5.355   6.650  -1.964
  320    HD2  TYR  47           HD2      TYR  47  -5.140   3.827  -5.139
  321    HE1  TYR  47           HE1      TYR  47  -6.084   8.385  -3.546
  322    HE2  TYR  47           HE2      TYR  47  -5.868   5.554  -6.732
  323    HH   TYR  47           HH       TYR  47  -7.088   7.679  -6.716
  324    HB2  TYR  47           HB2      TYR  47  -4.902   3.093  -2.927
  325    HB3  TYR  47           HB1      TYR  47  -5.368   4.127  -1.583
  326    H    VAL  48           HN       VAL  48  -2.152   2.209  -3.175
  327    HA   VAL  48           HA       VAL  48  -0.383   3.746  -4.863
  328    HB   VAL  48           HB       VAL  48  -0.834   0.760  -4.724
  329   HG11  VAL  48          HG11      VAL  48   1.313   0.600  -5.919
  330   HG12  VAL  48          HG12      VAL  48   1.324   2.353  -6.104
  331   HG13  VAL  48          HG13      VAL  48   0.068   1.392  -6.883
  332   HG21  VAL  48          HG23      VAL  48   1.377   2.447  -3.561
  333   HG22  VAL  48          HG21      VAL  48   1.217   0.695  -3.435
  334   HG23  VAL  48          HG22      VAL  48   0.041   1.746  -2.649
  335    H    LYS  49           HN       LYS  49  -0.698   4.295  -6.917
  336    HA   LYS  49           HA       LYS  49  -3.125   3.325  -8.251
  337    HB2  LYS  49           HB2      LYS  49  -2.853   5.776  -7.948
  338    HB3  LYS  49           HB1      LYS  49  -1.395   5.711  -8.928
  339    HG2  LYS  49           HG2      LYS  49  -2.771   4.845 -10.810
  340    HG3  LYS  49           HG1      LYS  49  -4.206   5.105  -9.818
  341    HD2  LYS  49           HD2      LYS  49  -3.977   7.002 -11.240
  342    HD3  LYS  49           HD1      LYS  49  -3.512   7.510  -9.616
  343    HE2  LYS  49           HE2      LYS  49  -1.972   8.386 -11.299
  344    HE3  LYS  49           HE1      LYS  49  -1.158   7.270 -10.205
  345    HZ1  LYS  49           HZ3      LYS  49  -0.523   6.873 -12.496
  346    HZ2  LYS  49           HZ1      LYS  49  -2.137   6.615 -12.931
  347    HZ3  LYS  49           HZ2      LYS  49  -1.363   5.538 -11.882
  348    H    SER  50           HN       SER  50   0.330   3.299  -8.436
  349    HA   SER  50           HA       SER  50   0.220   1.441 -10.648
  350    HG   SER  50           HG       SER  50   2.667   4.042 -10.375
  351    HB2  SER  50           HB2      SER  50   1.809   2.710 -12.054
  352    HB3  SER  50           HB1      SER  50   0.283   3.570 -11.847
  353    H    LEU  51           HN       LEU  51   2.228   0.349 -11.031
  354    HA   LEU  51           HA       LEU  51   4.064   0.490  -8.731
  355    HG   LEU  51           HG       LEU  51   1.551  -1.359  -8.908
  356    HB2  LEU  51           HB2      LEU  51   3.410  -1.891 -10.472
  357    HB3  LEU  51           HB1      LEU  51   4.517  -1.890  -9.113
  358   HD11  LEU  51          HD11      LEU  51   3.127  -3.836  -8.218
  359   HD12  LEU  51          HD12      LEU  51   2.015  -3.664  -9.576
  360   HD13  LEU  51          HD13      LEU  51   1.406  -3.582  -7.923
  361   HD21  LEU  51          HD23      LEU  51   3.651  -1.798  -6.787
  362   HD22  LEU  51          HD21      LEU  51   1.919  -1.622  -6.503
  363   HD23  LEU  51          HD22      LEU  51   2.849  -0.271  -7.153
  364    H    ILE  52           HN       ILE  52   6.311  -0.221  -9.210
  365    HA   ILE  52           HA       ILE  52   7.130   0.753 -11.862
  366    HB   ILE  52           HB       ILE  52   8.735   0.689  -9.310
  367   HG12  ILE  52          HG12      ILE  52   7.476   2.999 -10.810
  368   HG13  ILE  52          HG11      ILE  52   6.900   2.336  -9.284
  369   HG21  ILE  52          HG21      ILE  52   9.387   1.844 -12.023
  370   HG22  ILE  52          HG22      ILE  52  10.129   0.421 -11.294
  371   HG23  ILE  52          HG23      ILE  52  10.374   2.011 -10.571
  372   HD11  ILE  52          HD13      ILE  52   9.536   3.698  -9.753
  373   HD12  ILE  52          HD11      ILE  52   9.003   2.999  -8.224
  374   HD13  ILE  52          HD12      ILE  52   8.137   4.370  -8.917
  375    HA   PRO  53           HA       PRO  53   8.017  -3.694 -12.456
  376    HB2  PRO  53           HB2      PRO  53   9.042  -2.495 -14.987
  377    HB3  PRO  53           HB1      PRO  53   8.014  -3.913 -14.749
  378    HG2  PRO  53           HG2      PRO  53   6.977  -1.620 -15.608
  379    HG3  PRO  53           HG1      PRO  53   6.099  -2.636 -14.448
  380    HD2  PRO  53           HD2      PRO  53   7.595  -0.096 -13.991
  381    HD3  PRO  53           HD1      PRO  53   6.112  -0.690 -13.217
  382    H    GLY  54           HN       GLY  54   9.891  -4.876 -12.322
  383    HA2  GLY  54           HA2      GLY  54  12.206  -5.266 -12.451
  384    HA3  GLY  54           HA1      GLY  54  12.460  -3.547 -12.707
  385    H    SER  55           HN       SER  55  10.609  -3.044 -10.343
  386    HA   SER  55           HA       SER  55  12.708  -3.019  -8.367
  387    HG   SER  55           HG       SER  55  10.610  -0.166  -8.824
  388    HB2  SER  55           HB2      SER  55   9.838  -2.066  -8.227
  389    HB3  SER  55           HB1      SER  55  11.051  -1.799  -6.975
  390    H    ALA  56           HN       ALA  56  11.708  -3.434  -5.986
  391    HA   ALA  56           HA       ALA  56  11.511  -6.247  -5.780
  392    HB1  ALA  56           HB3      ALA  56  12.538  -4.934  -4.030
  393    HB2  ALA  56           HB1      ALA  56  11.166  -5.830  -3.374
  394    HB3  ALA  56           HB2      ALA  56  11.012  -4.106  -3.717
  395    H    ALA  57           HN       ALA  57   9.131  -3.703  -5.026
  396    HA   ALA  57           HA       ALA  57   6.989  -5.315  -4.348
  397    HB1  ALA  57           HB3      ALA  57   5.564  -3.409  -4.873
  398    HB2  ALA  57           HB1      ALA  57   6.887  -2.653  -5.762
  399    HB3  ALA  57           HB2      ALA  57   7.020  -2.897  -4.020
  400    H    ALA  58           HN       ALA  58   8.031  -4.262  -7.565
  401    HA   ALA  58           HA       ALA  58   5.776  -5.311  -8.943
  402    HB1  ALA  58           HB3      ALA  58   7.172  -3.541  -9.885
  403    HB2  ALA  58           HB1      ALA  58   7.072  -4.927 -10.969
  404    HB3  ALA  58           HB2      ALA  58   8.524  -4.667 -10.003
  405    H    LEU  59           HN       LEU  59   9.028  -6.561  -8.293
  406    HA   LEU  59           HA       LEU  59   8.682  -8.952  -9.799
  407    HG   LEU  59           HG       LEU  59  10.935  -7.015  -9.824
  408    HB2  LEU  59           HB2      LEU  59  10.647  -8.189  -7.644
  409    HB3  LEU  59           HB1      LEU  59  10.704  -9.718  -8.499
  410   HD11  LEU  59          HD11      LEU  59  13.075  -9.013  -9.106
  411   HD12  LEU  59          HD12      LEU  59  12.844  -7.425  -8.375
  412   HD13  LEU  59          HD13      LEU  59  13.309  -7.556 -10.071
  413   HD21  LEU  59          HD23      LEU  59  10.050  -8.737 -11.295
  414   HD22  LEU  59          HD21      LEU  59  11.383  -9.809 -10.867
  415   HD23  LEU  59          HD22      LEU  59  11.700  -8.319 -11.754
  416    H    ASP  60           HN       ASP  60   7.666  -7.946  -6.696
  417    HA   ASP  60           HA       ASP  60   7.598 -10.366  -5.297
  418    HB2  ASP  60           HB2      ASP  60   7.200  -8.136  -4.285
  419    HB3  ASP  60           HB1      ASP  60   5.639  -8.069  -5.096
  420    H    GLY  61           HN       GLY  61   4.966  -8.789  -7.123
  421    HA2  GLY  61           HA2      GLY  61   3.573  -9.985  -8.651
  422    HA3  GLY  61           HA1      GLY  61   3.934 -11.463  -7.774
  423    H    ARG  62           HN       ARG  62   3.354 -10.806  -5.191
  424    HA   ARG  62           HA       ARG  62   0.587 -11.116  -5.070
  425    HE   ARG  62           HE       ARG  62  -0.055 -12.239  -1.922
  426    HB2  ARG  62           HB2      ARG  62   2.459 -10.100  -2.925
  427    HB3  ARG  62           HB1      ARG  62   0.815 -10.658  -2.649
  428    HG2  ARG  62           HG2      ARG  62   3.012 -12.364  -3.800
  429    HG3  ARG  62           HG1      ARG  62   2.563 -12.327  -2.094
  430    HD2  ARG  62           HD2      ARG  62   0.768 -13.107  -4.390
  431    HD3  ARG  62           HD1      ARG  62   1.517 -14.212  -3.238
  432   HH11  ARG  62          HH11      ARG  62  -0.257 -15.220  -3.715
  433   HH12  ARG  62          HH12      ARG  62  -1.757 -15.701  -2.994
  434   HH21  ARG  62          HH21      ARG  62  -2.029 -12.862  -0.973
  435   HH22  ARG  62          HH22      ARG  62  -2.764 -14.360  -1.436
  436    H    ILE  63           HN       ILE  63   2.548  -8.220  -5.052
  437    HA   ILE  63           HA       ILE  63   0.422  -6.474  -4.237
  438    HB   ILE  63           HB       ILE  63   3.048  -5.783  -5.563
  439   HG12  ILE  63          HG12      ILE  63   2.317  -5.752  -2.626
  440   HG13  ILE  63          HG11      ILE  63   3.252  -7.026  -3.400
  441   HG21  ILE  63          HG21      ILE  63   2.673  -3.550  -4.612
  442   HG22  ILE  63          HG22      ILE  63   1.096  -4.074  -4.023
  443   HG23  ILE  63          HG23      ILE  63   1.408  -3.997  -5.756
  444   HD11  ILE  63          HD13      ILE  63   4.687  -5.465  -2.223
  445   HD12  ILE  63          HD11      ILE  63   4.051  -4.133  -3.189
  446   HD13  ILE  63          HD12      ILE  63   4.990  -5.411  -3.960
  447    H    GLU  64           HN       GLU  64  -1.100  -5.567  -5.456
  448    HA   GLU  64           HA       GLU  64  -0.769  -5.591  -8.382
  449    HB2  GLU  64           HB2      GLU  64  -2.343  -7.323  -7.804
  450    HB3  GLU  64           HB1      GLU  64  -3.238  -6.228  -6.759
  451    HG2  GLU  64           HG2      GLU  64  -3.907  -4.916  -8.706
  452    HG3  GLU  64           HG1      GLU  64  -3.003  -6.009  -9.753
  453    HA   PRO  65           HA       PRO  65  -1.373  -1.192  -8.244
  454    HB2  PRO  65           HB2      PRO  65  -2.899  -1.657 -10.764
  455    HB3  PRO  65           HB1      PRO  65  -1.581  -0.526 -10.441
  456    HG2  PRO  65           HG2      PRO  65  -1.133  -2.745 -11.828
  457    HG3  PRO  65           HG1      PRO  65   0.051  -2.168 -10.638
  458    HD2  PRO  65           HD2      PRO  65  -1.910  -4.413 -10.431
  459    HD3  PRO  65           HD1      PRO  65  -0.252  -4.301  -9.805
  460    H    ASN  66           HN       ASN  66  -3.114   0.421  -8.268
  461    HA   ASN  66           HA       ASN  66  -5.112   1.214  -7.535
  462    HB2  ASN  66           HB2      ASN  66  -6.169  -1.315  -8.819
  463    HB3  ASN  66           HB1      ASN  66  -7.158   0.047  -8.302
  464   HD21  ASN  66          HD21      ASN  66  -7.062   1.983  -9.448
  465   HD22  ASN  66          HD22      ASN  66  -6.408   2.067 -11.045
  466    H    ASP  67           HN       ASP  67  -3.622   0.005  -5.617
  467    HA   ASP  67           HA       ASP  67  -5.622  -1.427  -3.988
  468    HB2  ASP  67           HB2      ASP  67  -3.683  -2.840  -4.548
  469    HB3  ASP  67           HB1      ASP  67  -2.604  -1.634  -3.850
  470    H    LYS  68           HN       LYS  68  -5.474  -1.029  -1.643
  471    HA   LYS  68           HA       LYS  68  -4.717   1.769  -1.143
  472    HB2  LYS  68           HB2      LYS  68  -7.085   1.284  -0.810
  473    HB3  LYS  68           HB1      LYS  68  -6.682  -0.006   0.314
  474    HG2  LYS  68           HG2      LYS  68  -5.723   1.619   1.856
  475    HG3  LYS  68           HG1      LYS  68  -6.093   2.919   0.722
  476    HD2  LYS  68           HD2      LYS  68  -8.475   2.428   0.924
  477    HD3  LYS  68           HD1      LYS  68  -8.117   1.105   2.034
  478    HE2  LYS  68           HE2      LYS  68  -7.145   2.688   3.616
  479    HE3  LYS  68           HE1      LYS  68  -7.471   4.014   2.502
  480    HZ1  LYS  68           HZ3      LYS  68  -9.521   2.283   3.776
  481    HZ2  LYS  68           HZ1      LYS  68  -9.835   3.558   2.710
  482    HZ3  LYS  68           HZ2      LYS  68  -9.153   3.871   4.226
  483    H    ILE  69           HN       ILE  69  -3.133   2.243   0.225
  484    HA   ILE  69           HA       ILE  69  -1.856   0.062   1.694
  485    HB   ILE  69           HB       ILE  69  -0.890   2.900   1.317
  486   HG12  ILE  69          HG12      ILE  69  -1.079   1.758  -0.842
  487   HG13  ILE  69          HG11      ILE  69   0.610   1.977  -0.401
  488   HG21  ILE  69          HG21      ILE  69   0.083   1.813   3.251
  489   HG22  ILE  69          HG22      ILE  69   1.290   1.978   1.977
  490   HG23  ILE  69          HG23      ILE  69   0.527   0.415   2.271
  491   HD11  ILE  69          HD13      ILE  69  -0.971  -0.572  -0.140
  492   HD12  ILE  69          HD11      ILE  69   0.721  -0.357   0.314
  493   HD13  ILE  69          HD12      ILE  69   0.236  -0.208  -1.375
  494    H    LEU  70           HN       LEU  70  -1.589   0.050   3.901
  495    HA   LEU  70           HA       LEU  70  -3.171   2.045   5.378
  496    HG   LEU  70           HG       LEU  70  -4.124  -0.754   4.356
  497    HB2  LEU  70           HB2      LEU  70  -2.455  -0.765   6.215
  498    HB3  LEU  70           HB1      LEU  70  -3.487   0.347   7.094
  499   HD11  LEU  70          HD11      LEU  70  -5.759  -2.162   5.514
  500   HD12  LEU  70          HD12      LEU  70  -5.142  -1.593   7.065
  501   HD13  LEU  70          HD13      LEU  70  -4.107  -2.542   5.999
  502   HD21  LEU  70          HD23      LEU  70  -6.360   0.116   4.801
  503   HD22  LEU  70          HD21      LEU  70  -5.160   1.406   4.831
  504   HD23  LEU  70          HD22      LEU  70  -5.807   0.768   6.342
  505    H    ARG  71           HN       ARG  71  -0.634  -0.263   6.337
  506    HA   ARG  71           HA       ARG  71   1.078   1.941   7.156
  507    HE   ARG  71           HE       ARG  71  -1.703   1.218  10.456
  508    HB2  ARG  71           HB2      ARG  71   1.347   0.973   9.440
  509    HB3  ARG  71           HB1      ARG  71  -0.250   1.641   9.131
  510    HG2  ARG  71           HG2      ARG  71  -1.103  -0.619   8.716
  511    HG3  ARG  71           HG1      ARG  71   0.497  -1.275   9.065
  512    HD2  ARG  71           HD2      ARG  71  -0.939  -1.470  11.012
  513    HD3  ARG  71           HD1      ARG  71   0.374  -0.337  11.329
  514   HH11  ARG  71          HH11      ARG  71  -1.229  -1.077  13.034
  515   HH12  ARG  71          HH12      ARG  71  -2.359  -0.309  14.100
  516   HH21  ARG  71          HH21      ARG  71  -3.194   2.235  11.851
  517   HH22  ARG  71          HH22      ARG  71  -3.476   1.572  13.427
  518    H    VAL  72           HN       VAL  72   3.192   1.494   7.061
  519    HA   VAL  72           HA       VAL  72   4.010  -1.055   5.963
  520    HB   VAL  72           HB       VAL  72   5.853   1.215   6.696
  521   HG11  VAL  72          HG11      VAL  72   7.033  -0.731   6.034
  522   HG12  VAL  72          HG12      VAL  72   7.059   0.365   4.652
  523   HG13  VAL  72          HG13      VAL  72   5.950  -1.007   4.669
  524   HG21  VAL  72          HG23      VAL  72   3.998   2.167   5.422
  525   HG22  VAL  72          HG21      VAL  72   4.244   0.963   4.158
  526   HG23  VAL  72          HG22      VAL  72   5.489   2.170   4.482
  527    H    ASP  73           HN       ASP  73   6.253  -1.857   6.902
  528    HA   ASP  73           HA       ASP  73   5.892  -3.107   9.279
  529    HB2  ASP  73           HB2      ASP  73   7.807  -3.313   7.559
  530    HB3  ASP  73           HB1      ASP  73   8.623  -2.098   8.535
  531    H    ASP  74           HN       ASP  74   5.288  -2.243  11.157
  532    HA   ASP  74           HA       ASP  74   5.200  -0.941  13.017
  533    HB2  ASP  74           HB2      ASP  74   8.164  -0.801  12.459
  534    HB3  ASP  74           HB1      ASP  74   7.412  -0.276  13.961
  535    H    VAL  75           HN       VAL  75   4.849   0.447  10.419
  536    HA   VAL  75           HA       VAL  75   5.110   3.157  11.448
  537    HB   VAL  75           HB       VAL  75   6.222   2.394   8.739
  538   HG11  VAL  75          HG11      VAL  75   5.099   4.538   8.645
  539   HG12  VAL  75          HG12      VAL  75   6.846   4.771   8.570
  540   HG13  VAL  75          HG13      VAL  75   5.978   5.088  10.071
  541   HG21  VAL  75          HG23      VAL  75   7.611   3.430  11.208
  542   HG22  VAL  75          HG21      VAL  75   8.367   3.192   9.632
  543   HG23  VAL  75          HG22      VAL  75   7.751   1.806  10.534
  544    H    ASN  76           HN       ASN  76   3.490   4.502  10.769
  545    HA   ASN  76           HA       ASN  76   1.420   3.287   9.080
  546    HB2  ASN  76           HB2      ASN  76   1.240   5.726  10.865
  547    HB3  ASN  76           HB1      ASN  76  -0.101   4.932  10.045
  548   HD21  ASN  76          HD21      ASN  76   2.168   4.764  12.662
  549   HD22  ASN  76          HD22      ASN  76   1.396   3.478  13.520
  550    H    VAL  77           HN       VAL  77   0.660   4.298   7.211
  551    HA   VAL  77           HA       VAL  77   2.193   6.680   6.375
  552    HB   VAL  77           HB       VAL  77   2.015   5.847   4.038
  553   HG11  VAL  77          HG11      VAL  77   3.797   4.180   4.247
  554   HG12  VAL  77          HG12      VAL  77   3.454   4.033   5.971
  555   HG13  VAL  77          HG13      VAL  77   4.065   5.555   5.320
  556   HG21  VAL  77          HG23      VAL  77   1.502   3.474   3.676
  557   HG22  VAL  77          HG21      VAL  77   0.114   4.359   4.307
  558   HG23  VAL  77          HG22      VAL  77   1.056   3.318   5.376
  559    H    GLN  78           HN       GLN  78  -0.890   5.293   6.813
  560    HA   GLN  78           HA       GLN  78  -2.214   7.083   4.951
  561    HB2  GLN  78           HB2      GLN  78  -4.287   6.034   5.752
  562    HB3  GLN  78           HB1      GLN  78  -3.114   4.842   5.209
  563    HG2  GLN  78           HG2      GLN  78  -2.460   4.535   7.608
  564    HG3  GLN  78           HG1      GLN  78  -3.834   5.550   8.041
  565   HE21  GLN  78          HE21      GLN  78  -5.534   4.517   5.910
  566   HE22  GLN  78          HE22      GLN  78  -6.001   2.930   6.391
  567    H    GLY  79           HN       GLY  79  -0.651   8.111   7.255
  568    HA2  GLY  79           HA2      GLY  79  -2.758   9.854   8.325
  569    HA3  GLY  79           HA1      GLY  79  -1.676   9.048   9.452
  570    H    MET  80           HN       MET  80   0.081   9.646   6.728
  571    HA   MET  80           HA       MET  80   0.955  12.284   7.706
  572    HB2  MET  80           HB2      MET  80   2.739  10.115   6.587
  573    HB3  MET  80           HB1      MET  80   3.256  11.686   7.184
  574    HG2  MET  80           HG2      MET  80   2.464  11.078   9.425
  575    HG3  MET  80           HG1      MET  80   2.008   9.488   8.815
  576    HE1  MET  80           HE3      MET  80   4.697   9.009   6.762
  577    HE2  MET  80           HE1      MET  80   3.669   7.888   7.656
  578    HE3  MET  80           HE2      MET  80   5.414   7.878   7.912
  579    H    ALA  81           HN       ALA  81   2.388  13.388   5.976
  580    HA   ALA  81           HA       ALA  81   0.787  13.725   3.654
  581    HB1  ALA  81           HB3      ALA  81   2.427  15.362   2.967
  582    HB2  ALA  81           HB1      ALA  81   3.572  14.762   4.167
  583    HB3  ALA  81           HB2      ALA  81   2.084  15.551   4.686
  584    H    GLN  82           HN       GLN  82   1.819  13.713   1.414
  585    HA   GLN  82           HA       GLN  82   2.459  11.087   0.708
  586    HB2  GLN  82           HB2      GLN  82   1.472  12.723  -0.846
  587    HB3  GLN  82           HB1      GLN  82   2.983  13.621  -0.856
  588    HG2  GLN  82           HG2      GLN  82   4.127  11.778  -1.900
  589    HG3  GLN  82           HG1      GLN  82   2.683  10.775  -1.783
  590   HE21  GLN  82          HE21      GLN  82   2.579  10.440  -3.990
  591   HE22  GLN  82          HE22      GLN  82   2.104  11.679  -5.095
  592    H    SER  83           HN       SER  83   4.556  13.937   1.021
  593    HA   SER  83           HA       SER  83   6.956  12.797   0.220
  594    HG   SER  83           HG       SER  83   5.736  15.224   0.060
  595    HB2  SER  83           HB2      SER  83   6.511  14.916   2.335
  596    HB3  SER  83           HB1      SER  83   8.050  14.573   1.544
  597    H    ASP  84           HN       ASP  84   5.260  12.532   3.270
  598    HA   ASP  84           HA       ASP  84   7.441  11.434   4.742
  599    HB2  ASP  84           HB2      ASP  84   4.459  11.358   5.238
  600    HB3  ASP  84           HB1      ASP  84   5.666  10.768   6.377
  601    H    VAL  85           HN       VAL  85   4.760  10.059   2.904
  602    HA   VAL  85           HA       VAL  85   5.223   7.362   3.649
  603    HB   VAL  85           HB       VAL  85   3.928   8.395   1.122
  604   HG11  VAL  85          HG11      VAL  85   2.764   6.230   1.122
  605   HG12  VAL  85          HG12      VAL  85   3.722   5.729   2.515
  606   HG13  VAL  85          HG13      VAL  85   4.512   6.046   0.972
  607   HG21  VAL  85          HG23      VAL  85   2.690   7.720   3.789
  608   HG22  VAL  85          HG21      VAL  85   1.809   8.153   2.325
  609   HG23  VAL  85          HG22      VAL  85   2.862   9.335   3.101
  610    H    VAL  86           HN       VAL  86   6.460   9.412   1.077
  611    HA   VAL  86           HA       VAL  86   7.696   7.333  -0.415
  612    HB   VAL  86           HB       VAL  86   8.363  10.279  -0.389
  613   HG11  VAL  86          HG11      VAL  86   9.298   9.864  -2.613
  614   HG12  VAL  86          HG12      VAL  86   8.952   8.144  -2.436
  615   HG13  VAL  86          HG13      VAL  86  10.130   8.920  -1.378
  616   HG21  VAL  86          HG23      VAL  86   6.529   8.755  -2.234
  617   HG22  VAL  86          HG21      VAL  86   6.872  10.484  -2.277
  618   HG23  VAL  86          HG22      VAL  86   5.994   9.792  -0.912
  619    H    GLU  87           HN       GLU  87   8.957   9.678   1.960
  620    HA   GLU  87           HA       GLU  87  11.636   8.897   1.812
  621    HB2  GLU  87           HB2      GLU  87  11.935   9.982   3.966
  622    HB3  GLU  87           HB1      GLU  87  10.893  10.952   2.935
  623    HG2  GLU  87           HG2      GLU  87   8.942  10.200   4.134
  624    HG3  GLU  87           HG1      GLU  87   9.927   9.115   5.112
  625    H    VAL  88           HN       VAL  88   8.989   7.628   3.797
  626    HA   VAL  88           HA       VAL  88  10.498   5.907   5.414
  627    HB   VAL  88           HB       VAL  88   7.642   5.699   4.457
  628   HG11  VAL  88          HG11      VAL  88   8.407   3.455   4.954
  629   HG12  VAL  88          HG12      VAL  88   7.322   4.013   6.230
  630   HG13  VAL  88          HG13      VAL  88   9.065   3.993   6.501
  631   HG21  VAL  88          HG23      VAL  88   7.088   6.451   6.688
  632   HG22  VAL  88          HG21      VAL  88   8.208   7.589   5.938
  633   HG23  VAL  88          HG22      VAL  88   8.792   6.444   7.144
  634    H    LEU  89           HN       LEU  89   8.716   5.162   2.417
  635    HA   LEU  89           HA       LEU  89   9.494   2.502   2.189
  636    HG   LEU  89           HG       LEU  89   7.032   4.226   1.603
  637    HB2  LEU  89           HB2      LEU  89   8.919   4.462  -0.035
  638    HB3  LEU  89           HB1      LEU  89   8.929   2.715  -0.194
  639   HD11  LEU  89          HD11      LEU  89   5.335   3.802  -0.094
  640   HD12  LEU  89          HD12      LEU  89   6.558   3.098  -1.152
  641   HD13  LEU  89          HD13      LEU  89   6.633   4.810  -0.732
  642   HD21  LEU  89          HD23      LEU  89   5.808   2.112   1.647
  643   HD22  LEU  89          HD21      LEU  89   7.442   1.922   2.280
  644   HD23  LEU  89          HD22      LEU  89   7.059   1.365   0.651
  645    H    ARG  90           HN       ARG  90  11.238   5.421   1.466
  646    HA   ARG  90           HA       ARG  90  13.306   4.011  -0.013
  647    HE   ARG  90           HE       ARG  90  11.618   8.541  -0.187
  648    HB2  ARG  90           HB2      ARG  90  13.022   6.912   0.776
  649    HB3  ARG  90           HB1      ARG  90  14.365   6.269  -0.160
  650    HG2  ARG  90           HG2      ARG  90  12.839   5.609  -1.932
  651    HG3  ARG  90           HG1      ARG  90  11.470   6.198  -0.988
  652    HD2  ARG  90           HD2      ARG  90  13.770   7.863  -2.008
  653    HD3  ARG  90           HD1      ARG  90  12.144   7.818  -2.689
  654   HH11  ARG  90          HH11      ARG  90  14.062   9.685  -2.394
  655   HH12  ARG  90          HH12      ARG  90  14.084  11.289  -1.739
  656   HH21  ARG  90          HH21      ARG  90  11.641  10.647   0.680
  657   HH22  ARG  90          HH22      ARG  90  12.712  11.834   0.013
  658    H    ASN  91           HN       ASN  91  12.624   4.807   3.217
  659    HA   ASN  91           HA       ASN  91  15.427   4.800   4.026
  660    HB2  ASN  91           HB2      ASN  91  12.859   5.262   5.545
  661    HB3  ASN  91           HB1      ASN  91  14.425   5.131   6.340
  662   HD21  ASN  91          HD21      ASN  91  12.605   7.377   6.255
  663   HD22  ASN  91          HD22      ASN  91  13.480   8.691   5.553
  664    H    ALA  92           HN       ALA  92  12.964   2.589   3.505
  665    HA   ALA  92           HA       ALA  92  13.085   0.746   5.529
  666    HB1  ALA  92           HB3      ALA  92  11.589   0.541   3.621
  667    HB2  ALA  92           HB1      ALA  92  12.497  -0.951   3.867
  668    HB3  ALA  92           HB2      ALA  92  12.956   0.158   2.574
  669    H    GLY  93           HN       GLY  93  14.771  -0.201   2.567
  670    HA2  GLY  93           HA2      GLY  93  16.818  -1.192   2.232
  671    HA3  GLY  93           HA1      GLY  93  17.387  -0.252   3.603
  672    H    ASN  94           HN       ASN  94  14.732  -2.251   4.296
  673    HA   ASN  94           HA       ASN  94  16.366  -4.528   5.111
  674    HB2  ASN  94           HB2      ASN  94  15.635  -4.433   7.422
  675    HB3  ASN  94           HB1      ASN  94  16.387  -2.893   7.010
  676   HD21  ASN  94          HD21      ASN  94  13.324  -4.542   7.449
  677   HD22  ASN  94          HD22      ASN  94  12.395  -3.127   7.784
  678    HA   PRO  95           HA       PRO  95  12.701  -6.912   4.297
  679    HB2  PRO  95           HB2      PRO  95  12.783  -8.190   6.958
  680    HB3  PRO  95           HB1      PRO  95  12.931  -8.922   5.358
  681    HG2  PRO  95           HG2      PRO  95  15.044  -8.697   6.985
  682    HG3  PRO  95           HG1      PRO  95  15.201  -8.504   5.229
  683    HD2  PRO  95           HD2      PRO  95  15.095  -6.406   7.365
  684    HD3  PRO  95           HD1      PRO  95  16.124  -6.489   5.919
  685    H    VAL  96           HN       VAL  96  11.208  -5.192   4.346
  686    HA   VAL  96           HA       VAL  96   9.853  -4.669   6.893
  687    HB   VAL  96           HB       VAL  96   8.825  -2.753   5.769
  688   HG11  VAL  96          HG11      VAL  96  10.843  -1.401   5.467
  689   HG12  VAL  96          HG12      VAL  96  11.815  -2.871   5.394
  690   HG13  VAL  96          HG13      VAL  96  10.971  -2.446   6.883
  691   HG21  VAL  96          HG23      VAL  96   9.556  -2.114   3.502
  692   HG22  VAL  96          HG21      VAL  96   8.661  -3.635   3.517
  693   HG23  VAL  96          HG22      VAL  96  10.418  -3.647   3.368
  694    H    ARG  97           HN       ARG  97   7.567  -4.689   7.031
  695    HA   ARG  97           HA       ARG  97   6.309  -6.609   5.209
  696    HE   ARG  97           HE       ARG  97   3.548  -5.638   8.822
  697    HB2  ARG  97           HB2      ARG  97   6.331  -7.163   7.632
  698    HB3  ARG  97           HB1      ARG  97   5.412  -5.697   7.953
  699    HG2  ARG  97           HG2      ARG  97   3.610  -6.601   6.477
  700    HG3  ARG  97           HG1      ARG  97   4.514  -8.115   6.405
  701    HD2  ARG  97           HD2      ARG  97   2.769  -8.215   8.105
  702    HD3  ARG  97           HD1      ARG  97   4.371  -8.323   8.833
  703   HH11  ARG  97          HH11      ARG  97   2.781  -8.669  10.364
  704   HH12  ARG  97          HH12      ARG  97   2.199  -7.929  11.818
  705   HH21  ARG  97          HH21      ARG  97   2.782  -4.656  10.732
  706   HH22  ARG  97          HH22      ARG  97   2.199  -5.648  12.027
  707    H    LEU  98           HN       LEU  98   4.506  -6.086   4.065
  708    HA   LEU  98           HA       LEU  98   3.689  -3.264   4.168
  709    HG   LEU  98           HG       LEU  98   5.721  -4.753   2.223
  710    HB2  LEU  98           HB2      LEU  98   3.299  -5.232   1.919
  711    HB3  LEU  98           HB1      LEU  98   2.993  -3.507   1.869
  712   HD11  LEU  98          HD11      LEU  98   4.431  -3.541  -0.219
  713   HD12  LEU  98          HD12      LEU  98   4.842  -5.241   0.014
  714   HD13  LEU  98          HD13      LEU  98   6.120  -4.030  -0.087
  715   HD21  LEU  98          HD23      LEU  98   6.513  -2.470   1.720
  716   HD22  LEU  98          HD21      LEU  98   5.587  -2.556   3.219
  717   HD23  LEU  98          HD22      LEU  98   4.843  -1.905   1.758
  718    H    LEU  99           HN       LEU  99   1.890  -3.012   5.351
  719    HA   LEU  99           HA       LEU  99  -0.179  -5.087   5.229
  720    HG   LEU  99           HG       LEU  99  -2.270  -3.745   6.935
  721    HB2  LEU  99           HB2      LEU  99   0.657  -4.286   7.452
  722    HB3  LEU  99           HB1      LEU  99  -0.016  -2.710   7.082
  723   HD11  LEU  99          HD11      LEU  99  -0.836  -6.197   7.948
  724   HD12  LEU  99          HD12      LEU  99  -1.604  -6.013   6.371
  725   HD13  LEU  99          HD13      LEU  99  -2.586  -6.001   7.836
  726   HD21  LEU  99          HD23      LEU  99  -2.522  -4.120   9.367
  727   HD22  LEU  99          HD21      LEU  99  -1.604  -2.664   8.982
  728   HD23  LEU  99          HD22      LEU  99  -0.764  -4.118   9.520
  729    H    LEU 100           HN       LEU 100  -1.373  -4.735   3.443
  730    HA   LEU 100           HA       LEU 100  -2.662  -2.104   3.204
  731    HG   LEU 100           HG       LEU 100  -0.196  -4.185   1.665
  732    HB2  LEU 100           HB2      LEU 100  -2.628  -2.714   0.650
  733    HB3  LEU 100           HB1      LEU 100  -1.267  -1.913   1.410
  734   HD11  LEU 100          HD11      LEU 100  -1.002  -5.985   0.253
  735   HD12  LEU 100          HD12      LEU 100  -2.381  -5.004  -0.243
  736   HD13  LEU 100          HD13      LEU 100  -2.228  -5.528   1.433
  737   HD21  LEU 100          HD23      LEU 100   0.479  -2.620  -0.072
  738   HD22  LEU 100          HD21      LEU 100  -0.793  -3.228  -1.131
  739   HD23  LEU 100          HD22      LEU 100   0.542  -4.281  -0.661
  740    H    ILE 101           HN       ILE 101  -4.686  -2.148   1.960
  741    HA   ILE 101           HA       ILE 101  -6.094  -4.708   2.327
  742    HB   ILE 101           HB       ILE 101  -6.965  -3.012   3.822
  743   HG12  ILE 101          HG12      ILE 101  -8.881  -3.384   1.508
  744   HG13  ILE 101          HG11      ILE 101  -8.542  -4.612   2.724
  745   HG21  ILE 101          HG21      ILE 101  -7.945  -0.936   2.993
  746   HG22  ILE 101          HG22      ILE 101  -7.446  -1.351   1.353
  747   HG23  ILE 101          HG23      ILE 101  -6.231  -1.040   2.592
  748   HD11  ILE 101          HD13      ILE 101  -9.415  -3.122   4.455
  749   HD12  ILE 101          HD11      ILE 101 -10.614  -3.459   3.207
  750   HD13  ILE 101          HD12      ILE 101  -9.770  -1.910   3.224
  751    H    ARG 102           HN       ARG 102  -7.181  -5.577   0.656
  752    HA   ARG 102           HA       ARG 102  -7.304  -4.020  -1.843
  753    HE   ARG 102           HE       ARG 102  -6.958  -6.116  -6.137
  754    HB2  ARG 102           HB2      ARG 102  -5.589  -5.740  -2.024
  755    HB3  ARG 102           HB1      ARG 102  -6.736  -6.969  -1.513
  756    HG2  ARG 102           HG2      ARG 102  -6.385  -7.054  -3.909
  757    HG3  ARG 102           HG1      ARG 102  -8.049  -6.599  -3.536
  758    HD2  ARG 102           HD2      ARG 102  -7.501  -4.253  -3.943
  759    HD3  ARG 102           HD1      ARG 102  -5.831  -4.697  -4.291
  760   HH11  ARG 102          HH11      ARG 102  -8.012  -2.981  -5.040
  761   HH12  ARG 102          HH12      ARG 102  -8.712  -2.542  -6.562
  762   HH21  ARG 102          HH21      ARG 102  -7.873  -5.545  -8.144
  763   HH22  ARG 102          HH22      ARG 102  -8.632  -3.999  -8.326
  764    H    ARG 103           HN       ARG 103  -9.216  -3.953  -2.873
  765    HA   ARG 103           HA       ARG 103 -11.478  -5.221  -1.558
  766    HE   ARG 103           HE       ARG 103 -10.722  -1.402  -6.149
  767    HB2  ARG 103           HB2      ARG 103 -12.851  -3.786  -3.017
  768    HB3  ARG 103           HB1      ARG 103 -11.671  -2.858  -2.099
  769    HG2  ARG 103           HG2      ARG 103 -10.240  -2.700  -4.053
  770    HG3  ARG 103           HG1      ARG 103 -11.373  -3.687  -4.980
  771    HD2  ARG 103           HD2      ARG 103 -13.106  -1.969  -4.642
  772    HD3  ARG 103           HD1      ARG 103 -11.933  -0.978  -3.775
  773   HH11  ARG 103          HH11      ARG 103 -13.906  -0.284  -5.280
  774   HH12  ARG 103          HH12      ARG 103 -14.080   0.714  -6.684
  775   HH21  ARG 103          HH21      ARG 103 -10.944  -0.083  -8.002
  776   HH22  ARG 103          HH22      ARG 103 -12.397   0.830  -8.229
  777    H    LEU 104           HN       LEU 104 -12.678  -6.833  -2.374
  778    HA   LEU 104           HA       LEU 104 -11.798  -8.011  -4.912
  779    HG   LEU 104           HG       LEU 104 -11.213  -8.814  -1.885
  780    HB2  LEU 104           HB2      LEU 104 -13.500  -9.250  -2.748
  781    HB3  LEU 104           HB1      LEU 104 -12.796 -10.073  -4.128
  782   HD11  LEU 104          HD11      LEU 104 -12.479 -10.749  -1.112
  783   HD12  LEU 104          HD12      LEU 104 -10.754 -11.107  -1.184
  784   HD13  LEU 104          HD13      LEU 104 -11.833 -11.712  -2.440
  785   HD21  LEU 104          HD23      LEU 104 -10.367 -10.555  -4.198
  786   HD22  LEU 104          HD21      LEU 104  -9.327 -10.034  -2.872
  787   HD23  LEU 104          HD22      LEU 104  -9.996  -8.844  -3.988
  788    HA   PRO 105           HA       PRO 105 -15.689  -6.956  -6.753
  789    HB2  PRO 105           HB2      PRO 105 -15.746  -8.623  -8.842
  790    HB3  PRO 105           HB1      PRO 105 -14.536  -7.336  -8.729
  791    HG2  PRO 105           HG2      PRO 105 -14.260 -10.254  -8.137
  792    HG3  PRO 105           HG1      PRO 105 -13.136  -9.172  -8.978
  793    HD2  PRO 105           HD2      PRO 105 -12.909  -9.908  -6.331
  794    HD3  PRO 105           HD1      PRO 105 -12.214  -8.429  -7.022
  795    H    LEU 106           HN       LEU 106 -17.814  -7.768  -7.250
  796    HA   LEU 106           HA       LEU 106 -18.490 -10.138  -5.653
  797    HG   LEU 106           HG       LEU 106 -20.600  -7.628  -3.992
  798    HB2  LEU 106           HB2      LEU 106 -20.020  -7.668  -6.385
  799    HB3  LEU 106           HB1      LEU 106 -20.856  -9.119  -5.864
  800   HD11  LEU 106          HD11      LEU 106 -20.428 -10.028  -3.554
  801   HD12  LEU 106          HD12      LEU 106 -19.472  -9.080  -2.413
  802   HD13  LEU 106          HD13      LEU 106 -18.677  -9.929  -3.738
  803   HD21  LEU 106          HD23      LEU 106 -18.409  -6.955  -3.150
  804   HD22  LEU 106          HD21      LEU 106 -18.683  -6.350  -4.783
  805   HD23  LEU 106          HD22      LEU 106 -17.637  -7.745  -4.525
  806    H    LEU 107           HN       LEU 107 -19.648 -11.810  -6.485
  807    HA   LEU 107           HA       LEU 107 -20.023 -11.796  -9.397
  808    HG   LEU 107           HG       LEU 107 -17.559 -12.988  -8.166
  809    HB2  LEU 107           HB2      LEU 107 -19.671 -14.057  -7.438
  810    HB3  LEU 107           HB1      LEU 107 -20.107 -14.299  -9.119
  811   HD11  LEU 107          HD11      LEU 107 -16.478 -15.043  -8.966
  812   HD12  LEU 107          HD12      LEU 107 -18.068 -15.746  -9.263
  813   HD13  LEU 107          HD13      LEU 107 -17.574 -15.344  -7.618
  814   HD21  LEU 107          HD23      LEU 107 -16.871 -13.217 -10.518
  815   HD22  LEU 107          HD21      LEU 107 -18.262 -12.149 -10.329
  816   HD23  LEU 107          HD22      LEU 107 -18.487 -13.795 -10.920
  817    H    GLU 108           HN       GLU 108 -22.042 -10.928  -9.625
  818    HA   GLU 108           HA       GLU 108 -24.311 -10.820  -9.666
  819    HB2  GLU 108           HB2      GLU 108 -24.102 -13.756  -8.973
  820    HB3  GLU 108           HB1      GLU 108 -25.545 -12.950  -9.571
  821    HG2  GLU 108           HG2      GLU 108 -22.945 -13.263 -11.053
  822    HG3  GLU 108           HG1      GLU 108 -24.428 -14.173 -11.340
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1  -6.554 -14.682  12.908
    2    H2   GLY   1           HT2      GLY   1  -7.846 -15.559  12.257
    3    H3   GLY   1           HT3      GLY   1  -6.376 -16.333  12.575
    4    HA2  GLY   1           HA1      GLY   1  -7.997 -16.893  14.265
    5    HA3  GLY   1           HA2      GLY   1  -6.654 -15.985  14.942
    6    H    SER   2           HN       SER   2  -6.997 -13.574  15.050
    7    HA   SER   2           HA       SER   2  -9.578 -13.096  16.276
    8    HG   SER   2           HG       SER   2  -7.506 -11.944  18.498
    9    HB2  SER   2           HB2      SER   2  -7.146 -11.309  16.036
   10    HB3  SER   2           HB1      SER   2  -8.587 -10.947  16.987
   11    H    HIS   3           HN       HIS   3  -7.598 -11.361  13.865
   12    HA   HIS   3           HA       HIS   3  -9.932  -9.934  12.917
   13    HD1  HIS   3           HD1      HIS   3  -6.100  -9.326  14.328
   14    HD2  HIS   3           HD2      HIS   3  -9.133  -6.764  13.095
   15    HE1  HIS   3           HE1      HIS   3  -6.048  -7.394  15.937
   16    HE2  HIS   3           HE2      HIS   3  -7.871  -5.843  15.156
   17    HB2  HIS   3           HB2      HIS   3  -7.048  -9.880  12.006
   18    HB3  HIS   3           HB1      HIS   3  -8.317  -8.838  11.372
   19    H    GLY   4           HN       GLY   4 -11.304 -11.069  11.686
   20    HA2  GLY   4           HA2      GLY   4 -10.278 -13.046   9.798
   21    HA3  GLY   4           HA1      GLY   4 -11.965 -12.789  10.221
   22    H    TYR   5           HN       TYR   5 -13.099 -11.032   9.259
   23    HA   TYR   5           HA       TYR   5 -13.775  -9.809   7.469
   24    HD1  TYR   5           HD2      TYR   5 -10.808  -8.932   9.897
   25    HD2  TYR   5           HD1      TYR   5 -13.564  -6.662   7.583
   26    HE1  TYR   5           HE2      TYR   5 -11.230  -7.482  11.836
   27    HE2  TYR   5           HE1      TYR   5 -13.994  -5.205   9.518
   28    HH   TYR   5           HH       TYR   5 -13.821  -5.315  11.982
   29    HB2  TYR   5           HB2      TYR   5 -10.843  -9.065   7.425
   30    HB3  TYR   5           HB1      TYR   5 -12.102  -8.234   6.518
   31    H    SER   6           HN       SER   6 -12.943 -12.573   7.018
   32    HA   SER   6           HA       SER   6 -11.542 -12.751   4.549
   33    HG   SER   6           HG       SER   6 -11.397 -15.763   4.365
   34    HB2  SER   6           HB2      SER   6 -11.647 -14.642   6.112
   35    HB3  SER   6           HB1      SER   6 -13.391 -14.748   5.877
   36    H    ASP   7           HN       ASP   7 -12.412 -11.572   2.917
   37    HA   ASP   7           HA       ASP   7 -13.828 -10.951   1.250
   38    HB2  ASP   7           HB2      ASP   7 -15.052 -13.661   1.814
   39    HB3  ASP   7           HB1      ASP   7 -15.374 -12.681   0.387
   40    H    ALA   8           HN       ALA   8 -14.559  -9.351   2.915
   41    HA   ALA   8           HA       ALA   8 -17.411  -9.765   3.544
   42    HB1  ALA   8           HB3      ALA   8 -15.432  -8.090   5.085
   43    HB2  ALA   8           HB1      ALA   8 -16.020  -9.683   5.562
   44    HB3  ALA   8           HB2      ALA   8 -17.137  -8.320   5.477
   45    H    SER   9           HN       SER   9 -18.560  -8.670   2.096
   46    HA   SER   9           HA       SER   9 -19.350  -7.004   0.771
   47    HG   SER   9           HG       SER   9 -20.650  -5.422   2.846
   48    HB2  SER   9           HB2      SER   9 -17.922  -5.273   2.801
   49    HB3  SER   9           HB1      SER   9 -19.101  -4.690   1.626
   50    H    GLY  10           HN       GLY  10 -16.522  -8.087   0.404
   51    HA2  GLY  10           HA2      GLY  10 -15.075  -7.838  -1.399
   52    HA3  GLY  10           HA1      GLY  10 -15.849  -6.307  -1.775
   53    H    PHE  11           HN       PHE  11 -14.577  -7.066   1.399
   54    HA   PHE  11           HA       PHE  11 -12.195  -5.444   0.892
   55    HD1  PHE  11           HD1      PHE  11 -15.881  -4.126   1.381
   56    HD2  PHE  11           HD2      PHE  11 -11.960  -2.476   1.505
   57    HE1  PHE  11           HE1      PHE  11 -16.623  -2.265  -0.050
   58    HE2  PHE  11           HE2      PHE  11 -12.694  -0.614   0.077
   59    HZ   PHE  11           HZ       PHE  11 -15.030  -0.505  -0.701
   60    HB2  PHE  11           HB2      PHE  11 -14.258  -4.867   3.023
   61    HB3  PHE  11           HB1      PHE  11 -12.628  -4.202   3.051
   62    H    SER  12           HN       SER  12 -10.538  -6.648   1.503
   63    HA   SER  12           HA       SER  12 -10.657  -8.033   4.079
   64    HG   SER  12           HG       SER  12  -9.423 -11.145   2.823
   65    HB2  SER  12           HB2      SER  12 -11.211  -9.729   2.395
   66    HB3  SER  12           HB1      SER  12  -9.747  -9.329   1.497
   67    H    LEU  13           HN       LEU  13  -8.801  -7.935   5.225
   68    HA   LEU  13           HA       LEU  13  -6.725  -6.193   4.300
   69    HG   LEU  13           HG       LEU  13  -8.717  -6.347   6.757
   70    HB2  LEU  13           HB2      LEU  13  -6.781  -7.907   6.786
   71    HB3  LEU  13           HB1      LEU  13  -5.717  -6.546   6.481
   72   HD11  LEU  13          HD11      LEU  13  -6.530  -5.632   8.708
   73   HD12  LEU  13          HD12      LEU  13  -7.654  -6.982   8.863
   74   HD13  LEU  13          HD13      LEU  13  -8.253  -5.325   8.923
   75   HD21  LEU  13          HD23      LEU  13  -7.894  -4.591   5.365
   76   HD22  LEU  13          HD21      LEU  13  -6.540  -4.289   6.455
   77   HD23  LEU  13          HD22      LEU  13  -8.186  -3.913   6.967
   78    H    TYR  14           HN       TYR  14  -5.027  -6.747   3.128
   79    HA   TYR  14           HA       TYR  14  -4.139  -9.555   3.180
   80    HD1  TYR  14           HD2      TYR  14  -3.944 -11.209   0.696
   81    HD2  TYR  14           HD1      TYR  14  -6.640  -7.913   0.709
   82    HE1  TYR  14           HE2      TYR  14  -5.725 -12.666  -0.166
   83    HE2  TYR  14           HE1      TYR  14  -8.427  -9.364  -0.152
   84    HH   TYR  14           HH       TYR  14  -8.219 -12.723  -0.176
   85    HB2  TYR  14           HB2      TYR  14  -4.282  -7.547   0.955
   86    HB3  TYR  14           HB1      TYR  14  -3.136  -8.881   0.872
   87    H    SER  15           HN       SER  15  -2.191  -9.942   3.971
   88    HA   SER  15           HA       SER  15  -0.338  -7.691   4.322
   89    HG   SER  15           HG       SER  15   1.027  -8.322   6.796
   90    HB2  SER  15           HB2      SER  15  -0.963  -8.882   6.376
   91    HB3  SER  15           HB1      SER  15  -0.390 -10.397   5.680
   92    H    VAL  16           HN       VAL  16   1.762  -7.771   3.593
   93    HA   VAL  16           HA       VAL  16   2.591 -10.139   2.066
   94    HB   VAL  16           HB       VAL  16   3.062  -7.361   1.001
   95   HG11  VAL  16          HG11      VAL  16   3.427  -8.565  -1.110
   96   HG12  VAL  16          HG12      VAL  16   3.148 -10.093  -0.272
   97   HG13  VAL  16          HG13      VAL  16   4.535  -9.091   0.158
   98   HG21  VAL  16          HG23      VAL  16   0.648  -7.669   1.126
   99   HG22  VAL  16          HG21      VAL  16   0.789  -9.209   0.281
  100   HG23  VAL  16          HG22      VAL  16   1.198  -7.707  -0.548
  101    H    GLU  17           HN       GLU  17   4.921 -10.236   1.687
  102    HA   GLU  17           HA       GLU  17   6.449  -8.648   3.644
  103    HB2  GLU  17           HB2      GLU  17   6.694 -11.571   2.949
  104    HB3  GLU  17           HB1      GLU  17   7.958 -10.689   3.795
  105    HG2  GLU  17           HG2      GLU  17   6.353 -10.146   5.578
  106    HG3  GLU  17           HG1      GLU  17   5.130 -11.099   4.741
  107    H    LEU  18           HN       LEU  18   7.773  -7.302   2.649
  108    HA   LEU  18           HA       LEU  18   9.105  -8.188   0.174
  109    HG   LEU  18           HG       LEU  18   7.271  -5.443  -1.435
  110    HB2  LEU  18           HB2      LEU  18   7.839  -5.601   0.917
  111    HB3  LEU  18           HB1      LEU  18   9.294  -5.536  -0.059
  112   HD11  LEU  18          HD11      LEU  18   9.308  -6.432  -2.356
  113   HD12  LEU  18          HD12      LEU  18   7.861  -7.193  -3.019
  114   HD13  LEU  18          HD13      LEU  18   8.802  -8.019  -1.776
  115   HD21  LEU  18          HD23      LEU  18   5.811  -6.759   0.042
  116   HD22  LEU  18          HD21      LEU  18   6.706  -8.216  -0.391
  117   HD23  LEU  18          HD22      LEU  18   5.786  -7.348  -1.619
  118    H    PHE  19           HN       PHE  19  11.202  -7.003  -0.227
  119    HA   PHE  19           HA       PHE  19  12.573  -6.103   2.172
  120    HD1  PHE  19           HD2      PHE  19  11.570  -9.726   0.736
  121    HD2  PHE  19           HD1      PHE  19  15.413  -8.236  -0.329
  122    HE1  PHE  19           HE2      PHE  19  11.627 -11.260  -1.187
  123    HE2  PHE  19           HE1      PHE  19  15.476  -9.768  -2.254
  124    HZ   PHE  19           HZ       PHE  19  13.582 -11.283  -2.685
  125    HB2  PHE  19           HB2      PHE  19  14.467  -7.702   1.776
  126    HB3  PHE  19           HB1      PHE  19  12.981  -8.463   2.333
  127    H    ARG  20           HN       ARG  20  13.936  -4.475   1.721
  128    HA   ARG  20           HA       ARG  20  14.597  -4.041  -1.120
  129    HE   ARG  20           HE       ARG  20  15.575  -0.059   1.070
  130    HB2  ARG  20           HB2      ARG  20  13.292  -2.293   0.259
  131    HB3  ARG  20           HB1      ARG  20  14.834  -1.954   1.033
  132    HG2  ARG  20           HG2      ARG  20  15.792  -1.496  -1.215
  133    HG3  ARG  20           HG1      ARG  20  14.174  -1.684  -1.890
  134    HD2  ARG  20           HD2      ARG  20  14.578   0.651  -1.577
  135    HD3  ARG  20           HD1      ARG  20  13.404   0.134  -0.366
  136   HH11  ARG  20          HH11      ARG  20  14.773   2.417  -1.249
  137   HH12  ARG  20          HH12      ARG  20  15.704   3.641  -0.453
  138   HH21  ARG  20          HH21      ARG  20  16.801   1.547   2.121
  139   HH22  ARG  20          HH22      ARG  20  16.859   3.146   1.459
  140    H    GLU  21           HN       GLU  21  16.541  -4.844  -1.586
  141    HA   GLU  21           HA       GLU  21  18.785  -4.116   0.169
  142    HB2  GLU  21           HB2      GLU  21  19.816  -6.295  -0.221
  143    HB3  GLU  21           HB1      GLU  21  18.243  -6.476   0.543
  144    HG2  GLU  21           HG2      GLU  21  17.257  -7.037  -1.621
  145    HG3  GLU  21           HG1      GLU  21  18.837  -6.861  -2.383
  146    H    LYS  22           HN       LYS  22  17.426  -3.931  -2.848
  147    HA   LYS  22           HA       LYS  22  19.853  -4.059  -4.407
  148    HB2  LYS  22           HB2      LYS  22  17.071  -3.113  -5.123
  149    HB3  LYS  22           HB1      LYS  22  18.399  -3.271  -6.264
  150    HG2  LYS  22           HG2      LYS  22  17.192  -5.526  -4.674
  151    HG3  LYS  22           HG1      LYS  22  16.850  -5.164  -6.366
  152    HD2  LYS  22           HD2      LYS  22  19.584  -5.828  -5.276
  153    HD3  LYS  22           HD1      LYS  22  18.506  -6.992  -6.046
  154    HE2  LYS  22           HE2      LYS  22  19.617  -4.496  -7.325
  155    HE3  LYS  22           HE1      LYS  22  20.186  -6.140  -7.611
  156    HZ1  LYS  22           HZ3      LYS  22  18.686  -5.405  -9.355
  157    HZ2  LYS  22           HZ1      LYS  22  17.461  -5.125  -8.220
  158    HZ3  LYS  22           HZ2      LYS  22  18.011  -6.700  -8.502
  159    H    ASP  23           HN       ASP  23  20.330  -2.141  -5.893
  160    HA   ASP  23           HA       ASP  23  20.639   0.210  -4.194
  161    HB2  ASP  23           HB2      ASP  23  21.896  -0.496  -6.854
  162    HB3  ASP  23           HB1      ASP  23  22.254   0.956  -5.925
  163    H    THR  24           HN       THR  24  18.058  -0.440  -5.408
  164    HA   THR  24           HA       THR  24  17.685   1.490  -7.534
  165    HB   THR  24           HB       THR  24  15.339   0.813  -7.505
  166    HG1  THR  24           HG1      THR  24  15.287  -1.204  -5.831
  167   HG21  THR  24          HG23      THR  24  16.948  -0.591  -8.722
  168   HG22  THR  24          HG21      THR  24  15.610  -1.542  -8.078
  169   HG23  THR  24          HG22      THR  24  17.179  -1.571  -7.274
  170    H    SER  25           HN       SER  25  17.693   1.503  -4.155
  171    HA   SER  25           HA       SER  25  17.167   3.047  -2.574
  172    HG   SER  25           HG       SER  25  17.469   6.508  -3.372
  173    HB2  SER  25           HB2      SER  25  18.489   4.528  -4.033
  174    HB3  SER  25           HB1      SER  25  17.034   4.928  -4.944
  175    H    SER  26           HN       SER  26  15.011   1.608  -4.162
  176    HA   SER  26           HA       SER  26  12.790   2.911  -2.887
  177    HG   SER  26           HG       SER  26  12.190   2.178  -6.604
  178    HB2  SER  26           HB2      SER  26  11.465   3.250  -4.941
  179    HB3  SER  26           HB1      SER  26  12.923   4.241  -4.944
  180    H    LEU  27           HN       LEU  27  10.674   1.731  -3.604
  181    HA   LEU  27           HA       LEU  27  11.280  -1.147  -3.753
  182    HG   LEU  27           HG       LEU  27  11.342  -0.289  -1.052
  183    HB2  LEU  27           HB2      LEU  27   9.217   0.377  -2.199
  184    HB3  LEU  27           HB1      LEU  27   8.959  -1.310  -2.600
  185   HD11  LEU  27          HD11      LEU  27  10.224  -1.257   0.912
  186   HD12  LEU  27          HD12      LEU  27   8.792  -1.565  -0.072
  187   HD13  LEU  27          HD13      LEU  27   9.320   0.092   0.224
  188   HD21  LEU  27          HD23      LEU  27  11.767  -2.376  -2.220
  189   HD22  LEU  27          HD21      LEU  27  10.288  -3.072  -1.556
  190   HD23  LEU  27          HD22      LEU  27  11.628  -2.666  -0.485
  191    H    GLY  28           HN       GLY  28   9.852   1.434  -5.345
  192    HA2  GLY  28           HA2      GLY  28   8.906   1.353  -7.483
  193    HA3  GLY  28           HA1      GLY  28   8.649  -0.373  -7.280
  194    H    ILE  29           HN       ILE  29   7.606   1.622  -4.694
  195    HA   ILE  29           HA       ILE  29   4.836   0.996  -5.346
  196    HB   ILE  29           HB       ILE  29   5.992   2.251  -2.851
  197   HG12  ILE  29          HG12      ILE  29   5.060  -0.588  -3.332
  198   HG13  ILE  29          HG11      ILE  29   6.747  -0.086  -3.293
  199   HG21  ILE  29          HG21      ILE  29   3.822   1.703  -1.841
  200   HG22  ILE  29          HG22      ILE  29   3.243   1.144  -3.410
  201   HG23  ILE  29          HG23      ILE  29   3.658   2.842  -3.176
  202   HD11  ILE  29          HD13      ILE  29   6.475   0.609  -0.966
  203   HD12  ILE  29          HD11      ILE  29   6.091  -1.097  -1.194
  204   HD13  ILE  29          HD12      ILE  29   4.793   0.083  -1.011
  205    H    SER  30           HN       SER  30   3.849   2.399  -6.654
  206    HA   SER  30           HA       SER  30   4.429   5.262  -6.366
  207    HG   SER  30           HG       SER  30   3.994   6.181  -9.297
  208    HB2  SER  30           HB2      SER  30   4.728   4.346  -8.624
  209    HB3  SER  30           HB1      SER  30   3.055   3.786  -8.625
  210    H    ILE  31           HN       ILE  31   3.132   6.072  -4.839
  211    HA   ILE  31           HA       ILE  31   0.295   5.335  -4.823
  212    HB   ILE  31           HB       ILE  31   0.230   6.538  -2.640
  213   HG12  ILE  31          HG12      ILE  31   3.240   6.638  -2.975
  214   HG13  ILE  31          HG11      ILE  31   2.167   8.031  -3.081
  215   HG21  ILE  31          HG21      ILE  31   2.269   4.325  -2.845
  216   HG22  ILE  31          HG22      ILE  31   0.519   4.117  -2.758
  217   HG23  ILE  31          HG23      ILE  31   1.395   4.797  -1.386
  218   HD11  ILE  31          HD13      ILE  31   1.514   7.696  -0.750
  219   HD12  ILE  31          HD11      ILE  31   3.254   7.930  -0.919
  220   HD13  ILE  31          HD12      ILE  31   2.603   6.312  -0.650
  221    H    SER  32           HN       SER  32  -1.252   7.114  -4.331
  222    HA   SER  32           HA       SER  32  -0.484   9.756  -5.268
  223    HG   SER  32           HG       SER  32  -0.653   7.605  -7.495
  224    HB2  SER  32           HB2      SER  32  -2.633   8.122  -6.645
  225    HB3  SER  32           HB1      SER  32  -2.309   9.829  -6.942
  226    H    GLY  33           HN       GLY  33  -1.853  11.389  -4.547
  227    HA2  GLY  33           HA2      GLY  33  -3.706  10.546  -2.437
  228    HA3  GLY  33           HA1      GLY  33  -3.005  12.146  -2.613
  229    H    MET  34           HN       MET  34  -5.825  10.625  -2.682
  230    HA   MET  34           HA       MET  34  -6.956  11.832  -5.060
  231    HB2  MET  34           HB2      MET  34  -7.734   9.624  -4.345
  232    HB3  MET  34           HB1      MET  34  -8.259  10.293  -2.806
  233    HG2  MET  34           HG2      MET  34  -9.937  11.623  -3.903
  234    HG3  MET  34           HG1      MET  34  -9.359  11.106  -5.485
  235    HE1  MET  34           HE3      MET  34 -11.317   8.226  -2.449
  236    HE2  MET  34           HE1      MET  34 -11.039   9.936  -2.122
  237    HE3  MET  34           HE2      MET  34  -9.670   8.837  -2.285
  238    H    ARG  35           HN       ARG  35  -7.415  13.929  -5.068
  239    HA   ARG  35           HA       ARG  35  -8.315  15.190  -2.565
  240    HE   ARG  35           HE       ARG  35  -6.369  17.721  -1.749
  241    HB2  ARG  35           HB2      ARG  35  -7.302  16.629  -5.014
  242    HB3  ARG  35           HB1      ARG  35  -7.485  17.264  -3.386
  243    HG2  ARG  35           HG2      ARG  35  -5.524  15.122  -4.180
  244    HG3  ARG  35           HG1      ARG  35  -5.139  16.835  -4.013
  245    HD2  ARG  35           HD2      ARG  35  -6.244  15.101  -1.808
  246    HD3  ARG  35           HD1      ARG  35  -4.535  15.473  -2.025
  247   HH11  ARG  35          HH11      ARG  35  -3.972  15.640  -0.311
  248   HH12  ARG  35          HH12      ARG  35  -3.635  16.719   1.001
  249   HH21  ARG  35          HH21      ARG  35  -5.932  19.148  -0.019
  250   HH22  ARG  35          HH22      ARG  35  -4.751  18.709   1.168
  251    H    ASP  36           HN       ASP  36 -10.227  16.278  -2.476
  252    HA   ASP  36           HA       ASP  36 -11.826  16.435  -4.939
  253    HB2  ASP  36           HB2      ASP  36 -12.467  14.456  -3.512
  254    HB3  ASP  36           HB1      ASP  36 -12.945  15.598  -2.260
  255    H    GLN  37           HN       GLN  37 -13.646  17.967  -4.778
  256    HA   GLN  37           HA       GLN  37 -12.858  20.285  -3.169
  257    HB2  GLN  37           HB2      GLN  37 -14.390  21.538  -4.730
  258    HB3  GLN  37           HB1      GLN  37 -12.976  20.814  -5.482
  259    HG2  GLN  37           HG2      GLN  37 -14.351  18.955  -6.275
  260    HG3  GLN  37           HG1      GLN  37 -15.768  19.690  -5.526
  261   HE21  GLN  37          HE21      GLN  37 -13.481  19.864  -8.128
  262   HE22  GLN  37          HE22      GLN  37 -14.338  21.026  -9.077
  263    H    SER  38           HN       SER  38 -13.841  19.039  -1.314
  264    HA   SER  38           HA       SER  38 -16.643  19.863  -1.039
  265    HG   SER  38           HG       SER  38 -16.891  18.094  -2.436
  266    HB2  SER  38           HB2      SER  38 -15.540  17.137  -0.324
  267    HB3  SER  38           HB1      SER  38 -17.117  17.731   0.194
  268    H    THR  39           HN       THR  39 -17.029  20.933   0.790
  269    HA   THR  39           HA       THR  39 -14.880  21.184   2.736
  270    HB   THR  39           HB       THR  39 -16.226  23.003   3.704
  271    HG1  THR  39           HG1      THR  39 -18.082  23.465   1.972
  272   HG21  THR  39          HG23      THR  39 -15.944  23.171   0.701
  273   HG22  THR  39          HG21      THR  39 -14.682  23.518   1.882
  274   HG23  THR  39          HG22      THR  39 -16.113  24.545   1.795
  275    H    THR  40           HN       THR  40 -15.238  21.000   5.004
  276    HA   THR  40           HA       THR  40 -15.712  19.655   6.780
  277    HB   THR  40           HB       THR  40 -17.438  21.425   6.945
  278    HG1  THR  40           HG1      THR  40 -18.150  20.408   8.663
  279   HG21  THR  40          HG23      THR  40 -18.739  20.961   4.943
  280   HG22  THR  40          HG21      THR  40 -19.772  20.873   6.369
  281   HG23  THR  40          HG22      THR  40 -19.216  19.393   5.590
  282    H    GLY  41           HN       GLY  41 -15.442  18.224   4.326
  283    HA2  GLY  41           HA2      GLY  41 -16.506  15.707   5.170
  284    HA3  GLY  41           HA1      GLY  41 -17.349  16.322   3.755
  285    H    GLU  42           HN       GLU  42 -13.926  16.450   4.699
  286    HA   GLU  42           HA       GLU  42 -13.149  15.635   2.032
  287    HB2  GLU  42           HB2      GLU  42 -11.421  16.246   4.437
  288    HB3  GLU  42           HB1      GLU  42 -10.870  16.087   2.775
  289    HG2  GLU  42           HG2      GLU  42 -12.185  18.048   2.151
  290    HG3  GLU  42           HG1      GLU  42 -12.736  18.207   3.818
  291    H    ALA  43           HN       ALA  43 -11.582  13.901   1.671
  292    HA   ALA  43           HA       ALA  43 -11.442  11.821   3.699
  293    HB1  ALA  43           HB3      ALA  43 -12.724  11.310   1.016
  294    HB2  ALA  43           HB1      ALA  43 -13.549  11.335   2.575
  295    HB3  ALA  43           HB2      ALA  43 -12.350  10.089   2.233
  296    H    THR  44           HN       THR  44  -9.208  12.156   3.662
  297    HA   THR  44           HA       THR  44  -7.780  11.732   1.151
  298    HB   THR  44           HB       THR  44  -5.760  12.330   2.383
  299    HG1  THR  44           HG1      THR  44  -6.601  13.181   4.692
  300   HG21  THR  44          HG23      THR  44  -6.333  14.636   2.975
  301   HG22  THR  44          HG21      THR  44  -8.044  14.211   2.990
  302   HG23  THR  44          HG22      THR  44  -7.133  14.146   1.482
  303    H    GLY  45           HN       GLY  45  -6.131  10.130   0.927
  304    HA2  GLY  45           HA2      GLY  45  -5.720   8.107   2.898
  305    HA3  GLY  45           HA1      GLY  45  -6.833   7.563   1.653
  306    H    ILE  46           HN       ILE  46  -4.078   6.699   2.389
  307    HA   ILE  46           HA       ILE  46  -2.555   7.388  -0.007
  308    HB   ILE  46           HB       ILE  46  -1.726   5.604   2.285
  309   HG12  ILE  46          HG12      ILE  46  -2.207   7.856   3.113
  310   HG13  ILE  46          HG11      ILE  46  -0.475   7.549   3.135
  311   HG21  ILE  46          HG21      ILE  46   0.549   6.038   1.467
  312   HG22  ILE  46          HG22      ILE  46  -0.122   6.961   0.122
  313   HG23  ILE  46          HG23      ILE  46  -0.451   5.233   0.257
  314   HD11  ILE  46          HD13      ILE  46  -0.217   8.851   1.089
  315   HD12  ILE  46          HD11      ILE  46  -0.967   9.799   2.373
  316   HD13  ILE  46          HD12      ILE  46  -1.954   9.154   1.062
  317    H    TYR  47           HN       TYR  47  -3.091   6.254  -1.765
  318    HA   TYR  47           HA       TYR  47  -3.294   3.330  -1.512
  319    HD1  TYR  47           HD1      TYR  47  -5.688   6.673  -1.796
  320    HD2  TYR  47           HD2      TYR  47  -4.894   4.435  -5.325
  321    HE1  TYR  47           HE1      TYR  47  -6.260   8.637  -3.162
  322    HE2  TYR  47           HE2      TYR  47  -5.464   6.391  -6.702
  323    HH   TYR  47           HH       TYR  47  -5.779   9.507  -5.425
  324    HB2  TYR  47           HB2      TYR  47  -5.081   3.328  -3.215
  325    HB3  TYR  47           HB1      TYR  47  -5.558   4.202  -1.763
  326    H    VAL  48           HN       VAL  48  -2.408   2.132  -3.154
  327    HA   VAL  48           HA       VAL  48  -0.512   3.517  -4.848
  328    HB   VAL  48           HB       VAL  48  -1.065   0.569  -4.483
  329   HG11  VAL  48          HG11      VAL  48   1.117   1.943  -6.049
  330   HG12  VAL  48          HG12      VAL  48  -0.188   0.954  -6.707
  331   HG13  VAL  48          HG13      VAL  48   1.054   0.216  -5.694
  332   HG21  VAL  48          HG23      VAL  48   1.251   2.252  -3.535
  333   HG22  VAL  48          HG21      VAL  48   0.992   0.538  -3.216
  334   HG23  VAL  48          HG22      VAL  48  -0.103   1.737  -2.528
  335    H    LYS  49           HN       LYS  49  -0.774   3.969  -6.944
  336    HA   LYS  49           HA       LYS  49  -3.142   2.870  -8.299
  337    HB2  LYS  49           HB2      LYS  49  -3.056   5.342  -8.018
  338    HB3  LYS  49           HB1      LYS  49  -1.584   5.371  -8.979
  339    HG2  LYS  49           HG2      LYS  49  -2.830   4.438 -10.883
  340    HG3  LYS  49           HG1      LYS  49  -4.304   4.479  -9.915
  341    HD2  LYS  49           HD2      LYS  49  -4.281   6.418 -11.320
  342    HD3  LYS  49           HD1      LYS  49  -3.988   6.941  -9.662
  343    HE2  LYS  49           HE2      LYS  49  -1.606   7.099 -10.108
  344    HE3  LYS  49           HE1      LYS  49  -1.850   6.486 -11.742
  345    HZ1  LYS  49           HZ3      LYS  49  -2.950   9.032 -10.677
  346    HZ2  LYS  49           HZ1      LYS  49  -3.160   8.446 -12.250
  347    HZ3  LYS  49           HZ2      LYS  49  -1.621   8.893 -11.713
  348    H    SER  50           HN       SER  50   0.310   3.090  -8.390
  349    HA   SER  50           HA       SER  50   0.354   1.264 -10.649
  350    HG   SER  50           HG       SER  50   2.292   3.100 -12.911
  351    HB2  SER  50           HB2      SER  50   0.434   3.455 -11.740
  352    HB3  SER  50           HB1      SER  50   1.807   3.916 -10.735
  353    H    LEU  51           HN       LEU  51   2.671   0.594 -11.140
  354    HA   LEU  51           HA       LEU  51   4.359   0.646  -8.740
  355    HG   LEU  51           HG       LEU  51   2.004  -1.113  -8.404
  356    HB2  LEU  51           HB2      LEU  51   3.516  -1.801 -10.291
  357    HB3  LEU  51           HB1      LEU  51   4.849  -1.790  -9.153
  358   HD11  LEU  51          HD11      LEU  51   1.927  -3.348  -7.398
  359   HD12  LEU  51          HD12      LEU  51   3.506  -3.710  -8.099
  360   HD13  LEU  51          HD13      LEU  51   2.119  -3.421  -9.151
  361   HD21  LEU  51          HD23      LEU  51   2.816  -1.461  -6.121
  362   HD22  LEU  51          HD21      LEU  51   3.692  -0.159  -6.927
  363   HD23  LEU  51          HD22      LEU  51   4.442  -1.746  -6.742
  364    H    ILE  52           HN       ILE  52   6.600   0.099  -9.155
  365    HA   ILE  52           HA       ILE  52   7.402   0.880 -11.864
  366    HB   ILE  52           HB       ILE  52   9.012   0.854  -9.313
  367   HG12  ILE  52          HG12      ILE  52   7.841   3.131 -10.930
  368   HG13  ILE  52          HG11      ILE  52   7.265   2.581  -9.361
  369   HG21  ILE  52          HG21      ILE  52  10.712   2.049 -10.622
  370   HG22  ILE  52          HG22      ILE  52   9.734   1.839 -12.073
  371   HG23  ILE  52          HG23      ILE  52  10.414   0.431 -11.257
  372   HD11  ILE  52          HD13      ILE  52   8.583   4.589  -9.136
  373   HD12  ILE  52          HD11      ILE  52   9.945   3.811  -9.941
  374   HD13  ILE  52          HD12      ILE  52   9.404   3.230  -8.366
  375    HA   PRO  53           HA       PRO  53   8.236  -3.574 -12.343
  376    HB2  PRO  53           HB2      PRO  53   9.246  -3.206 -14.911
  377    HB3  PRO  53           HB1      PRO  53   7.565  -3.569 -14.512
  378    HG2  PRO  53           HG2      PRO  53   8.846  -0.944 -15.125
  379    HG3  PRO  53           HG1      PRO  53   7.241  -1.544 -15.577
  380    HD2  PRO  53           HD2      PRO  53   7.554   0.226 -13.596
  381    HD3  PRO  53           HD1      PRO  53   6.338  -1.065 -13.492
  382    H    GLY  54           HN       GLY  54  10.039  -4.611 -11.768
  383    HA2  GLY  54           HA2      GLY  54  12.399  -5.052 -12.158
  384    HA3  GLY  54           HA1      GLY  54  12.635  -3.319 -12.320
  385    H    SER  55           HN       SER  55  10.781  -2.908  -9.971
  386    HA   SER  55           HA       SER  55  12.842  -3.015  -7.960
  387    HG   SER  55           HG       SER  55  12.075  -0.255  -7.630
  388    HB2  SER  55           HB2      SER  55   9.985  -2.024  -7.815
  389    HB3  SER  55           HB1      SER  55  11.191  -1.828  -6.543
  390    H    ALA  56           HN       ALA  56  11.803  -3.541  -5.617
  391    HA   ALA  56           HA       ALA  56  11.558  -6.353  -5.562
  392    HB1  ALA  56           HB3      ALA  56  11.266  -6.111  -3.170
  393    HB2  ALA  56           HB1      ALA  56  10.947  -4.387  -3.360
  394    HB3  ALA  56           HB2      ALA  56  12.543  -5.035  -3.736
  395    H    ALA  57           HN       ALA  57   9.182  -3.798  -4.826
  396    HA   ALA  57           HA       ALA  57   7.006  -5.419  -4.248
  397    HB1  ALA  57           HB3      ALA  57   7.061  -2.998  -3.854
  398    HB2  ALA  57           HB1      ALA  57   5.611  -3.493  -4.727
  399    HB3  ALA  57           HB2      ALA  57   6.940  -2.721  -5.591
  400    H    ALA  58           HN       ALA  58   8.279  -4.407  -7.362
  401    HA   ALA  58           HA       ALA  58   6.047  -5.288  -8.900
  402    HB1  ALA  58           HB3      ALA  58   7.496  -4.966 -10.830
  403    HB2  ALA  58           HB1      ALA  58   8.894  -4.807  -9.768
  404    HB3  ALA  58           HB2      ALA  58   7.611  -3.598  -9.724
  405    H    LEU  59           HN       LEU  59   9.264  -6.681  -8.277
  406    HA   LEU  59           HA       LEU  59   8.857  -9.053  -9.739
  407    HG   LEU  59           HG       LEU  59  11.151  -7.078  -9.378
  408    HB2  LEU  59           HB2      LEU  59  10.687  -8.535  -7.395
  409    HB3  LEU  59           HB1      LEU  59  10.779  -9.927  -8.455
  410   HD11  LEU  59          HD11      LEU  59  13.535  -7.596  -9.464
  411   HD12  LEU  59          HD12      LEU  59  13.221  -9.176  -8.746
  412   HD13  LEU  59          HD13      LEU  59  12.915  -7.709  -7.817
  413   HD21  LEU  59          HD23      LEU  59  12.065  -8.121 -11.389
  414   HD22  LEU  59          HD21      LEU  59  10.394  -8.616 -11.119
  415   HD23  LEU  59          HD22      LEU  59  11.715  -9.718 -10.726
  416    H    ASP  60           HN       ASP  60   7.699  -8.034  -6.685
  417    HA   ASP  60           HA       ASP  60   7.417 -10.499  -5.371
  418    HB2  ASP  60           HB2      ASP  60   7.169  -8.389  -4.187
  419    HB3  ASP  60           HB1      ASP  60   5.751  -7.984  -5.148
  420    H    GLY  61           HN       GLY  61   4.987  -8.648  -7.226
  421    HA2  GLY  61           HA2      GLY  61   3.532  -9.635  -8.822
  422    HA3  GLY  61           HA1      GLY  61   3.814 -11.198  -8.072
  423    H    ARG  62           HN       ARG  62   3.202 -10.829  -5.477
  424    HA   ARG  62           HA       ARG  62   0.428 -10.983  -5.418
  425    HE   ARG  62           HE       ARG  62   3.816 -11.485  -2.183
  426    HB2  ARG  62           HB2      ARG  62   2.354 -10.355  -3.178
  427    HB3  ARG  62           HB1      ARG  62   0.660 -10.763  -2.944
  428    HG2  ARG  62           HG2      ARG  62   1.030 -12.950  -3.934
  429    HG3  ARG  62           HG1      ARG  62   2.722 -12.545  -4.227
  430    HD2  ARG  62           HD2      ARG  62   1.412 -12.642  -1.513
  431    HD3  ARG  62           HD1      ARG  62   2.386 -13.936  -2.207
  432   HH11  ARG  62          HH11      ARG  62   2.755 -14.088  -0.127
  433   HH12  ARG  62          HH12      ARG  62   4.045 -13.888   1.012
  434   HH21  ARG  62          HH21      ARG  62   5.521 -11.215  -0.693
  435   HH22  ARG  62          HH22      ARG  62   5.619 -12.254   0.689
  436    H    ILE  63           HN       ILE  63   2.512  -8.208  -5.192
  437    HA   ILE  63           HA       ILE  63   0.451  -6.457  -4.189
  438    HB   ILE  63           HB       ILE  63   3.128  -5.741  -5.397
  439   HG12  ILE  63          HG12      ILE  63   2.343  -5.984  -2.483
  440   HG13  ILE  63          HG11      ILE  63   3.261  -7.197  -3.369
  441   HG21  ILE  63          HG21      ILE  63   2.816  -3.602  -4.236
  442   HG22  ILE  63          HG22      ILE  63   1.209  -4.122  -3.725
  443   HG23  ILE  63          HG23      ILE  63   1.558  -3.890  -5.438
  444   HD11  ILE  63          HD13      ILE  63   4.677  -5.757  -1.986
  445   HD12  ILE  63          HD11      ILE  63   4.140  -4.357  -2.912
  446   HD13  ILE  63          HD12      ILE  63   5.067  -5.632  -3.701
  447    H    GLU  64           HN       GLU  64  -1.228  -6.075  -5.495
  448    HA   GLU  64           HA       GLU  64  -0.702  -5.535  -8.337
  449    HB2  GLU  64           HB2      GLU  64  -2.265  -7.411  -7.766
  450    HB3  GLU  64           HB1      GLU  64  -3.339  -6.231  -7.031
  451    HG2  GLU  64           HG2      GLU  64  -3.670  -5.143  -9.155
  452    HG3  GLU  64           HG1      GLU  64  -2.495  -6.211  -9.918
  453    HA   PRO  65           HA       PRO  65  -1.473  -1.202  -7.732
  454    HB2  PRO  65           HB2      PRO  65  -2.844  -1.406 -10.371
  455    HB3  PRO  65           HB1      PRO  65  -1.578  -0.291  -9.842
  456    HG2  PRO  65           HG2      PRO  65  -0.993  -2.322 -11.453
  457    HG3  PRO  65           HG1      PRO  65   0.110  -1.859 -10.142
  458    HD2  PRO  65           HD2      PRO  65  -1.789  -4.159 -10.302
  459    HD3  PRO  65           HD1      PRO  65  -0.169  -4.081  -9.580
  460    H    ASN  66           HN       ASN  66  -3.340   0.388  -7.992
  461    HA   ASN  66           HA       ASN  66  -5.422   1.062  -7.394
  462    HB2  ASN  66           HB2      ASN  66  -6.234  -1.626  -8.519
  463    HB3  ASN  66           HB1      ASN  66  -7.341  -0.313  -8.135
  464   HD21  ASN  66          HD21      ASN  66  -5.475   1.737  -9.052
  465   HD22  ASN  66          HD22      ASN  66  -5.505   1.670 -10.776
  466    H    ASP  67           HN       ASP  67  -3.797  -0.147  -5.429
  467    HA   ASP  67           HA       ASP  67  -5.794  -1.481  -3.718
  468    HB2  ASP  67           HB2      ASP  67  -3.894  -2.419  -2.466
  469    HB3  ASP  67           HB1      ASP  67  -3.831  -2.879  -4.165
  470    H    LYS  68           HN       LYS  68  -5.620  -0.982  -1.376
  471    HA   LYS  68           HA       LYS  68  -4.913   1.853  -1.001
  472    HB2  LYS  68           HB2      LYS  68  -7.305   1.361  -0.765
  473    HB3  LYS  68           HB1      LYS  68  -6.944   0.173   0.479
  474    HG2  LYS  68           HG2      LYS  68  -6.143   1.886   1.959
  475    HG3  LYS  68           HG1      LYS  68  -6.313   3.107   0.696
  476    HD2  LYS  68           HD2      LYS  68  -8.741   2.693   0.655
  477    HD3  LYS  68           HD1      LYS  68  -8.547   1.524   1.965
  478    HE2  LYS  68           HE2      LYS  68  -7.706   3.267   3.426
  479    HE3  LYS  68           HE1      LYS  68  -7.806   4.442   2.116
  480    HZ1  LYS  68           HZ3      LYS  68 -10.201   4.144   2.076
  481    HZ2  LYS  68           HZ1      LYS  68  -9.691   4.617   3.619
  482    HZ3  LYS  68           HZ2      LYS  68 -10.110   3.005   3.323
  483    H    ILE  69           HN       ILE  69  -3.136   2.183   0.141
  484    HA   ILE  69           HA       ILE  69  -1.961   0.130   1.768
  485    HB   ILE  69           HB       ILE  69  -1.149   3.029   1.517
  486   HG12  ILE  69          HG12      ILE  69  -1.178   1.901  -0.669
  487   HG13  ILE  69          HG11      ILE  69   0.467   2.261  -0.156
  488   HG21  ILE  69          HG21      ILE  69  -0.201   1.957   3.473
  489   HG22  ILE  69          HG22      ILE  69   1.051   2.227   2.261
  490   HG23  ILE  69          HG23      ILE  69   0.374   0.614   2.485
  491   HD11  ILE  69          HD13      ILE  69   0.321   0.062  -1.166
  492   HD12  ILE  69          HD11      ILE  69  -0.893  -0.419   0.019
  493   HD13  ILE  69          HD12      ILE  69   0.755  -0.062   0.539
  494    H    LEU  70           HN       LEU  70  -1.675   0.127   4.000
  495    HA   LEU  70           HA       LEU  70  -3.347   2.035   5.498
  496    HG   LEU  70           HG       LEU  70  -4.352  -0.721   4.215
  497    HB2  LEU  70           HB2      LEU  70  -2.893  -0.861   6.207
  498    HB3  LEU  70           HB1      LEU  70  -3.943   0.270   7.039
  499   HD11  LEU  70          HD11      LEU  70  -6.237  -1.965   5.154
  500   HD12  LEU  70          HD12      LEU  70  -5.773  -1.443   6.773
  501   HD13  LEU  70          HD13      LEU  70  -4.701  -2.490   5.843
  502   HD21  LEU  70          HD23      LEU  70  -6.089   0.991   5.990
  503   HD22  LEU  70          HD21      LEU  70  -6.550   0.348   4.413
  504   HD23  LEU  70          HD22      LEU  70  -5.237   1.520   4.539
  505    H    ARG  71           HN       ARG  71  -0.817  -0.424   6.112
  506    HA   ARG  71           HA       ARG  71   0.742   1.609   7.513
  507    HE   ARG  71           HE       ARG  71   0.810   0.698  11.362
  508    HB2  ARG  71           HB2      ARG  71  -0.050  -1.016   8.782
  509    HB3  ARG  71           HB1      ARG  71   1.076   0.149   9.466
  510    HG2  ARG  71           HG2      ARG  71  -0.731   1.803   9.590
  511    HG3  ARG  71           HG1      ARG  71  -1.855   0.605   8.947
  512    HD2  ARG  71           HD2      ARG  71  -2.022   0.749  11.374
  513    HD3  ARG  71           HD1      ARG  71  -1.431  -0.834  10.873
  514   HH11  ARG  71          HH11      ARG  71  -1.952  -0.416  13.171
  515   HH12  ARG  71          HH12      ARG  71  -1.106  -0.461  14.681
  516   HH21  ARG  71          HH21      ARG  71   1.932   0.643  13.348
  517   HH22  ARG  71          HH22      ARG  71   1.101   0.142  14.783
  518    H    VAL  72           HN       VAL  72   2.913   1.290   7.505
  519    HA   VAL  72           HA       VAL  72   3.908  -0.913   5.841
  520    HB   VAL  72           HB       VAL  72   5.468   1.510   6.751
  521   HG11  VAL  72          HG11      VAL  72   6.858  -0.246   5.891
  522   HG12  VAL  72          HG12      VAL  72   6.777   1.043   4.690
  523   HG13  VAL  72          HG13      VAL  72   5.828  -0.428   4.471
  524   HG21  VAL  72          HG23      VAL  72   3.456   2.281   5.604
  525   HG22  VAL  72          HG21      VAL  72   3.830   1.235   4.235
  526   HG23  VAL  72          HG22      VAL  72   4.898   2.581   4.634
  527    H    ASP  73           HN       ASP  73   6.250  -1.606   6.551
  528    HA   ASP  73           HA       ASP  73   6.164  -3.057   8.857
  529    HB2  ASP  73           HB2      ASP  73   7.901  -3.218   7.060
  530    HB3  ASP  73           HB1      ASP  73   8.682  -1.800   7.749
  531    H    ASP  74           HN       ASP  74   5.674  -2.327  10.829
  532    HA   ASP  74           HA       ASP  74   5.669  -1.116  12.753
  533    HB2  ASP  74           HB2      ASP  74   8.553  -0.742  11.932
  534    HB3  ASP  74           HB1      ASP  74   7.915  -0.310  13.516
  535    H    VAL  75           HN       VAL  75   4.817   0.293  10.392
  536    HA   VAL  75           HA       VAL  75   5.120   3.016  11.378
  537    HB   VAL  75           HB       VAL  75   5.712   2.292   8.500
  538   HG11  VAL  75          HG11      VAL  75   5.565   4.994   9.832
  539   HG12  VAL  75          HG12      VAL  75   4.449   4.360   8.622
  540   HG13  VAL  75          HG13      VAL  75   6.124   4.695   8.187
  541   HG21  VAL  75          HG23      VAL  75   7.588   1.849  10.006
  542   HG22  VAL  75          HG21      VAL  75   7.493   3.501  10.613
  543   HG23  VAL  75          HG22      VAL  75   7.934   3.205   8.932
  544    H    ASN  76           HN       ASN  76   3.396   4.377  10.833
  545    HA   ASN  76           HA       ASN  76   1.105   3.033   9.552
  546    HB2  ASN  76           HB2      ASN  76   0.686   3.430  11.914
  547    HB3  ASN  76           HB1      ASN  76   1.132   5.125  11.741
  548   HD21  ASN  76          HD21      ASN  76  -0.283   6.544  10.745
  549   HD22  ASN  76          HD22      ASN  76  -1.944   6.152  10.475
  550    H    VAL  77           HN       VAL  77   0.382   3.918   7.703
  551    HA   VAL  77           HA       VAL  77   1.314   6.634   7.041
  552    HB   VAL  77           HB       VAL  77   0.959   6.062   4.691
  553   HG11  VAL  77          HG11      VAL  77   3.150   5.660   5.573
  554   HG12  VAL  77          HG12      VAL  77   2.738   4.334   4.487
  555   HG13  VAL  77          HG13      VAL  77   2.651   4.103   6.233
  556   HG21  VAL  77          HG23      VAL  77   0.249   3.305   5.687
  557   HG22  VAL  77          HG21      VAL  77   0.389   3.808   4.003
  558   HG23  VAL  77          HG22      VAL  77  -0.892   4.473   5.018
  559    H    GLN  78           HN       GLN  78  -1.109   5.858   8.619
  560    HA   GLN  78           HA       GLN  78  -3.256   6.786   6.866
  561    HB2  GLN  78           HB2      GLN  78  -3.291   5.683   9.679
  562    HB3  GLN  78           HB1      GLN  78  -4.721   6.260   8.835
  563    HG2  GLN  78           HG2      GLN  78  -2.964   4.062   7.781
  564    HG3  GLN  78           HG1      GLN  78  -4.359   3.776   8.821
  565   HE21  GLN  78          HE21      GLN  78  -5.432   2.602   7.245
  566   HE22  GLN  78          HE22      GLN  78  -6.134   3.345   5.851
  567    H    GLY  79           HN       GLY  79  -1.162   8.611   7.620
  568    HA2  GLY  79           HA2      GLY  79  -2.652  10.877   8.257
  569    HA3  GLY  79           HA1      GLY  79  -1.957  10.286   9.758
  570    H    MET  80           HN       MET  80  -0.203   9.768   6.817
  571    HA   MET  80           HA       MET  80   1.640  11.939   7.580
  572    HB2  MET  80           HB2      MET  80   2.320   9.282   6.309
  573    HB3  MET  80           HB1      MET  80   3.468  10.561   6.679
  574    HG2  MET  80           HG2      MET  80   2.747  10.333   9.089
  575    HG3  MET  80           HG1      MET  80   1.910   8.861   8.598
  576    HE1  MET  80           HE3      MET  80   3.213   6.768   7.445
  577    HE2  MET  80           HE1      MET  80   4.960   6.743   7.211
  578    HE3  MET  80           HE2      MET  80   3.963   7.874   6.295
  579    H    ALA  81           HN       ALA  81   2.533  13.203   5.981
  580    HA   ALA  81           HA       ALA  81   0.982  13.693   3.699
  581    HB1  ALA  81           HB3      ALA  81   2.742  15.247   3.043
  582    HB2  ALA  81           HB1      ALA  81   3.824  14.540   4.244
  583    HB3  ALA  81           HB2      ALA  81   2.371  15.397   4.761
  584    H    GLN  82           HN       GLN  82   1.632  13.581   1.446
  585    HA   GLN  82           HA       GLN  82   2.224  11.040   0.558
  586    HB2  GLN  82           HB2      GLN  82   1.184  12.820  -0.811
  587    HB3  GLN  82           HB1      GLN  82   2.742  13.625  -0.921
  588    HG2  GLN  82           HG2      GLN  82   2.527  12.480  -2.934
  589    HG3  GLN  82           HG1      GLN  82   3.599  11.469  -1.966
  590   HE21  GLN  82          HE21      GLN  82   1.881  10.781  -4.229
  591   HE22  GLN  82          HE22      GLN  82   0.831   9.529  -3.666
  592    H    SER  83           HN       SER  83   4.445  13.822   0.325
  593    HA   SER  83           HA       SER  83   6.697  12.454  -0.494
  594    HG   SER  83           HG       SER  83   5.565  14.886   1.732
  595    HB2  SER  83           HB2      SER  83   7.991  14.359   0.390
  596    HB3  SER  83           HB1      SER  83   6.555  14.896  -0.482
  597    H    ASP  84           HN       ASP  84   5.389  12.805   2.744
  598    HA   ASP  84           HA       ASP  84   7.640  11.927   4.183
  599    HB2  ASP  84           HB2      ASP  84   5.651  13.038   5.192
  600    HB3  ASP  84           HB1      ASP  84   4.734  11.558   4.932
  601    H    VAL  85           HN       VAL  85   4.895  10.153   2.808
  602    HA   VAL  85           HA       VAL  85   5.563   7.616   3.816
  603    HB   VAL  85           HB       VAL  85   4.198   8.129   1.172
  604   HG11  VAL  85          HG11      VAL  85   3.037   6.022   1.688
  605   HG12  VAL  85          HG12      VAL  85   4.012   5.860   3.148
  606   HG13  VAL  85          HG13      VAL  85   4.784   5.810   1.563
  607   HG21  VAL  85          HG23      VAL  85   2.079   8.083   2.473
  608   HG22  VAL  85          HG21      VAL  85   3.082   9.496   2.801
  609   HG23  VAL  85          HG22      VAL  85   3.035   8.162   3.953
  610    H    VAL  86           HN       VAL  86   6.547   9.325   0.893
  611    HA   VAL  86           HA       VAL  86   7.894   7.196  -0.364
  612    HB   VAL  86           HB       VAL  86   8.571  10.134  -0.571
  613   HG11  VAL  86          HG11      VAL  86   9.414   9.543  -2.789
  614   HG12  VAL  86          HG12      VAL  86   9.028   7.850  -2.487
  615   HG13  VAL  86          HG13      VAL  86  10.264   8.658  -1.523
  616   HG21  VAL  86          HG23      VAL  86   6.199   9.780  -0.987
  617   HG22  VAL  86          HG21      VAL  86   6.580   8.511  -2.150
  618   HG23  VAL  86          HG22      VAL  86   7.041  10.180  -2.485
  619    H    GLU  87           HN       GLU  87   8.911   9.541   2.056
  620    HA   GLU  87           HA       GLU  87  11.674   9.012   1.971
  621    HB2  GLU  87           HB2      GLU  87   9.942  10.013   4.235
  622    HB3  GLU  87           HB1      GLU  87  11.699   9.997   4.268
  623    HG2  GLU  87           HG2      GLU  87  11.751  11.505   2.347
  624    HG3  GLU  87           HG1      GLU  87   9.988  11.519   2.315
  625    H    VAL  88           HN       VAL  88   9.101   7.682   4.032
  626    HA   VAL  88           HA       VAL  88  10.628   6.038   5.654
  627    HB   VAL  88           HB       VAL  88   7.830   5.626   4.598
  628   HG11  VAL  88          HG11      VAL  88   7.536   3.965   6.374
  629   HG12  VAL  88          HG12      VAL  88   9.245   4.102   6.785
  630   HG13  VAL  88          HG13      VAL  88   8.765   3.459   5.213
  631   HG21  VAL  88          HG23      VAL  88   8.122   7.589   6.005
  632   HG22  VAL  88          HG21      VAL  88   8.873   6.597   7.257
  633   HG23  VAL  88          HG22      VAL  88   7.174   6.362   6.844
  634    H    LEU  89           HN       LEU  89   9.013   5.147   2.600
  635    HA   LEU  89           HA       LEU  89   9.961   2.532   2.462
  636    HG   LEU  89           HG       LEU  89   7.412   4.192   1.644
  637    HB2  LEU  89           HB2      LEU  89   9.377   4.391   0.154
  638    HB3  LEU  89           HB1      LEU  89   9.468   2.642   0.067
  639   HD11  LEU  89          HD11      LEU  89   7.166   2.705  -0.966
  640   HD12  LEU  89          HD12      LEU  89   7.108   4.456  -0.759
  641   HD13  LEU  89          HD13      LEU  89   5.840   3.444  -0.067
  642   HD21  LEU  89          HD23      LEU  89   7.667   1.241   1.072
  643   HD22  LEU  89          HD21      LEU  89   6.308   2.019   1.886
  644   HD23  LEU  89          HD22      LEU  89   7.906   2.025   2.635
  645    H    ARG  90           HN       ARG  90  11.483   5.562   1.573
  646    HA   ARG  90           HA       ARG  90  13.685   4.300   0.208
  647    HE   ARG  90           HE       ARG  90  12.066   8.733   0.005
  648    HB2  ARG  90           HB2      ARG  90  13.123   7.143   1.032
  649    HB3  ARG  90           HB1      ARG  90  14.641   6.664   0.287
  650    HG2  ARG  90           HG2      ARG  90  13.396   5.835  -1.665
  651    HG3  ARG  90           HG1      ARG  90  11.897   6.396  -0.922
  652    HD2  ARG  90           HD2      ARG  90  14.253   8.154  -1.600
  653    HD3  ARG  90           HD1      ARG  90  12.816   7.969  -2.603
  654   HH11  ARG  90          HH11      ARG  90  13.595   9.999  -2.858
  655   HH12  ARG  90          HH12      ARG  90  13.094  11.630  -2.563
  656   HH21  ARG  90          HH21      ARG  90  11.403  10.882   0.405
  657   HH22  ARG  90          HH22      ARG  90  11.851  12.132  -0.706
  658    H    ASN  91           HN       ASN  91  12.881   4.887   3.434
  659    HA   ASN  91           HA       ASN  91  15.663   4.968   4.326
  660    HB2  ASN  91           HB2      ASN  91  13.064   5.192   5.861
  661    HB3  ASN  91           HB1      ASN  91  14.664   5.267   6.593
  662   HD21  ASN  91          HD21      ASN  91  12.523   7.251   6.512
  663   HD22  ASN  91          HD22      ASN  91  13.212   8.665   5.798
  664    H    ALA  92           HN       ALA  92  13.195   2.742   3.727
  665    HA   ALA  92           HA       ALA  92  13.456   0.815   5.685
  666    HB1  ALA  92           HB3      ALA  92  11.774   0.745   3.911
  667    HB2  ALA  92           HB1      ALA  92  12.651  -0.782   4.034
  668    HB3  ALA  92           HB2      ALA  92  13.030   0.352   2.736
  669    H    GLY  93           HN       GLY  93  14.842   0.076   2.506
  670    HA2  GLY  93           HA2      GLY  93  16.832  -0.918   1.916
  671    HA3  GLY  93           HA1      GLY  93  17.536  -0.112   3.311
  672    H    ASN  94           HN       ASN  94  14.880  -2.110   4.011
  673    HA   ASN  94           HA       ASN  94  16.503  -4.479   4.534
  674    HB2  ASN  94           HB2      ASN  94  15.914  -4.561   6.886
  675    HB3  ASN  94           HB1      ASN  94  16.678  -3.008   6.554
  676   HD21  ASN  94          HD21      ASN  94  13.593  -4.616   7.012
  677   HD22  ASN  94          HD22      ASN  94  12.727  -3.218   7.536
  678    HA   PRO  95           HA       PRO  95  12.764  -6.767   3.760
  679    HB2  PRO  95           HB2      PRO  95  12.942  -8.108   6.397
  680    HB3  PRO  95           HB1      PRO  95  12.925  -8.813   4.779
  681    HG2  PRO  95           HG2      PRO  95  15.171  -8.739   6.217
  682    HG3  PRO  95           HG1      PRO  95  15.196  -8.475   4.463
  683    HD2  PRO  95           HD2      PRO  95  15.377  -6.478   6.684
  684    HD3  PRO  95           HD1      PRO  95  16.257  -6.532   5.142
  685    H    VAL  96           HN       VAL  96  11.193  -5.163   3.866
  686    HA   VAL  96           HA       VAL  96   9.981  -4.644   6.497
  687    HB   VAL  96           HB       VAL  96   8.910  -2.684   5.399
  688   HG11  VAL  96          HG11      VAL  96  10.955  -2.411   6.682
  689   HG12  VAL  96          HG12      VAL  96  10.948  -1.318   5.297
  690   HG13  VAL  96          HG13      VAL  96  11.921  -2.788   5.256
  691   HG21  VAL  96          HG23      VAL  96   8.946  -3.507   3.098
  692   HG22  VAL  96          HG21      VAL  96  10.707  -3.407   3.085
  693   HG23  VAL  96          HG22      VAL  96   9.742  -1.937   3.226
  694    H    ARG  97           HN       ARG  97   7.734  -4.689   6.755
  695    HA   ARG  97           HA       ARG  97   6.373  -6.526   4.940
  696    HE   ARG  97           HE       ARG  97   4.352  -8.708   7.658
  697    HB2  ARG  97           HB2      ARG  97   5.620  -5.582   7.713
  698    HB3  ARG  97           HB1      ARG  97   4.728  -6.766   6.769
  699    HG2  ARG  97           HG2      ARG  97   6.666  -8.258   6.810
  700    HG3  ARG  97           HG1      ARG  97   7.555  -7.070   7.764
  701    HD2  ARG  97           HD2      ARG  97   6.631  -8.822   9.187
  702    HD3  ARG  97           HD1      ARG  97   5.901  -7.259   9.550
  703   HH11  ARG  97          HH11      ARG  97   5.110  -8.511  11.054
  704   HH12  ARG  97          HH12      ARG  97   3.597  -9.184  11.562
  705   HH21  ARG  97          HH21      ARG  97   2.358  -9.592   8.318
  706   HH22  ARG  97          HH22      ARG  97   2.033  -9.799  10.006
  707    H    LEU  98           HN       LEU  98   4.506  -6.012   3.886
  708    HA   LEU  98           HA       LEU  98   3.683  -3.187   4.015
  709    HG   LEU  98           HG       LEU  98   5.777  -4.703   2.046
  710    HB2  LEU  98           HB2      LEU  98   3.356  -5.039   1.667
  711    HB3  LEU  98           HB1      LEU  98   3.126  -3.302   1.696
  712   HD11  LEU  98          HD11      LEU  98   4.908  -4.951  -0.217
  713   HD12  LEU  98          HD12      LEU  98   6.289  -3.855  -0.183
  714   HD13  LEU  98          HD13      LEU  98   4.654  -3.209  -0.318
  715   HD21  LEU  98          HD23      LEU  98   5.733  -2.588   3.216
  716   HD22  LEU  98          HD21      LEU  98   5.071  -1.782   1.794
  717   HD23  LEU  98          HD22      LEU  98   6.708  -2.436   1.755
  718    H    LEU  99           HN       LEU  99   1.824  -2.985   5.072
  719    HA   LEU  99           HA       LEU  99  -0.175  -5.124   4.869
  720    HG   LEU  99           HG       LEU  99  -2.321  -3.738   6.603
  721    HB2  LEU  99           HB2      LEU  99   0.573  -4.429   7.130
  722    HB3  LEU  99           HB1      LEU  99  -0.037  -2.817   6.812
  723   HD11  LEU  99          HD11      LEU  99  -1.022  -6.325   7.443
  724   HD12  LEU  99          HD12      LEU  99  -1.761  -5.989   5.878
  725   HD13  LEU  99          HD13      LEU  99  -2.758  -6.034   7.332
  726   HD21  LEU  99          HD23      LEU  99  -1.549  -2.854   8.740
  727   HD22  LEU  99          HD21      LEU  99  -0.912  -4.439   9.176
  728   HD23  LEU  99          HD22      LEU  99  -2.650  -4.211   8.978
  729    H    LEU 100           HN       LEU 100  -1.459  -4.775   3.161
  730    HA   LEU 100           HA       LEU 100  -2.808  -2.172   2.995
  731    HG   LEU 100           HG       LEU 100  -0.182  -3.961   1.389
  732    HB2  LEU 100           HB2      LEU 100  -2.756  -2.726   0.407
  733    HB3  LEU 100           HB1      LEU 100  -1.472  -1.827   1.190
  734   HD11  LEU 100          HD11      LEU 100  -2.003  -5.548   1.268
  735   HD12  LEU 100          HD12      LEU 100  -0.857  -5.842  -0.041
  736   HD13  LEU 100          HD13      LEU 100  -2.384  -5.024  -0.373
  737   HD21  LEU 100          HD23      LEU 100  -0.973  -3.049  -1.371
  738   HD22  LEU 100          HD21      LEU 100   0.427  -4.055  -1.006
  739   HD23  LEU 100          HD22      LEU 100   0.335  -2.411  -0.376
  740    H    ILE 101           HN       ILE 101  -4.885  -2.229   1.935
  741    HA   ILE 101           HA       ILE 101  -6.171  -4.855   2.220
  742    HB   ILE 101           HB       ILE 101  -7.149  -3.195   3.660
  743   HG12  ILE 101          HG12      ILE 101  -8.971  -3.622   1.281
  744   HG13  ILE 101          HG11      ILE 101  -8.658  -4.823   2.529
  745   HG21  ILE 101          HG21      ILE 101  -7.581  -1.530   1.184
  746   HG22  ILE 101          HG22      ILE 101  -6.425  -1.197   2.474
  747   HG23  ILE 101          HG23      ILE 101  -8.157  -1.138   2.804
  748   HD11  ILE 101          HD13      ILE 101 -10.773  -3.704   2.901
  749   HD12  ILE 101          HD11      ILE 101  -9.959  -2.141   2.941
  750   HD13  ILE 101          HD12      ILE 101  -9.637  -3.335   4.199
  751    H    ARG 102           HN       ARG 102  -7.220  -5.808   0.575
  752    HA   ARG 102           HA       ARG 102  -7.245  -4.399  -2.014
  753    HE   ARG 102           HE       ARG 102  -5.701  -6.842  -4.749
  754    HB2  ARG 102           HB2      ARG 102  -6.824  -7.313  -1.364
  755    HB3  ARG 102           HB1      ARG 102  -7.195  -6.751  -2.986
  756    HG2  ARG 102           HG2      ARG 102  -4.845  -5.743  -1.410
  757    HG3  ARG 102           HG1      ARG 102  -4.764  -7.148  -2.476
  758    HD2  ARG 102           HD2      ARG 102  -5.558  -4.353  -3.286
  759    HD3  ARG 102           HD1      ARG 102  -4.003  -5.119  -3.610
  760   HH11  ARG 102          HH11      ARG 102  -5.483  -3.370  -4.936
  761   HH12  ARG 102          HH12      ARG 102  -6.108  -3.291  -6.550
  762   HH21  ARG 102          HH21      ARG 102  -6.529  -6.746  -6.868
  763   HH22  ARG 102          HH22      ARG 102  -6.703  -5.209  -7.647
  764    H    ARG 103           HN       ARG 103  -9.077  -4.472  -3.264
  765    HA   ARG 103           HA       ARG 103 -11.503  -5.261  -1.870
  766    HE   ARG 103           HE       ARG 103 -10.927  -1.997  -5.178
  767    HB2  ARG 103           HB2      ARG 103 -11.127  -3.781  -4.481
  768    HB3  ARG 103           HB1      ARG 103 -12.668  -4.048  -3.678
  769    HG2  ARG 103           HG2      ARG 103 -11.918  -2.728  -1.772
  770    HG3  ARG 103           HG1      ARG 103 -10.357  -2.477  -2.555
  771    HD2  ARG 103           HD2      ARG 103 -13.035  -1.561  -3.594
  772    HD3  ARG 103           HD1      ARG 103 -11.810  -0.540  -2.842
  773   HH11  ARG 103          HH11      ARG 103 -12.298   0.956  -3.936
  774   HH12  ARG 103          HH12      ARG 103 -11.824   1.904  -5.306
  775   HH21  ARG 103          HH21      ARG 103 -10.296  -0.755  -6.985
  776   HH22  ARG 103          HH22      ARG 103 -10.688   0.932  -7.039
  777    H    LEU 104           HN       LEU 104 -12.606  -7.051  -2.283
  778    HA   LEU 104           HA       LEU 104 -11.819  -8.677  -4.595
  779    HG   LEU 104           HG       LEU 104 -11.177  -8.883  -1.441
  780    HB2  LEU 104           HB2      LEU 104 -13.444  -9.518  -2.198
  781    HB3  LEU 104           HB1      LEU 104 -12.730 -10.563  -3.412
  782   HD11  LEU 104          HD11      LEU 104 -11.706 -11.850  -1.503
  783   HD12  LEU 104          HD12      LEU 104 -12.362 -10.699  -0.339
  784   HD13  LEU 104          HD13      LEU 104 -10.628 -11.019  -0.382
  785   HD21  LEU 104          HD23      LEU 104  -9.251 -10.192  -2.228
  786   HD22  LEU 104          HD21      LEU 104  -9.961  -9.215  -3.514
  787   HD23  LEU 104          HD22      LEU 104 -10.278 -10.949  -3.446
  788    HA   PRO 105           HA       PRO 105 -15.794  -7.180  -6.244
  789    HB2  PRO 105           HB2      PRO 105 -15.426  -8.298  -8.719
  790    HB3  PRO 105           HB1      PRO 105 -14.789  -6.718  -8.247
  791    HG2  PRO 105           HG2      PRO 105 -13.406  -9.373  -8.330
  792    HG3  PRO 105           HG1      PRO 105 -12.813  -7.783  -8.851
  793    HD2  PRO 105           HD2      PRO 105 -12.075  -8.863  -6.504
  794    HD3  PRO 105           HD1      PRO 105 -12.332  -7.115  -6.685
  795    H    LEU 106           HN       LEU 106 -17.535  -8.377  -7.551
  796    HA   LEU 106           HA       LEU 106 -17.630 -11.235  -6.909
  797    HG   LEU 106           HG       LEU 106 -17.935  -9.544  -4.449
  798    HB2  LEU 106           HB2      LEU 106 -19.721  -9.199  -6.148
  799    HB3  LEU 106           HB1      LEU 106 -20.011 -10.928  -6.152
  800   HD11  LEU 106          HD11      LEU 106 -19.457 -10.006  -2.585
  801   HD12  LEU 106          HD12      LEU 106 -20.663 -10.607  -3.724
  802   HD13  LEU 106          HD13      LEU 106 -20.179  -8.912  -3.763
  803   HD21  LEU 106          HD23      LEU 106 -17.817 -11.696  -3.289
  804   HD22  LEU 106          HD21      LEU 106 -17.362 -11.851  -4.985
  805   HD23  LEU 106          HD22      LEU 106 -18.955 -12.384  -4.447
  806    H    LEU 107           HN       LEU 107 -18.932 -12.474  -8.259
  807    HA   LEU 107           HA       LEU 107 -19.417 -11.324 -10.858
  808    HG   LEU 107           HG       LEU 107 -18.044 -14.742 -11.415
  809    HB2  LEU 107           HB2      LEU 107 -19.697 -14.105  -9.738
  810    HB3  LEU 107           HB1      LEU 107 -20.232 -13.698 -11.356
  811   HD11  LEU 107          HD11      LEU 107 -18.646 -12.991 -13.054
  812   HD12  LEU 107          HD12      LEU 107 -16.909 -13.130 -12.781
  813   HD13  LEU 107          HD13      LEU 107 -17.816 -11.807 -12.046
  814   HD21  LEU 107          HD23      LEU 107 -17.082 -12.409  -9.763
  815   HD22  LEU 107          HD21      LEU 107 -16.094 -13.715 -10.420
  816   HD23  LEU 107          HD22      LEU 107 -17.292 -14.058  -9.171
  817    H    GLU 108           HN       GLU 108 -21.173 -10.049 -10.983
  818    HA   GLU 108           HA       GLU 108 -23.743 -11.235 -10.183
  819    HB2  GLU 108           HB2      GLU 108 -24.482  -8.832  -9.717
  820    HB3  GLU 108           HB1      GLU 108 -23.418  -9.588  -8.540
  821    HG2  GLU 108           HG2      GLU 108 -21.509  -8.413  -9.513
  822    HG3  GLU 108           HG1      GLU 108 -22.581  -7.649 -10.684
  Start of MODEL   11
    1    H1   GLY   1           HT1      GLY   1 -12.500 -11.732  16.305
    2    H2   GLY   1           HT2      GLY   1 -11.880 -12.678  15.047
    3    H3   GLY   1           HT3      GLY   1 -13.466 -12.097  14.964
    4    HA2  GLY   1           HA1      GLY   1 -12.016 -10.816  13.522
    5    HA3  GLY   1           HA2      GLY   1 -12.684  -9.830  14.814
    6    H    SER   2           HN       SER   2  -9.821 -11.701  13.882
    7    HA   SER   2           HA       SER   2  -8.202 -10.203  15.796
    8    HG   SER   2           HG       SER   2  -7.250 -13.177  16.471
    9    HB2  SER   2           HB2      SER   2  -7.460 -12.498  13.967
   10    HB3  SER   2           HB1      SER   2  -6.398 -11.769  15.172
   11    H    HIS   3           HN       HIS   3  -8.002 -11.065  12.339
   12    HA   HIS   3           HA       HIS   3  -6.051  -9.074  11.763
   13    HD1  HIS   3           HD1      HIS   3  -7.644 -12.950  10.490
   14    HD2  HIS   3           HD2      HIS   3  -4.000 -10.955  10.462
   15    HE1  HIS   3           HE1      HIS   3  -5.900 -14.733  10.809
   16    HE2  HIS   3           HE2      HIS   3  -3.701 -13.502  10.793
   17    HB2  HIS   3           HB2      HIS   3  -7.878 -10.543   9.851
   18    HB3  HIS   3           HB1      HIS   3  -6.403  -9.682   9.427
   19    H    GLY   4           HN       GLY   4  -9.529  -9.332  11.030
   20    HA2  GLY   4           HA2      GLY   4 -10.651  -7.077  11.584
   21    HA3  GLY   4           HA1      GLY   4  -9.539  -6.463  10.370
   22    H    TYR   5           HN       TYR   5 -10.129  -6.526   8.283
   23    HA   TYR   5           HA       TYR   5 -12.767  -7.573   7.665
   24    HD1  TYR   5           HD1      TYR   5 -14.495  -5.681   6.413
   25    HD2  TYR   5           HD2      TYR   5 -10.764  -4.017   7.600
   26    HE1  TYR   5           HE1      TYR   5 -15.671  -3.753   7.383
   27    HE2  TYR   5           HE2      TYR   5 -11.930  -2.081   8.573
   28    HH   TYR   5           HH       TYR   5 -15.272  -2.028   9.104
   29    HB2  TYR   5           HB2      TYR   5 -10.822  -5.870   6.103
   30    HB3  TYR   5           HB1      TYR   5 -12.343  -6.452   5.433
   31    H    SER   6           HN       SER   6 -13.187  -9.334   6.479
   32    HA   SER   6           HA       SER   6 -11.176 -10.499   4.754
   33    HG   SER   6           HG       SER   6 -12.016 -12.239   8.249
   34    HB2  SER   6           HB2      SER   6 -11.268 -12.717   5.855
   35    HB3  SER   6           HB1      SER   6 -10.568 -11.485   6.904
   36    H    ASP   7           HN       ASP   7 -12.323 -10.742   2.954
   37    HA   ASP   7           HA       ASP   7 -13.976 -11.307   1.498
   38    HB2  ASP   7           HB2      ASP   7 -14.737 -13.285   3.662
   39    HB3  ASP   7           HB1      ASP   7 -15.232 -13.359   1.973
   40    H    ALA   8           HN       ALA   8 -14.746  -9.072   2.239
   41    HA   ALA   8           HA       ALA   8 -17.575  -9.310   2.899
   42    HB1  ALA   8           HB3      ALA   8 -15.743  -7.459   4.416
   43    HB2  ALA   8           HB1      ALA   8 -16.484  -8.926   5.055
   44    HB3  ALA   8           HB2      ALA   8 -17.495  -7.559   4.586
   45    H    SER   9           HN       SER   9 -18.503  -8.417   1.184
   46    HA   SER   9           HA       SER   9 -19.024  -6.977  -0.497
   47    HG   SER   9           HG       SER   9 -19.893  -4.224  -0.204
   48    HB2  SER   9           HB2      SER   9 -19.415  -5.469   1.421
   49    HB3  SER   9           HB1      SER   9 -17.737  -4.934   1.332
   50    H    GLY  10           HN       GLY  10 -16.337  -8.274  -0.458
   51    HA2  GLY  10           HA2      GLY  10 -14.627  -8.350  -2.015
   52    HA3  GLY  10           HA1      GLY  10 -15.267  -6.879  -2.733
   53    H    PHE  11           HN       PHE  11 -14.309  -7.300   0.634
   54    HA   PHE  11           HA       PHE  11 -11.927  -5.655   0.161
   55    HD1  PHE  11           HD2      PHE  11 -11.940  -3.112  -0.101
   56    HD2  PHE  11           HD1      PHE  11 -15.856  -4.151   1.205
   57    HE1  PHE  11           HE2      PHE  11 -12.892  -1.440  -1.636
   58    HE2  PHE  11           HE1      PHE  11 -16.815  -2.483  -0.330
   59    HZ   PHE  11           HZ       PHE  11 -15.332  -1.110  -1.735
   60    HB2  PHE  11           HB2      PHE  11 -14.036  -5.090   2.256
   61    HB3  PHE  11           HB1      PHE  11 -12.473  -4.286   2.165
   62    H    SER  12           HN       SER  12 -10.287  -6.848   0.847
   63    HA   SER  12           HA       SER  12 -10.488  -8.131   3.477
   64    HG   SER  12           HG       SER  12  -9.001 -11.197   2.362
   65    HB2  SER  12           HB2      SER  12 -10.855  -9.902   1.837
   66    HB3  SER  12           HB1      SER  12  -9.386  -9.439   0.978
   67    H    LEU  13           HN       LEU  13  -8.650  -8.070   4.700
   68    HA   LEU  13           HA       LEU  13  -6.632  -6.188   3.889
   69    HG   LEU  13           HG       LEU  13  -8.678  -6.141   6.123
   70    HB2  LEU  13           HB2      LEU  13  -6.868  -7.869   6.385
   71    HB3  LEU  13           HB1      LEU  13  -5.694  -6.589   6.138
   72   HD11  LEU  13          HD11      LEU  13  -8.370  -5.202   8.366
   73   HD12  LEU  13          HD12      LEU  13  -6.688  -5.732   8.351
   74   HD13  LEU  13          HD13      LEU  13  -7.988  -6.923   8.318
   75   HD21  LEU  13          HD23      LEU  13  -6.312  -4.278   6.216
   76   HD22  LEU  13          HD21      LEU  13  -7.989  -3.783   6.451
   77   HD23  LEU  13          HD22      LEU  13  -7.475  -4.454   4.903
   78    H    TYR  14           HN       TYR  14  -4.835  -6.661   2.836
   79    HA   TYR  14           HA       TYR  14  -3.784  -9.408   2.997
   80    HD1  TYR  14           HD2      TYR  14  -3.618 -11.150   0.617
   81    HD2  TYR  14           HD1      TYR  14  -6.232  -7.798   0.338
   82    HE1  TYR  14           HE2      TYR  14  -5.390 -12.609  -0.263
   83    HE2  TYR  14           HE1      TYR  14  -8.010  -9.252  -0.542
   84    HH   TYR  14           HH       TYR  14  -7.838 -12.643  -0.431
   85    HB2  TYR  14           HB2      TYR  14  -3.883  -7.473   0.692
   86    HB3  TYR  14           HB1      TYR  14  -2.764  -8.832   0.709
   87    H    SER  15           HN       SER  15  -1.474  -9.659   2.903
   88    HA   SER  15           HA       SER  15   0.164  -7.293   3.273
   89    HG   SER  15           HG       SER  15   0.735 -10.090   5.839
   90    HB2  SER  15           HB2      SER  15   1.092  -8.057   5.425
   91    HB3  SER  15           HB1      SER  15  -0.636  -7.732   5.549
   92    H    VAL  16           HN       VAL  16   2.187  -7.565   2.532
   93    HA   VAL  16           HA       VAL  16   3.162 -10.304   2.074
   94    HB   VAL  16           HB       VAL  16   3.556  -8.070   0.084
   95   HG11  VAL  16          HG11      VAL  16   4.235  -9.881  -1.408
   96   HG12  VAL  16          HG12      VAL  16   3.968 -11.051  -0.116
   97   HG13  VAL  16          HG13      VAL  16   5.237  -9.836   0.043
   98   HG21  VAL  16          HG23      VAL  16   1.178  -8.577   0.198
   99   HG22  VAL  16          HG21      VAL  16   1.520 -10.296   0.007
  100   HG23  VAL  16          HG22      VAL  16   1.867  -9.175  -1.310
  101    H    GLU  17           HN       GLU  17   5.389 -10.588   2.260
  102    HA   GLU  17           HA       GLU  17   6.766  -8.424   3.659
  103    HB2  GLU  17           HB2      GLU  17   7.419 -11.356   3.353
  104    HB3  GLU  17           HB1      GLU  17   8.451 -10.207   4.190
  105    HG2  GLU  17           HG2      GLU  17   7.184 -11.360   5.826
  106    HG3  GLU  17           HG1      GLU  17   6.545  -9.720   5.722
  107    H    LEU  18           HN       LEU  18   7.998  -7.097   2.535
  108    HA   LEU  18           HA       LEU  18   9.568  -8.172   0.282
  109    HG   LEU  18           HG       LEU  18   7.495  -6.001  -1.860
  110    HB2  LEU  18           HB2      LEU  18   8.015  -5.624   0.523
  111    HB3  LEU  18           HB1      LEU  18   9.442  -5.666  -0.490
  112   HD11  LEU  18          HD11      LEU  18   9.505  -7.259  -2.460
  113   HD12  LEU  18          HD12      LEU  18   8.035  -8.116  -2.919
  114   HD13  LEU  18          HD13      LEU  18   8.939  -8.620  -1.492
  115   HD21  LEU  18          HD23      LEU  18   6.843  -8.394  -0.151
  116   HD22  LEU  18          HD21      LEU  18   5.938  -7.806  -1.545
  117   HD23  LEU  18          HD22      LEU  18   6.012  -6.840  -0.071
  118    H    PHE  19           HN       PHE  19  11.700  -7.970   0.508
  119    HA   PHE  19           HA       PHE  19  12.710  -6.190   2.612
  120    HD1  PHE  19           HD2      PHE  19  12.277 -10.007   1.287
  121    HD2  PHE  19           HD1      PHE  19  15.977  -8.051   0.508
  122    HE1  PHE  19           HE2      PHE  19  12.722 -11.588  -0.546
  123    HE2  PHE  19           HE1      PHE  19  16.427  -9.628  -1.327
  124    HZ   PHE  19           HZ       PHE  19  14.807 -11.401  -1.852
  125    HB2  PHE  19           HB2      PHE  19  14.770  -7.587   2.500
  126    HB3  PHE  19           HB1      PHE  19  13.331  -8.501   2.936
  127    H    ARG  20           HN       ARG  20  14.026  -4.506   2.170
  128    HA   ARG  20           HA       ARG  20  14.721  -4.098  -0.658
  129    HE   ARG  20           HE       ARG  20  16.197   0.050   1.077
  130    HB2  ARG  20           HB2      ARG  20  13.377  -2.361   0.662
  131    HB3  ARG  20           HB1      ARG  20  14.881  -2.005   1.502
  132    HG2  ARG  20           HG2      ARG  20  15.928  -1.536  -0.711
  133    HG3  ARG  20           HG1      ARG  20  14.334  -1.723  -1.445
  134    HD2  ARG  20           HD2      ARG  20  14.432   0.556  -1.147
  135    HD3  ARG  20           HD1      ARG  20  13.623   0.048   0.335
  136   HH11  ARG  20          HH11      ARG  20  14.269   2.406  -0.613
  137   HH12  ARG  20          HH12      ARG  20  15.165   3.762  -0.011
  138   HH21  ARG  20          HH21      ARG  20  17.385   1.828   1.874
  139   HH22  ARG  20          HH22      ARG  20  16.935   3.432   1.401
  140    H    GLU  21           HN       GLU  21  16.614  -5.210  -0.898
  141    HA   GLU  21           HA       GLU  21  18.824  -4.550   0.920
  142    HB2  GLU  21           HB2      GLU  21  18.298  -6.954   0.570
  143    HB3  GLU  21           HB1      GLU  21  18.649  -6.756  -1.142
  144    HG2  GLU  21           HG2      GLU  21  20.955  -6.141  -0.588
  145    HG3  GLU  21           HG1      GLU  21  20.596  -6.377   1.123
  146    H    LYS  22           HN       LYS  22  17.626  -4.088  -2.248
  147    HA   LYS  22           HA       LYS  22  20.176  -3.341  -3.399
  148    HB2  LYS  22           HB2      LYS  22  17.366  -3.114  -4.498
  149    HB3  LYS  22           HB1      LYS  22  18.840  -2.807  -5.407
  150    HG2  LYS  22           HG2      LYS  22  18.149  -5.453  -4.148
  151    HG3  LYS  22           HG1      LYS  22  17.820  -5.029  -5.829
  152    HD2  LYS  22           HD2      LYS  22  20.210  -4.684  -6.213
  153    HD3  LYS  22           HD1      LYS  22  20.543  -5.092  -4.528
  154    HE2  LYS  22           HE2      LYS  22  19.640  -7.329  -4.888
  155    HE3  LYS  22           HE1      LYS  22  19.276  -6.922  -6.563
  156    HZ1  LYS  22           HZ3      LYS  22  21.339  -8.174  -6.365
  157    HZ2  LYS  22           HZ1      LYS  22  21.991  -6.979  -5.361
  158    HZ3  LYS  22           HZ2      LYS  22  21.631  -6.623  -6.975
  159    H    ASP  23           HN       ASP  23  20.876  -1.289  -3.828
  160    HA   ASP  23           HA       ASP  23  19.670   0.823  -2.266
  161    HB2  ASP  23           HB2      ASP  23  21.643   2.147  -2.994
  162    HB3  ASP  23           HB1      ASP  23  22.085   0.619  -2.239
  163    H    THR  24           HN       THR  24  18.052  -0.080  -4.409
  164    HA   THR  24           HA       THR  24  18.250   1.687  -6.641
  165    HB   THR  24           HB       THR  24  16.074   0.839  -7.309
  166    HG1  THR  24           HG1      THR  24  15.993  -0.009  -4.622
  167   HG21  THR  24          HG23      THR  24  18.025  -0.596  -7.703
  168   HG22  THR  24          HG21      THR  24  16.572  -1.552  -7.407
  169   HG23  THR  24          HG22      THR  24  17.777  -1.360  -6.132
  170    H    SER  25           HN       SER  25  17.214   2.102  -3.470
  171    HA   SER  25           HA       SER  25  16.149   3.765  -2.348
  172    HG   SER  25           HG       SER  25  15.453   5.973  -2.536
  173    HB2  SER  25           HB2      SER  25  17.744   5.198  -3.560
  174    HB3  SER  25           HB1      SER  25  16.610   5.322  -4.904
  175    H    SER  26           HN       SER  26  14.713   1.976  -4.422
  176    HA   SER  26           HA       SER  26  12.123   3.259  -4.075
  177    HG   SER  26           HG       SER  26  12.995   4.540  -7.302
  178    HB2  SER  26           HB2      SER  26  13.143   2.382  -6.788
  179    HB3  SER  26           HB1      SER  26  11.494   2.906  -6.440
  180    H    LEU  27           HN       LEU  27  10.492   1.833  -3.758
  181    HA   LEU  27           HA       LEU  27  11.227  -0.999  -3.687
  182    HG   LEU  27           HG       LEU  27  11.127   0.701  -1.229
  183    HB2  LEU  27           HB2      LEU  27   8.961   0.543  -2.431
  184    HB3  LEU  27           HB1      LEU  27   9.081  -1.204  -2.369
  185   HD11  LEU  27          HD11      LEU  27   9.005   0.801  -0.017
  186   HD12  LEU  27          HD12      LEU  27  10.266   0.033   0.947
  187   HD13  LEU  27          HD13      LEU  27   9.028  -0.953   0.167
  188   HD21  LEU  27          HD23      LEU  27  12.007  -1.325  -0.139
  189   HD22  LEU  27          HD21      LEU  27  12.110  -1.409  -1.898
  190   HD23  LEU  27          HD22      LEU  27  10.847  -2.296  -1.045
  191    H    GLY  28           HN       GLY  28   9.239   1.242  -5.391
  192    HA2  GLY  28           HA2      GLY  28   8.476   0.577  -7.601
  193    HA3  GLY  28           HA1      GLY  28   8.107  -1.005  -6.932
  194    H    ILE  29           HN       ILE  29   7.231   1.270  -4.690
  195    HA   ILE  29           HA       ILE  29   4.422   0.945  -5.356
  196    HB   ILE  29           HB       ILE  29   5.806   2.097  -2.935
  197   HG12  ILE  29          HG12      ILE  29   4.536   0.162  -1.847
  198   HG13  ILE  29          HG11      ILE  29   4.236  -0.422  -3.479
  199   HG21  ILE  29          HG21      ILE  29   2.856   1.935  -3.524
  200   HG22  ILE  29          HG22      ILE  29   3.810   3.390  -3.238
  201   HG23  ILE  29          HG23      ILE  29   3.538   2.242  -1.928
  202   HD11  ILE  29          HD13      ILE  29   6.941   0.006  -2.234
  203   HD12  ILE  29          HD11      ILE  29   6.631  -0.605  -3.859
  204   HD13  ILE  29          HD12      ILE  29   6.131  -1.545  -2.454
  205    H    SER  30           HN       SER  30   3.452   2.360  -6.636
  206    HA   SER  30           HA       SER  30   4.340   5.167  -6.580
  207    HG   SER  30           HG       SER  30   3.003   6.225  -8.353
  208    HB2  SER  30           HB2      SER  30   4.652   4.091  -8.766
  209    HB3  SER  30           HB1      SER  30   2.944   3.655  -8.801
  210    H    ILE  31           HN       ILE  31   3.029   5.919  -4.948
  211    HA   ILE  31           HA       ILE  31   0.172   5.414  -5.035
  212    HB   ILE  31           HB       ILE  31   0.076   6.752  -2.969
  213   HG12  ILE  31          HG12      ILE  31   3.083   6.949  -3.251
  214   HG13  ILE  31          HG11      ILE  31   1.965   8.276  -3.548
  215   HG21  ILE  31          HG21      ILE  31   2.202   4.614  -2.969
  216   HG22  ILE  31          HG22      ILE  31   0.463   4.356  -2.838
  217   HG23  ILE  31          HG23      ILE  31   1.330   5.194  -1.551
  218   HD11  ILE  31          HD13      ILE  31   1.246   8.183  -1.216
  219   HD12  ILE  31          HD11      ILE  31   2.981   8.462  -1.357
  220   HD13  ILE  31          HD12      ILE  31   2.376   6.863  -0.923
  221    H    SER  32           HN       SER  32  -1.346   7.246  -4.788
  222    HA   SER  32           HA       SER  32  -0.474   9.749  -6.008
  223    HG   SER  32           HG       SER  32  -0.311   8.893  -8.269
  224    HB2  SER  32           HB2      SER  32  -2.761   8.081  -7.086
  225    HB3  SER  32           HB1      SER  32  -2.360   9.717  -7.608
  226    H    GLY  33           HN       GLY  33  -1.484  11.496  -5.171
  227    HA2  GLY  33           HA2      GLY  33  -3.368  11.008  -3.003
  228    HA3  GLY  33           HA1      GLY  33  -2.561  12.526  -3.360
  229    H    MET  34           HN       MET  34  -5.488  11.234  -3.152
  230    HA   MET  34           HA       MET  34  -6.692  12.193  -5.581
  231    HB2  MET  34           HB2      MET  34  -7.647  10.287  -4.355
  232    HB3  MET  34           HB1      MET  34  -7.958  11.327  -2.972
  233    HG2  MET  34           HG2      MET  34  -9.536  12.627  -4.272
  234    HG3  MET  34           HG1      MET  34  -9.184  11.657  -5.701
  235    HE1  MET  34           HE3      MET  34  -9.563  10.442  -1.969
  236    HE2  MET  34           HE1      MET  34 -11.273  10.014  -1.923
  237    HE3  MET  34           HE2      MET  34 -10.791  11.698  -2.116
  238    H    ARG  35           HN       ARG  35  -6.163  14.374  -5.711
  239    HA   ARG  35           HA       ARG  35  -6.868  16.162  -3.544
  240    HE   ARG  35           HE       ARG  35  -4.734  18.276  -3.306
  241    HB2  ARG  35           HB2      ARG  35  -5.935  16.916  -6.313
  242    HB3  ARG  35           HB1      ARG  35  -5.864  17.893  -4.854
  243    HG2  ARG  35           HG2      ARG  35  -4.276  15.394  -5.408
  244    HG3  ARG  35           HG1      ARG  35  -3.668  17.051  -5.417
  245    HD2  ARG  35           HD2      ARG  35  -4.757  15.537  -3.047
  246    HD3  ARG  35           HD1      ARG  35  -3.074  15.972  -3.337
  247   HH11  ARG  35          HH11      ARG  35  -3.217  15.927  -1.226
  248   HH12  ARG  35          HH12      ARG  35  -3.134  16.995   0.135
  249   HH21  ARG  35          HH21      ARG  35  -4.628  19.689  -1.521
  250   HH22  ARG  35          HH22      ARG  35  -3.937  19.133  -0.032
  251    H    ASP  36           HN       ASP  36  -8.174  18.134  -4.028
  252    HA   ASP  36           HA       ASP  36 -10.212  17.794  -6.079
  253    HB2  ASP  36           HB2      ASP  36 -11.032  16.611  -4.019
  254    HB3  ASP  36           HB1      ASP  36 -10.979  18.157  -3.177
  255    H    GLN  37           HN       GLN  37  -7.981  19.674  -4.934
  256    HA   GLN  37           HA       GLN  37  -7.546  21.905  -4.881
  257    HB2  GLN  37           HB2      GLN  37 -10.056  22.061  -6.562
  258    HB3  GLN  37           HB1      GLN  37  -8.859  23.338  -6.392
  259    HG2  GLN  37           HG2      GLN  37  -8.379  20.622  -7.598
  260    HG3  GLN  37           HG1      GLN  37  -8.601  22.127  -8.487
  261   HE21  GLN  37          HE21      GLN  37  -6.455  20.246  -6.520
  262   HE22  GLN  37          HE22      GLN  37  -5.037  21.194  -6.796
  263    H    SER  38           HN       SER  38  -9.248  20.717  -2.806
  264    HA   SER  38           HA       SER  38 -10.548  23.187  -1.868
  265    HG   SER  38           HG       SER  38 -13.494  21.834  -0.905
  266    HB2  SER  38           HB2      SER  38 -12.183  21.390  -2.578
  267    HB3  SER  38           HB1      SER  38 -11.551  20.398  -1.265
  268    H    THR  39           HN       THR  39 -11.243  22.081   0.687
  269    HA   THR  39           HA       THR  39  -9.038  22.695   2.213
  270    HB   THR  39           HB       THR  39 -10.134  21.465   4.076
  271    HG1  THR  39           HG1      THR  39 -11.320  20.184   2.016
  272   HG21  THR  39          HG23      THR  39 -11.975  23.158   2.384
  273   HG22  THR  39          HG21      THR  39 -10.819  23.746   3.579
  274   HG23  THR  39          HG22      THR  39 -12.209  22.791   4.094
  275    H    THR  40           HN       THR  40  -7.325  21.611   3.068
  276    HA   THR  40           HA       THR  40  -6.721  19.010   1.886
  277    HB   THR  40           HB       THR  40  -4.986  20.696   1.693
  278    HG1  THR  40           HG1      THR  40  -3.413  19.317   2.206
  279   HG21  THR  40          HG23      THR  40  -3.847  21.595   3.666
  280   HG22  THR  40          HG21      THR  40  -4.986  20.750   4.714
  281   HG23  THR  40          HG22      THR  40  -5.552  22.044   3.657
  282    H    GLY  41           HN       GLY  41  -8.182  20.088   4.632
  283    HA2  GLY  41           HA2      GLY  41  -6.952  18.476   6.630
  284    HA3  GLY  41           HA1      GLY  41  -8.544  19.215   6.731
  285    H    GLU  42           HN       GLU  42 -10.005  18.060   4.832
  286    HA   GLU  42           HA       GLU  42  -9.914  15.202   5.534
  287    HB2  GLU  42           HB2      GLU  42 -12.264  16.954   4.804
  288    HB3  GLU  42           HB1      GLU  42 -12.363  15.216   5.049
  289    HG2  GLU  42           HG2      GLU  42 -11.507  17.224   7.121
  290    HG3  GLU  42           HG1      GLU  42 -13.101  16.479   7.009
  291    H    ALA  43           HN       ALA  43 -11.382  13.963   3.790
  292    HA   ALA  43           HA       ALA  43 -11.399  13.037   1.713
  293    HB1  ALA  43           HB3      ALA  43 -11.097  15.899   0.810
  294    HB2  ALA  43           HB1      ALA  43 -12.620  15.090   1.180
  295    HB3  ALA  43           HB2      ALA  43 -11.641  14.546  -0.182
  296    H    THR  44           HN       THR  44  -8.938  12.970   3.010
  297    HA   THR  44           HA       THR  44  -7.117  13.017   0.704
  298    HB   THR  44           HB       THR  44  -5.253  13.671   2.232
  299    HG1  THR  44           HG1      THR  44  -5.640  13.967   4.297
  300   HG21  THR  44          HG23      THR  44  -6.259  15.343   0.789
  301   HG22  THR  44          HG21      THR  44  -5.858  16.066   2.347
  302   HG23  THR  44          HG22      THR  44  -7.529  15.641   1.975
  303    H    GLY  45           HN       GLY  45  -6.140  11.124   0.371
  304    HA2  GLY  45           HA2      GLY  45  -5.541   9.370   2.626
  305    HA3  GLY  45           HA1      GLY  45  -6.654   8.743   1.419
  306    H    ILE  46           HN       ILE  46  -4.454   7.305   1.821
  307    HA   ILE  46           HA       ILE  46  -2.704   7.972  -0.457
  308    HB   ILE  46           HB       ILE  46  -1.964   6.317   1.957
  309   HG12  ILE  46          HG12      ILE  46  -2.230   8.661   2.586
  310   HG13  ILE  46          HG11      ILE  46  -0.526   8.223   2.584
  311   HG21  ILE  46          HG21      ILE  46  -0.319   7.316  -0.363
  312   HG22  ILE  46          HG22      ILE  46  -0.763   5.642  -0.029
  313   HG23  ILE  46          HG23      ILE  46   0.325   6.501   1.062
  314   HD11  ILE  46          HD13      ILE  46  -0.266   9.296   0.399
  315   HD12  ILE  46          HD11      ILE  46  -0.851  10.418   1.627
  316   HD13  ILE  46          HD12      ILE  46  -1.968   9.757   0.434
  317    H    TYR  47           HN       TYR  47  -3.073   6.704  -2.148
  318    HA   TYR  47           HA       TYR  47  -3.490   3.841  -1.710
  319    HD1  TYR  47           HD1      TYR  47  -5.651   7.230  -2.005
  320    HD2  TYR  47           HD2      TYR  47  -5.342   4.867  -5.529
  321    HE1  TYR  47           HE1      TYR  47  -6.233   9.194  -3.367
  322    HE2  TYR  47           HE2      TYR  47  -5.923   6.823  -6.900
  323    HH   TYR  47           HH       TYR  47  -5.926   9.982  -5.690
  324    HB2  TYR  47           HB2      TYR  47  -5.302   3.820  -3.415
  325    HB3  TYR  47           HB1      TYR  47  -5.734   4.706  -1.957
  326    H    VAL  48           HN       VAL  48  -2.524   2.550  -3.179
  327    HA   VAL  48           HA       VAL  48  -0.656   3.752  -4.999
  328    HB   VAL  48           HB       VAL  48  -1.344   0.836  -4.601
  329   HG11  VAL  48          HG11      VAL  48  -0.269   1.216  -6.741
  330   HG12  VAL  48          HG12      VAL  48   0.847   0.412  -5.638
  331   HG13  VAL  48          HG13      VAL  48   1.014   2.138  -5.959
  332   HG21  VAL  48          HG23      VAL  48   0.894   2.480  -3.422
  333   HG22  VAL  48          HG21      VAL  48   0.645   0.749  -3.194
  334   HG23  VAL  48          HG22      VAL  48  -0.528   1.900  -2.553
  335    H    LYS  49           HN       LYS  49  -0.719   3.816  -7.200
  336    HA   LYS  49           HA       LYS  49  -3.187   2.841  -8.483
  337    HB2  LYS  49           HB2      LYS  49  -3.146   5.293  -8.328
  338    HB3  LYS  49           HB1      LYS  49  -1.597   5.323  -9.161
  339    HG2  LYS  49           HG2      LYS  49  -2.709   4.276 -11.128
  340    HG3  LYS  49           HG1      LYS  49  -4.249   4.451 -10.287
  341    HD2  LYS  49           HD2      LYS  49  -2.384   6.728 -10.954
  342    HD3  LYS  49           HD1      LYS  49  -3.800   6.274 -11.907
  343    HE2  LYS  49           HE2      LYS  49  -3.819   7.155  -9.020
  344    HE3  LYS  49           HE1      LYS  49  -4.280   8.146 -10.403
  345    HZ1  LYS  49           HZ3      LYS  49  -6.223   7.233  -9.332
  346    HZ2  LYS  49           HZ1      LYS  49  -5.633   5.657  -9.513
  347    HZ3  LYS  49           HZ2      LYS  49  -6.059   6.562 -10.876
  348    H    SER  50           HN       SER  50   0.282   3.139  -8.646
  349    HA   SER  50           HA       SER  50   0.295   1.232 -10.859
  350    HG   SER  50           HG       SER  50   0.585   3.946 -12.959
  351    HB2  SER  50           HB2      SER  50   1.840   3.834 -10.903
  352    HB3  SER  50           HB1      SER  50   2.016   2.529 -12.075
  353    H    LEU  51           HN       LEU  51   2.644   0.558 -11.335
  354    HA   LEU  51           HA       LEU  51   4.263   0.492  -8.892
  355    HG   LEU  51           HG       LEU  51   1.769  -1.195  -8.800
  356    HB2  LEU  51           HB2      LEU  51   3.454  -1.919 -10.521
  357    HB3  LEU  51           HB1      LEU  51   4.660  -1.936  -9.248
  358   HD11  LEU  51          HD11      LEU  51   1.934  -3.509  -9.551
  359   HD12  LEU  51          HD12      LEU  51   1.514  -3.425  -7.841
  360   HD13  LEU  51          HD13      LEU  51   3.162  -3.827  -8.325
  361   HD21  LEU  51          HD23      LEU  51   3.973  -1.927  -6.875
  362   HD22  LEU  51          HD21      LEU  51   2.310  -1.516  -6.453
  363   HD23  LEU  51          HD22      LEU  51   3.367  -0.296  -7.164
  364    H    ILE  52           HN       ILE  52   6.496  -0.281  -9.313
  365    HA   ILE  52           HA       ILE  52   7.367   0.568 -11.988
  366    HB   ILE  52           HB       ILE  52   8.895   0.514  -9.390
  367   HG12  ILE  52          HG12      ILE  52   7.923   2.802 -11.120
  368   HG13  ILE  52          HG11      ILE  52   7.225   2.315  -9.579
  369   HG21  ILE  52          HG21      ILE  52  10.704   1.603 -10.652
  370   HG22  ILE  52          HG22      ILE  52   9.785   1.380 -12.141
  371   HG23  ILE  52          HG23      ILE  52  10.371  -0.023 -11.246
  372   HD11  ILE  52          HD13      ILE  52   8.639   4.267  -9.335
  373   HD12  ILE  52          HD11      ILE  52  10.006   3.373  -9.999
  374   HD13  ILE  52          HD12      ILE  52   9.306   2.892  -8.454
  375    HA   PRO  53           HA       PRO  53   8.065  -3.923 -12.461
  376    HB2  PRO  53           HB2      PRO  53   9.024  -2.908 -15.089
  377    HB3  PRO  53           HB1      PRO  53   7.906  -4.228 -14.732
  378    HG2  PRO  53           HG2      PRO  53   7.006  -1.906 -15.667
  379    HG3  PRO  53           HG1      PRO  53   6.106  -2.796 -14.424
  380    HD2  PRO  53           HD2      PRO  53   7.841  -0.378 -14.145
  381    HD3  PRO  53           HD1      PRO  53   6.321  -0.778 -13.320
  382    H    GLY  54           HN       GLY  54   9.849  -4.950 -11.827
  383    HA2  GLY  54           HA2      GLY  54  12.184  -5.486 -12.256
  384    HA3  GLY  54           HA1      GLY  54  12.467  -3.771 -12.513
  385    H    SER  55           HN       SER  55  10.572  -3.380 -10.098
  386    HA   SER  55           HA       SER  55  12.709  -3.342  -8.143
  387    HG   SER  55           HG       SER  55  10.599  -0.706  -8.966
  388    HB2  SER  55           HB2      SER  55   9.844  -2.376  -7.966
  389    HB3  SER  55           HB1      SER  55  11.084  -2.109  -6.740
  390    H    ALA  56           HN       ALA  56  11.671  -3.769  -5.757
  391    HA   ALA  56           HA       ALA  56  11.444  -6.592  -5.602
  392    HB1  ALA  56           HB3      ALA  56  11.162  -6.242  -3.197
  393    HB2  ALA  56           HB1      ALA  56  10.953  -4.513  -3.472
  394    HB3  ALA  56           HB2      ALA  56  12.497  -5.283  -3.835
  395    H    ALA  57           HN       ALA  57   9.123  -3.989  -4.880
  396    HA   ALA  57           HA       ALA  57   6.943  -5.601  -4.237
  397    HB1  ALA  57           HB3      ALA  57   5.565  -3.638  -4.656
  398    HB2  ALA  57           HB1      ALA  57   6.904  -2.865  -5.504
  399    HB3  ALA  57           HB2      ALA  57   7.031  -3.202  -3.777
  400    H    ALA  58           HN       ALA  58   8.077  -4.444  -7.374
  401    HA   ALA  58           HA       ALA  58   5.807  -5.287  -8.854
  402    HB1  ALA  58           HB3      ALA  58   7.195  -4.925 -10.825
  403    HB2  ALA  58           HB1      ALA  58   8.627  -4.800  -9.803
  404    HB3  ALA  58           HB2      ALA  58   7.351  -3.588  -9.685
  405    H    LEU  59           HN       LEU  59   9.066  -6.715  -8.551
  406    HA   LEU  59           HA       LEU  59   8.534  -9.033 -10.029
  407    HG   LEU  59           HG       LEU  59  10.928  -7.181  -9.824
  408    HB2  LEU  59           HB2      LEU  59  10.510  -8.553  -7.801
  409    HB3  LEU  59           HB1      LEU  59  10.496  -9.991  -8.805
  410   HD11  LEU  59          HD11      LEU  59  13.257  -7.950 -10.182
  411   HD12  LEU  59          HD12      LEU  59  12.874  -9.415  -9.278
  412   HD13  LEU  59          HD13      LEU  59  12.804  -7.844  -8.481
  413   HD21  LEU  59          HD23      LEU  59  11.149  -9.859 -11.195
  414   HD22  LEU  59          HD21      LEU  59  11.593  -8.305 -11.901
  415   HD23  LEU  59          HD22      LEU  59   9.911  -8.638 -11.487
  416    H    ASP  60           HN       ASP  60   7.573  -8.134  -6.866
  417    HA   ASP  60           HA       ASP  60   7.335 -10.628  -5.622
  418    HB2  ASP  60           HB2      ASP  60   7.100  -8.482  -4.434
  419    HB3  ASP  60           HB1      ASP  60   5.580  -8.189  -5.270
  420    H    GLY  61           HN       GLY  61   4.945  -8.801  -7.530
  421    HA2  GLY  61           HA2      GLY  61   3.396  -9.737  -9.025
  422    HA3  GLY  61           HA1      GLY  61   3.730 -11.321  -8.346
  423    H    ARG  62           HN       ARG  62   3.249 -10.852  -5.651
  424    HA   ARG  62           HA       ARG  62   0.459 -11.136  -5.524
  425    HE   ARG  62           HE       ARG  62   0.680 -12.867  -1.812
  426    HB2  ARG  62           HB2      ARG  62   2.305 -10.381  -3.256
  427    HB3  ARG  62           HB1      ARG  62   0.717 -11.121  -3.116
  428    HG2  ARG  62           HG2      ARG  62   1.525 -13.146  -4.148
  429    HG3  ARG  62           HG1      ARG  62   3.102 -12.405  -4.430
  430    HD2  ARG  62           HD2      ARG  62   3.188 -13.843  -2.479
  431    HD3  ARG  62           HD1      ARG  62   3.404 -12.159  -2.007
  432   HH11  ARG  62          HH11      ARG  62   3.746 -13.393  -0.244
  433   HH12  ARG  62          HH12      ARG  62   3.048 -13.675   1.315
  434   HH21  ARG  62          HH21      ARG  62  -0.250 -13.236   0.237
  435   HH22  ARG  62          HH22      ARG  62   0.775 -13.589   1.589
  436    H    ILE  63           HN       ILE  63   2.451  -8.328  -5.527
  437    HA   ILE  63           HA       ILE  63   0.381  -6.629  -4.389
  438    HB   ILE  63           HB       ILE  63   3.061  -5.840  -5.541
  439   HG12  ILE  63          HG12      ILE  63   2.253  -6.198  -2.644
  440   HG13  ILE  63          HG11      ILE  63   3.203  -7.362  -3.563
  441   HG21  ILE  63          HG21      ILE  63   1.443  -4.018  -5.526
  442   HG22  ILE  63          HG22      ILE  63   2.704  -3.743  -4.325
  443   HG23  ILE  63          HG23      ILE  63   1.113  -4.310  -3.819
  444   HD11  ILE  63          HD13      ILE  63   4.949  -5.665  -3.866
  445   HD12  ILE  63          HD11      ILE  63   4.635  -6.016  -2.166
  446   HD13  ILE  63          HD12      ILE  63   4.001  -4.540  -2.893
  447    H    GLU  64           HN       GLU  64  -1.212  -5.909  -5.610
  448    HA   GLU  64           HA       GLU  64  -0.694  -5.383  -8.462
  449    HB2  GLU  64           HB2      GLU  64  -2.244  -7.264  -8.089
  450    HB3  GLU  64           HB1      GLU  64  -3.291  -6.211  -7.148
  451    HG2  GLU  64           HG2      GLU  64  -3.657  -4.825  -9.144
  452    HG3  GLU  64           HG1      GLU  64  -2.652  -5.932 -10.076
  453    HA   PRO  65           HA       PRO  65  -1.535  -1.091  -7.693
  454    HB2  PRO  65           HB2      PRO  65  -2.821  -0.526 -10.093
  455    HB3  PRO  65           HB1      PRO  65  -1.074  -0.489  -9.835
  456    HG2  PRO  65           HG2      PRO  65  -2.774  -2.647 -11.011
  457    HG3  PRO  65           HG1      PRO  65  -1.162  -2.093 -11.503
  458    HD2  PRO  65           HD2      PRO  65  -1.471  -4.352 -10.114
  459    HD3  PRO  65           HD1      PRO  65  -0.104  -3.264  -9.792
  460    H    ASN  66           HN       ASN  66  -3.500   0.488  -8.098
  461    HA   ASN  66           HA       ASN  66  -5.607   1.084  -7.491
  462    HB2  ASN  66           HB2      ASN  66  -6.160  -1.646  -8.650
  463    HB3  ASN  66           HB1      ASN  66  -7.445  -0.615  -8.031
  464   HD21  ASN  66          HD21      ASN  66  -4.593   0.602  -9.648
  465   HD22  ASN  66          HD22      ASN  66  -5.403   1.153 -11.071
  466    H    ASP  67           HN       ASP  67  -4.001   0.270  -5.437
  467    HA   ASP  67           HA       ASP  67  -5.910  -1.078  -3.645
  468    HB2  ASP  67           HB2      ASP  67  -3.973  -2.029  -2.427
  469    HB3  ASP  67           HB1      ASP  67  -4.064  -2.601  -4.090
  470    H    LYS  68           HN       LYS  68  -5.113  -0.654  -1.240
  471    HA   LYS  68           HA       LYS  68  -4.329   2.172  -1.009
  472    HB2  LYS  68           HB2      LYS  68  -6.744   2.059  -0.750
  473    HB3  LYS  68           HB1      LYS  68  -6.581   0.800   0.464
  474    HG2  LYS  68           HG2      LYS  68  -5.346   2.424   1.889
  475    HG3  LYS  68           HG1      LYS  68  -5.721   3.671   0.698
  476    HD2  LYS  68           HD2      LYS  68  -8.096   3.342   1.053
  477    HD3  LYS  68           HD1      LYS  68  -7.768   2.014   2.170
  478    HE2  LYS  68           HE2      LYS  68  -6.574   3.588   3.643
  479    HE3  LYS  68           HE1      LYS  68  -6.991   4.902   2.544
  480    HZ1  LYS  68           HZ3      LYS  68  -9.337   4.440   2.968
  481    HZ2  LYS  68           HZ1      LYS  68  -8.517   4.823   4.397
  482    HZ3  LYS  68           HZ2      LYS  68  -8.913   3.214   4.054
  483    H    ILE  69           HN       ILE  69  -2.625   2.431   0.260
  484    HA   ILE  69           HA       ILE  69  -1.586   0.276   1.834
  485    HB   ILE  69           HB       ILE  69  -0.682   3.160   1.794
  486   HG12  ILE  69          HG12      ILE  69  -0.672   2.193  -0.467
  487   HG13  ILE  69          HG11      ILE  69   0.965   2.456   0.121
  488   HG21  ILE  69          HG21      ILE  69   0.153   1.894   3.698
  489   HG22  ILE  69          HG22      ILE  69   1.455   2.257   2.566
  490   HG23  ILE  69          HG23      ILE  69   0.754   0.639   2.615
  491   HD11  ILE  69          HD13      ILE  69  -0.486  -0.180   0.066
  492   HD12  ILE  69          HD11      ILE  69   1.158   0.083   0.645
  493   HD13  ILE  69          HD12      ILE  69   0.770   0.341  -1.056
  494    H    LEU  70           HN       LEU  70  -1.456   0.108   4.068
  495    HA   LEU  70           HA       LEU  70  -3.115   2.009   5.590
  496    HG   LEU  70           HG       LEU  70  -4.228  -0.581   4.101
  497    HB2  LEU  70           HB2      LEU  70  -2.843  -0.950   6.103
  498    HB3  LEU  70           HB1      LEU  70  -3.848   0.172   7.000
  499   HD11  LEU  70          HD11      LEU  70  -6.221  -1.750   4.887
  500   HD12  LEU  70          HD12      LEU  70  -5.805  -1.348   6.553
  501   HD13  LEU  70          HD13      LEU  70  -4.759  -2.416   5.616
  502   HD21  LEU  70          HD23      LEU  70  -5.894   1.142   5.932
  503   HD22  LEU  70          HD21      LEU  70  -6.350   0.636   4.306
  504   HD23  LEU  70          HD22      LEU  70  -4.958   1.694   4.543
  505    H    ARG  71           HN       ARG  71  -0.846  -0.653   6.298
  506    HA   ARG  71           HA       ARG  71   0.695   1.215   7.958
  507    HE   ARG  71           HE       ARG  71   0.482  -1.231  11.420
  508    HB2  ARG  71           HB2      ARG  71  -0.249  -1.536   8.774
  509    HB3  ARG  71           HB1      ARG  71   0.945  -0.598   9.660
  510    HG2  ARG  71           HG2      ARG  71  -0.674   1.105  10.150
  511    HG3  ARG  71           HG1      ARG  71  -1.872   0.315   9.124
  512    HD2  ARG  71           HD2      ARG  71  -2.208  -0.104  11.545
  513    HD3  ARG  71           HD1      ARG  71  -1.975  -1.573  10.600
  514   HH11  ARG  71          HH11      ARG  71  -2.449  -0.683  13.224
  515   HH12  ARG  71          HH12      ARG  71  -1.733  -1.073  14.753
  516   HH21  ARG  71          HH21      ARG  71   1.431  -1.751  13.429
  517   HH22  ARG  71          HH22      ARG  71   0.471  -1.678  14.869
  518    H    VAL  72           HN       VAL  72   2.851   0.986   7.890
  519    HA   VAL  72           HA       VAL  72   3.938  -1.122   6.148
  520    HB   VAL  72           HB       VAL  72   5.376   1.389   7.014
  521   HG11  VAL  72          HG11      VAL  72   5.775  -0.522   4.715
  522   HG12  VAL  72          HG12      VAL  72   6.824  -0.313   6.117
  523   HG13  VAL  72          HG13      VAL  72   6.666   0.985   4.934
  524   HG21  VAL  72          HG23      VAL  72   3.306   2.060   5.919
  525   HG22  VAL  72          HG21      VAL  72   3.679   1.014   4.549
  526   HG23  VAL  72          HG22      VAL  72   4.698   2.411   4.897
  527    H    ASP  73           HN       ASP  73   6.302  -1.708   6.807
  528    HA   ASP  73           HA       ASP  73   6.339  -3.135   9.128
  529    HB2  ASP  73           HB2      ASP  73   8.029  -3.168   7.237
  530    HB3  ASP  73           HB1      ASP  73   8.810  -1.802   8.026
  531    H    ASP  74           HN       ASP  74   5.862  -2.407  11.094
  532    HA   ASP  74           HA       ASP  74   5.822  -1.158  12.996
  533    HB2  ASP  74           HB2      ASP  74   8.731  -0.805  12.252
  534    HB3  ASP  74           HB1      ASP  74   8.046  -0.483  13.842
  535    H    VAL  75           HN       VAL  75   5.373   0.317  10.379
  536    HA   VAL  75           HA       VAL  75   5.550   2.992  11.541
  537    HB   VAL  75           HB       VAL  75   6.552   2.366   8.759
  538   HG11  VAL  75          HG11      VAL  75   7.088   4.767   8.649
  539   HG12  VAL  75          HG12      VAL  75   6.280   5.001  10.199
  540   HG13  VAL  75          HG13      VAL  75   5.354   4.472   8.794
  541   HG21  VAL  75          HG23      VAL  75   8.015   3.371  11.198
  542   HG22  VAL  75          HG21      VAL  75   8.708   3.193   9.586
  543   HG23  VAL  75          HG22      VAL  75   8.169   1.770  10.477
  544    H    ASN  76           HN       ASN  76   3.422   3.416  11.680
  545    HA   ASN  76           HA       ASN  76   1.493   2.551   9.771
  546    HB2  ASN  76           HB2      ASN  76   1.246   4.726  11.864
  547    HB3  ASN  76           HB1      ASN  76  -0.084   3.918  11.041
  548   HD21  ASN  76          HD21      ASN  76  -0.642   1.838  11.623
  549   HD22  ASN  76          HD22      ASN  76  -0.059   1.088  13.065
  550    H    VAL  77           HN       VAL  77   0.427   3.727   8.158
  551    HA   VAL  77           HA       VAL  77   1.581   6.368   7.534
  552    HB   VAL  77           HB       VAL  77   1.352   5.803   5.112
  553   HG11  VAL  77          HG11      VAL  77   3.231   4.152   6.789
  554   HG12  VAL  77          HG12      VAL  77   3.527   5.749   6.103
  555   HG13  VAL  77          HG13      VAL  77   3.377   4.349   5.043
  556   HG21  VAL  77          HG23      VAL  77   0.937   3.010   6.171
  557   HG22  VAL  77          HG21      VAL  77   1.228   3.432   4.484
  558   HG23  VAL  77          HG22      VAL  77  -0.242   3.981   5.290
  559    H    GLN  78           HN       GLN  78  -0.871   5.738   8.925
  560    HA   GLN  78           HA       GLN  78  -2.930   6.487   6.980
  561    HB2  GLN  78           HB2      GLN  78  -3.155   5.535   9.839
  562    HB3  GLN  78           HB1      GLN  78  -4.523   5.972   8.823
  563    HG2  GLN  78           HG2      GLN  78  -2.565   3.749   8.288
  564    HG3  GLN  78           HG1      GLN  78  -4.204   3.562   8.910
  565   HE21  GLN  78          HE21      GLN  78  -2.259   4.356   6.135
  566   HE22  GLN  78          HE22      GLN  78  -3.513   4.195   4.958
  567    H    GLY  79           HN       GLY  79  -0.907   8.386   7.872
  568    HA2  GLY  79           HA2      GLY  79  -2.563  10.616   8.334
  569    HA3  GLY  79           HA1      GLY  79  -1.848  10.124   9.860
  570    H    MET  80           HN       MET  80  -0.379  10.011   6.634
  571    HA   MET  80           HA       MET  80   1.412  12.200   7.405
  572    HB2  MET  80           HB2      MET  80   2.310   9.494   6.404
  573    HB3  MET  80           HB1      MET  80   3.356  10.901   6.533
  574    HG2  MET  80           HG2      MET  80   2.804  10.958   8.981
  575    HG3  MET  80           HG1      MET  80   2.013   9.399   8.761
  576    HE1  MET  80           HE3      MET  80   5.028   7.168   7.574
  577    HE2  MET  80           HE1      MET  80   3.933   8.092   6.545
  578    HE3  MET  80           HE2      MET  80   3.301   7.204   7.932
  579    H    ALA  81           HN       ALA  81   2.227  13.410   5.712
  580    HA   ALA  81           HA       ALA  81   0.662  13.491   3.356
  581    HB1  ALA  81           HB3      ALA  81   2.178  15.270   2.635
  582    HB2  ALA  81           HB1      ALA  81   3.276  14.869   3.955
  583    HB3  ALA  81           HB2      ALA  81   1.666  15.496   4.308
  584    H    GLN  82           HN       GLN  82   1.506  13.387   1.142
  585    HA   GLN  82           HA       GLN  82   2.471  10.927   0.432
  586    HB2  GLN  82           HB2      GLN  82   1.421  12.456  -1.151
  587    HB3  GLN  82           HB1      GLN  82   2.812  13.529  -1.068
  588    HG2  GLN  82           HG2      GLN  82   4.215  11.834  -2.078
  589    HG3  GLN  82           HG1      GLN  82   2.864  10.700  -2.096
  590   HE21  GLN  82          HE21      GLN  82   1.205  10.982  -3.578
  591   HE22  GLN  82          HE22      GLN  82   1.360  12.020  -4.951
  592    H    SER  83           HN       SER  83   4.404  13.920   0.609
  593    HA   SER  83           HA       SER  83   6.870  12.881  -0.075
  594    HG   SER  83           HG       SER  83   8.542  15.372   0.533
  595    HB2  SER  83           HB2      SER  83   6.484  15.278   0.190
  596    HB3  SER  83           HB1      SER  83   6.270  15.069   1.928
  597    H    ASP  84           HN       ASP  84   5.257  12.844   3.061
  598    HA   ASP  84           HA       ASP  84   7.475  11.852   4.525
  599    HB2  ASP  84           HB2      ASP  84   4.513  11.765   5.119
  600    HB3  ASP  84           HB1      ASP  84   5.768  11.294   6.262
  601    H    VAL  85           HN       VAL  85   4.783  10.295   2.849
  602    HA   VAL  85           HA       VAL  85   5.204   7.682   3.801
  603    HB   VAL  85           HB       VAL  85   4.151   8.379   1.060
  604   HG11  VAL  85          HG11      VAL  85   4.601   6.007   1.461
  605   HG12  VAL  85          HG12      VAL  85   2.873   6.320   1.303
  606   HG13  VAL  85          HG13      VAL  85   3.579   6.059   2.898
  607   HG21  VAL  85          HG23      VAL  85   2.958   9.740   2.652
  608   HG22  VAL  85          HG21      VAL  85   2.692   8.348   3.697
  609   HG23  VAL  85          HG22      VAL  85   1.913   8.425   2.118
  610    H    VAL  86           HN       VAL  86   6.504   9.399   0.993
  611    HA   VAL  86           HA       VAL  86   7.898   7.207  -0.116
  612    HB   VAL  86           HB       VAL  86   8.531  10.151  -0.388
  613   HG11  VAL  86          HG11      VAL  86   9.301   7.798  -2.111
  614   HG12  VAL  86          HG12      VAL  86  10.384   8.747  -1.093
  615   HG13  VAL  86          HG13      VAL  86   9.610   9.492  -2.493
  616   HG21  VAL  86          HG23      VAL  86   6.239   9.685  -1.034
  617   HG22  VAL  86          HG21      VAL  86   6.777   8.359  -2.064
  618   HG23  VAL  86          HG22      VAL  86   7.217  10.019  -2.463
  619    H    GLU  87           HN       GLU  87   8.764   9.636   2.283
  620    HA   GLU  87           HA       GLU  87  11.515   9.167   2.416
  621    HB2  GLU  87           HB2      GLU  87   9.512  10.142   4.436
  622    HB3  GLU  87           HB1      GLU  87  11.206   9.942   4.861
  623    HG2  GLU  87           HG2      GLU  87  10.211  11.657   2.598
  624    HG3  GLU  87           HG1      GLU  87  10.588  12.251   4.215
  625    H    VAL  88           HN       VAL  88   8.878   7.689   4.291
  626    HA   VAL  88           HA       VAL  88  10.432   6.003   5.880
  627    HB   VAL  88           HB       VAL  88   7.611   5.671   4.861
  628   HG11  VAL  88          HG11      VAL  88   7.338   3.951   6.607
  629   HG12  VAL  88          HG12      VAL  88   9.071   4.023   6.924
  630   HG13  VAL  88          HG13      VAL  88   8.485   3.464   5.357
  631   HG21  VAL  88          HG23      VAL  88   7.019   6.311   7.161
  632   HG22  VAL  88          HG21      VAL  88   7.948   7.566   6.340
  633   HG23  VAL  88          HG22      VAL  88   8.730   6.525   7.530
  634    H    LEU  89           HN       LEU  89   8.788   5.256   2.807
  635    HA   LEU  89           HA       LEU  89   9.678   2.622   2.582
  636    HG   LEU  89           HG       LEU  89   7.104   4.331   1.826
  637    HB2  LEU  89           HB2      LEU  89   9.049   4.569   0.362
  638    HB3  LEU  89           HB1      LEU  89   9.151   2.828   0.190
  639   HD11  LEU  89          HD11      LEU  89   6.852   2.780  -0.747
  640   HD12  LEU  89          HD12      LEU  89   6.738   4.532  -0.569
  641   HD13  LEU  89          HD13      LEU  89   5.519   3.490   0.163
  642   HD21  LEU  89          HD23      LEU  89   6.047   2.117   2.100
  643   HD22  LEU  89          HD21      LEU  89   7.621   2.222   2.885
  644   HD23  LEU  89          HD22      LEU  89   7.458   1.374   1.348
  645    H    ARG  90           HN       ARG  90  11.265   5.643   1.784
  646    HA   ARG  90           HA       ARG  90  13.410   4.323   0.355
  647    HE   ARG  90           HE       ARG  90  12.211   8.949  -0.140
  648    HB2  ARG  90           HB2      ARG  90  12.895   7.195   1.103
  649    HB3  ARG  90           HB1      ARG  90  14.397   6.674   0.350
  650    HG2  ARG  90           HG2      ARG  90  12.968   5.702  -1.501
  651    HG3  ARG  90           HG1      ARG  90  11.623   6.598  -0.793
  652    HD2  ARG  90           HD2      ARG  90  14.226   7.831  -1.682
  653    HD3  ARG  90           HD1      ARG  90  12.757   7.791  -2.655
  654   HH11  ARG  90          HH11      ARG  90  13.851   9.615  -3.141
  655   HH12  ARG  90          HH12      ARG  90  13.636  11.330  -3.028
  656   HH21  ARG  90          HH21      ARG  90  11.920  11.209   0.015
  657   HH22  ARG  90          HH22      ARG  90  12.539  12.236  -1.235
  658    H    ASN  91           HN       ASN  91  12.666   4.961   3.572
  659    HA   ASN  91           HA       ASN  91  15.468   5.055   4.407
  660    HB2  ASN  91           HB2      ASN  91  12.864   5.563   5.823
  661    HB3  ASN  91           HB1      ASN  91  14.349   5.296   6.730
  662   HD21  ASN  91          HD21      ASN  91  14.294   6.885   3.625
  663   HD22  ASN  91          HD22      ASN  91  14.685   8.464   4.207
  664    H    ALA  92           HN       ALA  92  13.009   2.822   3.886
  665    HA   ALA  92           HA       ALA  92  13.266   0.982   5.944
  666    HB1  ALA  92           HB3      ALA  92  12.793   0.389   3.026
  667    HB2  ALA  92           HB1      ALA  92  11.558   0.840   4.200
  668    HB3  ALA  92           HB2      ALA  92  12.430  -0.683   4.379
  669    H    GLY  93           HN       GLY  93  14.572   0.031   2.798
  670    HA2  GLY  93           HA2      GLY  93  16.553  -0.986   2.218
  671    HA3  GLY  93           HA1      GLY  93  17.290  -0.089   3.538
  672    H    ASN  94           HN       ASN  94  14.656  -2.141   4.325
  673    HA   ASN  94           HA       ASN  94  16.368  -4.400   5.017
  674    HB2  ASN  94           HB2      ASN  94  15.693  -4.386   7.358
  675    HB3  ASN  94           HB1      ASN  94  16.444  -2.843   6.961
  676   HD21  ASN  94          HD21      ASN  94  13.379  -4.476   7.439
  677   HD22  ASN  94          HD22      ASN  94  12.475  -3.064   7.853
  678    HA   PRO  95           HA       PRO  95  12.765  -6.889   4.226
  679    HB2  PRO  95           HB2      PRO  95  12.496  -8.426   6.509
  680    HB3  PRO  95           HB1      PRO  95  13.603  -8.786   5.181
  681    HG2  PRO  95           HG2      PRO  95  14.149  -7.448   7.796
  682    HG3  PRO  95           HG1      PRO  95  15.135  -8.626   6.909
  683    HD2  PRO  95           HD2      PRO  95  15.727  -6.015   6.890
  684    HD3  PRO  95           HD1      PRO  95  15.957  -7.023   5.447
  685    H    VAL  96           HN       VAL  96  11.301  -5.126   4.262
  686    HA   VAL  96           HA       VAL  96   9.917  -4.611   6.792
  687    HB   VAL  96           HB       VAL  96   8.874  -2.700   5.557
  688   HG11  VAL  96          HG11      VAL  96  10.883  -1.303   5.587
  689   HG12  VAL  96          HG12      VAL  96  11.889  -2.752   5.634
  690   HG13  VAL  96          HG13      VAL  96  10.821  -2.374   6.986
  691   HG21  VAL  96          HG23      VAL  96  10.859  -3.454   3.413
  692   HG22  VAL  96          HG21      VAL  96   9.856  -2.005   3.434
  693   HG23  VAL  96          HG22      VAL  96   9.106  -3.594   3.291
  694    H    ARG  97           HN       ARG  97   7.650  -4.623   6.938
  695    HA   ARG  97           HA       ARG  97   6.363  -6.521   5.126
  696    HE   ARG  97           HE       ARG  97   4.005  -8.142   7.941
  697    HB2  ARG  97           HB2      ARG  97   5.488  -5.474   7.827
  698    HB3  ARG  97           HB1      ARG  97   4.630  -6.683   6.880
  699    HG2  ARG  97           HG2      ARG  97   6.529  -8.199   7.075
  700    HG3  ARG  97           HG1      ARG  97   7.408  -6.983   8.005
  701    HD2  ARG  97           HD2      ARG  97   6.366  -8.695   9.437
  702    HD3  ARG  97           HD1      ARG  97   5.746  -7.076   9.762
  703   HH11  ARG  97          HH11      ARG  97   5.162  -9.063  11.097
  704   HH12  ARG  97          HH12      ARG  97   3.700  -9.884  11.534
  705   HH21  ARG  97          HH21      ARG  97   2.080  -9.219   8.507
  706   HH22  ARG  97          HH22      ARG  97   1.948  -9.972  10.061
  707    H    LEU  98           HN       LEU  98   4.472  -6.050   4.048
  708    HA   LEU  98           HA       LEU  98   3.702  -3.206   4.007
  709    HG   LEU  98           HG       LEU  98   5.918  -4.557   2.263
  710    HB2  LEU  98           HB2      LEU  98   3.541  -5.175   1.731
  711    HB3  LEU  98           HB1      LEU  98   3.171  -3.463   1.659
  712   HD11  LEU  98          HD11      LEU  98   5.173  -5.201   0.009
  713   HD12  LEU  98          HD12      LEU  98   6.491  -4.030  -0.028
  714   HD13  LEU  98          HD13      LEU  98   4.837  -3.507  -0.348
  715   HD21  LEU  98          HD23      LEU  98   6.639  -2.279   1.725
  716   HD22  LEU  98          HD21      LEU  98   5.530  -2.304   3.098
  717   HD23  LEU  98          HD22      LEU  98   4.955  -1.800   1.508
  718    H    LEU  99           HN       LEU  99   1.877  -3.107   5.195
  719    HA   LEU  99           HA       LEU  99  -0.182  -5.159   4.805
  720    HG   LEU  99           HG       LEU  99  -2.311  -3.706   6.579
  721    HB2  LEU  99           HB2      LEU  99   0.503  -4.664   7.114
  722    HB3  LEU  99           HB1      LEU  99   0.036  -2.989   6.895
  723   HD11  LEU  99          HD11      LEU  99  -1.246  -6.434   7.290
  724   HD12  LEU  99          HD12      LEU  99  -1.916  -5.951   5.733
  725   HD13  LEU  99          HD13      LEU  99  -2.949  -5.997   7.162
  726   HD21  LEU  99          HD23      LEU  99  -1.018  -4.662   9.129
  727   HD22  LEU  99          HD21      LEU  99  -2.728  -4.289   8.917
  728   HD23  LEU  99          HD22      LEU  99  -1.522  -3.009   8.776
  729    H    LEU 100           HN       LEU 100  -1.289  -4.629   2.999
  730    HA   LEU 100           HA       LEU 100  -2.629  -2.012   2.988
  731    HG   LEU 100           HG       LEU 100  -0.013  -3.809   1.323
  732    HB2  LEU 100           HB2      LEU 100  -2.495  -2.366   0.381
  733    HB3  LEU 100           HB1      LEU 100  -1.189  -1.601   1.268
  734   HD11  LEU 100          HD11      LEU 100  -0.752  -5.517  -0.305
  735   HD12  LEU 100          HD12      LEU 100  -2.250  -4.613  -0.526
  736   HD13  LEU 100          HD13      LEU 100  -1.864  -5.312   1.047
  737   HD21  LEU 100          HD23      LEU 100  -0.689  -2.634  -1.368
  738   HD22  LEU 100          HD21      LEU 100   0.638  -3.758  -1.069
  739   HD23  LEU 100          HD22      LEU 100   0.637  -2.169  -0.304
  740    H    ILE 101           HN       ILE 101  -4.693  -1.949   1.991
  741    HA   ILE 101           HA       ILE 101  -6.075  -4.518   2.112
  742    HB   ILE 101           HB       ILE 101  -7.030  -2.661   3.394
  743   HG12  ILE 101          HG12      ILE 101  -8.778  -3.400   1.036
  744   HG13  ILE 101          HG11      ILE 101  -8.493  -4.434   2.432
  745   HG21  ILE 101          HG21      ILE 101  -8.024  -0.736   2.261
  746   HG22  ILE 101          HG22      ILE 101  -7.407  -1.325   0.717
  747   HG23  ILE 101          HG23      ILE 101  -6.285  -0.822   1.981
  748   HD11  ILE 101          HD13      ILE 101  -9.518  -2.727   3.872
  749   HD12  ILE 101          HD11      ILE 101 -10.621  -3.322   2.631
  750   HD13  ILE 101          HD12      ILE 101  -9.850  -1.747   2.444
  751    H    ARG 102           HN       ARG 102  -7.019  -5.489   0.402
  752    HA   ARG 102           HA       ARG 102  -6.837  -4.117  -2.200
  753    HE   ARG 102           HE       ARG 102  -3.899  -4.319  -3.186
  754    HB2  ARG 102           HB2      ARG 102  -5.224  -6.032  -1.838
  755    HB3  ARG 102           HB1      ARG 102  -6.622  -7.096  -1.766
  756    HG2  ARG 102           HG2      ARG 102  -5.767  -7.227  -3.964
  757    HG3  ARG 102           HG1      ARG 102  -7.247  -6.269  -4.049
  758    HD2  ARG 102           HD2      ARG 102  -5.407  -5.316  -5.394
  759    HD3  ARG 102           HD1      ARG 102  -5.972  -4.223  -4.129
  760   HH11  ARG 102          HH11      ARG 102  -4.255  -7.037  -5.341
  761   HH12  ARG 102          HH12      ARG 102  -2.607  -7.546  -5.173
  762   HH21  ARG 102          HH21      ARG 102  -1.732  -4.984  -2.964
  763   HH22  ARG 102          HH22      ARG 102  -1.175  -6.379  -3.827
  764    H    ARG 103           HN       ARG 103  -8.524  -4.369  -3.640
  765    HA   ARG 103           HA       ARG 103 -11.028  -5.280  -2.437
  766    HE   ARG 103           HE       ARG 103 -14.948  -3.695  -5.181
  767    HB2  ARG 103           HB2      ARG 103 -10.978  -3.008  -3.358
  768    HB3  ARG 103           HB1      ARG 103 -10.525  -3.648  -4.932
  769    HG2  ARG 103           HG2      ARG 103 -12.665  -4.832  -5.063
  770    HG3  ARG 103           HG1      ARG 103 -13.119  -4.168  -3.491
  771    HD2  ARG 103           HD2      ARG 103 -12.973  -1.907  -4.399
  772    HD3  ARG 103           HD1      ARG 103 -12.494  -2.559  -5.965
  773   HH11  ARG 103          HH11      ARG 103 -13.595  -0.675  -6.276
  774   HH12  ARG 103          HH12      ARG 103 -15.067  -0.135  -7.011
  775   HH21  ARG 103          HH21      ARG 103 -16.888  -2.991  -6.147
  776   HH22  ARG 103          HH22      ARG 103 -16.939  -1.451  -6.938
  777    H    LEU 104           HN       LEU 104 -12.067  -7.053  -3.085
  778    HA   LEU 104           HA       LEU 104 -10.840  -8.854  -4.913
  779    HG   LEU 104           HG       LEU 104 -11.750  -9.011  -1.965
  780    HB2  LEU 104           HB2      LEU 104 -13.581  -8.932  -3.646
  781    HB3  LEU 104           HB1      LEU 104 -12.823 -10.266  -4.494
  782   HD11  LEU 104          HD11      LEU 104 -13.259 -11.588  -2.374
  783   HD12  LEU 104          HD12      LEU 104 -13.853 -10.150  -1.541
  784   HD13  LEU 104          HD13      LEU 104 -12.504 -11.066  -0.869
  785   HD21  LEU 104          HD23      LEU 104 -10.933 -11.491  -3.475
  786   HD22  LEU 104          HD21      LEU 104 -10.294 -10.987  -1.911
  787   HD23  LEU 104          HD22      LEU 104 -10.007  -9.997  -3.342
  788    HA   PRO 105           HA       PRO 105 -12.884  -7.512  -8.625
  789    HB2  PRO 105           HB2      PRO 105 -12.354  -9.559 -10.240
  790    HB3  PRO 105           HB1      PRO 105 -11.035  -8.573  -9.588
  791    HG2  PRO 105           HG2      PRO 105 -12.076 -11.212  -8.608
  792    HG3  PRO 105           HG1      PRO 105 -10.394 -10.734  -8.916
  793    HD2  PRO 105           HD2      PRO 105 -11.522 -10.696  -6.437
  794    HD3  PRO 105           HD1      PRO 105 -10.240  -9.570  -6.930
  795    H    LEU 106           HN       LEU 106 -14.843  -8.054  -7.017
  796    HA   LEU 106           HA       LEU 106 -16.461 -10.244  -8.065
  797    HG   LEU 106           HG       LEU 106 -15.255 -10.211  -5.336
  798    HB2  LEU 106           HB2      LEU 106 -16.871  -8.353  -5.751
  799    HB3  LEU 106           HB1      LEU 106 -18.055  -9.547  -6.247
  800   HD11  LEU 106          HD11      LEU 106 -16.527  -9.253  -3.505
  801   HD12  LEU 106          HD12      LEU 106 -16.323 -10.989  -3.270
  802   HD13  LEU 106          HD13      LEU 106 -17.866 -10.350  -3.837
  803   HD21  LEU 106          HD23      LEU 106 -16.221 -11.867  -6.842
  804   HD22  LEU 106          HD21      LEU 106 -17.668 -11.950  -5.835
  805   HD23  LEU 106          HD22      LEU 106 -16.116 -12.495  -5.197
  806    H    LEU 107           HN       LEU 107 -17.286  -9.667 -10.007
  807    HA   LEU 107           HA       LEU 107 -18.403  -7.014 -10.401
  808    HG   LEU 107           HG       LEU 107 -16.654  -7.901 -13.577
  809    HB2  LEU 107           HB2      LEU 107 -18.044  -9.387 -12.224
  810    HB3  LEU 107           HB1      LEU 107 -18.917  -7.949 -12.712
  811   HD11  LEU 107          HD11      LEU 107 -16.042  -5.708 -12.882
  812   HD12  LEU 107          HD12      LEU 107 -16.898  -5.892 -11.352
  813   HD13  LEU 107          HD13      LEU 107 -17.803  -5.808 -12.863
  814   HD21  LEU 107          HD23      LEU 107 -15.752  -7.977 -10.699
  815   HD22  LEU 107          HD21      LEU 107 -14.719  -7.777 -12.114
  816   HD23  LEU 107          HD22      LEU 107 -15.585  -9.291 -11.863
  817    H    GLU 108           HN       GLU 108 -20.305  -6.751  -9.387
  818    HA   GLU 108           HA       GLU 108 -22.223  -8.755  -8.943
  819    HB2  GLU 108           HB2      GLU 108 -22.594  -5.757  -9.053
  820    HB3  GLU 108           HB1      GLU 108 -23.747  -6.897  -8.377
  821    HG2  GLU 108           HG2      GLU 108 -22.108  -7.554  -6.689
  822    HG3  GLU 108           HG1      GLU 108 -20.956  -6.404  -7.366
  Start of MODEL   12
    1    H1   GLY   1           HT1      GLY   1 -10.642  -6.679  19.399
    2    H2   GLY   1           HT2      GLY   1  -9.104  -7.235  19.830
    3    H3   GLY   1           HT3      GLY   1  -9.616  -7.328  18.221
    4    HA2  GLY   1           HA1      GLY   1  -9.108  -4.835  19.751
    5    HA3  GLY   1           HA2      GLY   1  -8.068  -5.502  18.502
    6    H    SER   2           HN       SER   2  -8.191  -3.797  17.094
    7    HA   SER   2           HA       SER   2 -10.800  -2.841  16.233
    8    HG   SER   2           HG       SER   2  -7.482  -2.243  14.612
    9    HB2  SER   2           HB2      SER   2  -9.417  -1.261  14.827
   10    HB3  SER   2           HB1      SER   2  -9.167  -1.120  16.568
   11    H    HIS   3           HN       HIS   3  -7.855  -3.793  14.462
   12    HA   HIS   3           HA       HIS   3  -9.188  -4.318  12.047
   13    HD1  HIS   3           HD1      HIS   3  -5.517  -3.358  13.997
   14    HD2  HIS   3           HD2      HIS   3  -7.081  -2.768  10.192
   15    HE1  HIS   3           HE1      HIS   3  -4.700  -1.090  13.279
   16    HE2  HIS   3           HE2      HIS   3  -5.625  -0.771  10.957
   17    HB2  HIS   3           HB2      HIS   3  -6.551  -5.452  13.003
   18    HB3  HIS   3           HB1      HIS   3  -7.104  -5.378  11.333
   19    H    GLY   4           HN       GLY   4 -10.324  -6.019  11.346
   20    HA2  GLY   4           HA2      GLY   4  -9.835  -8.700  12.032
   21    HA3  GLY   4           HA1      GLY   4 -11.116  -8.090  13.067
   22    H    TYR   5           HN       TYR   5 -10.427  -7.373   9.659
   23    HA   TYR   5           HA       TYR   5 -13.170  -8.204   9.023
   24    HD1  TYR   5           HD1      TYR   5 -14.798  -6.004   8.305
   25    HD2  TYR   5           HD2      TYR   5 -10.789  -4.746   8.969
   26    HE1  TYR   5           HE1      TYR   5 -15.624  -4.040   9.533
   27    HE2  TYR   5           HE2      TYR   5 -11.603  -2.779  10.198
   28    HH   TYR   5           HH       TYR   5 -14.829  -2.454  11.221
   29    HB2  TYR   5           HB2      TYR   5 -11.235  -6.499   7.441
   30    HB3  TYR   5           HB1      TYR   5 -12.881  -6.887   6.953
   31    H    SER   6           HN       SER   6 -12.326 -10.456   9.206
   32    HA   SER   6           HA       SER   6 -10.506 -11.466   7.268
   33    HG   SER   6           HG       SER   6 -10.276 -13.914   7.605
   34    HB2  SER   6           HB2      SER   6 -10.886 -12.627   9.391
   35    HB3  SER   6           HB1      SER   6 -12.569 -12.914   8.947
   36    H    ASP   7           HN       ASP   7 -11.293 -10.662   5.276
   37    HA   ASP   7           HA       ASP   7 -12.449 -10.727   3.318
   38    HB2  ASP   7           HB2      ASP   7 -11.736 -13.081   3.384
   39    HB3  ASP   7           HB1      ASP   7 -13.184 -13.498   4.295
   40    H    ALA   8           HN       ALA   8 -13.916  -9.087   3.937
   41    HA   ALA   8           HA       ALA   8 -16.639 -10.087   4.445
   42    HB1  ALA   8           HB3      ALA   8 -15.437  -7.590   5.635
   43    HB2  ALA   8           HB1      ALA   8 -15.747  -9.096   6.498
   44    HB3  ALA   8           HB2      ALA   8 -17.092  -8.155   5.854
   45    H    SER   9           HN       SER   9 -17.853  -9.686   2.736
   46    HA   SER   9           HA       SER   9 -18.750  -8.711   0.891
   47    HG   SER   9           HG       SER   9 -20.256  -6.261   0.819
   48    HB2  SER   9           HB2      SER   9 -19.397  -7.018   2.587
   49    HB3  SER   9           HB1      SER   9 -17.910  -6.135   2.243
   50    H    GLY  10           HN       GLY  10 -15.966  -9.485   0.783
   51    HA2  GLY  10           HA2      GLY  10 -14.599  -9.447  -1.157
   52    HA3  GLY  10           HA1      GLY  10 -15.193  -7.831  -1.510
   53    H    PHE  11           HN       PHE  11 -14.748  -6.719   1.080
   54    HA   PHE  11           HA       PHE  11 -12.085  -5.867   0.804
   55    HD1  PHE  11           HD2      PHE  11 -12.121  -3.052   1.361
   56    HD2  PHE  11           HD1      PHE  11 -15.890  -4.902   2.054
   57    HE1  PHE  11           HE2      PHE  11 -13.242  -1.195   0.199
   58    HE2  PHE  11           HE1      PHE  11 -17.018  -3.050   0.892
   59    HZ   PHE  11           HZ       PHE  11 -15.695  -1.184  -0.021
   60    HB2  PHE  11           HB2      PHE  11 -13.951  -5.674   3.178
   61    HB3  PHE  11           HB1      PHE  11 -12.413  -4.827   3.049
   62    H    SER  12           HN       SER  12 -10.614  -7.515   0.819
   63    HA   SER  12           HA       SER  12 -10.437  -9.116   3.282
   64    HG   SER  12           HG       SER  12 -11.739 -10.042   1.432
   65    HB2  SER  12           HB2      SER  12  -9.317  -9.719   0.534
   66    HB3  SER  12           HB1      SER  12  -9.152 -10.748   1.956
   67    H    LEU  13           HN       LEU  13  -8.544  -9.209   4.419
   68    HA   LEU  13           HA       LEU  13  -6.717  -7.019   4.033
   69    HG   LEU  13           HG       LEU  13  -8.690  -7.922   6.296
   70    HB2  LEU  13           HB2      LEU  13  -6.609  -9.268   6.045
   71    HB3  LEU  13           HB1      LEU  13  -5.683  -7.780   6.101
   72   HD11  LEU  13          HD11      LEU  13  -6.625  -7.539   8.459
   73   HD12  LEU  13          HD12      LEU  13  -7.628  -8.971   8.225
   74   HD13  LEU  13          HD13      LEU  13  -8.373  -7.434   8.664
   75   HD21  LEU  13          HD23      LEU  13  -8.010  -5.813   5.419
   76   HD22  LEU  13          HD21      LEU  13  -6.706  -5.679   6.599
   77   HD23  LEU  13          HD22      LEU  13  -8.387  -5.580   7.126
   78    H    TYR  14           HN       TYR  14  -4.927  -7.079   2.862
   79    HA   TYR  14           HA       TYR  14  -3.730  -9.701   2.267
   80    HD1  TYR  14           HD1      TYR  14  -6.354  -7.797   0.310
   81    HD2  TYR  14           HD2      TYR  14  -3.256 -10.538  -0.692
   82    HE1  TYR  14           HE1      TYR  14  -7.960  -9.128  -0.990
   83    HE2  TYR  14           HE2      TYR  14  -4.855 -11.875  -1.995
   84    HH   TYR  14           HH       TYR  14  -7.298 -12.257  -2.082
   85    HB2  TYR  14           HB2      TYR  14  -4.003  -7.208   0.617
   86    HB3  TYR  14           HB1      TYR  14  -2.731  -8.374   0.266
   87    H    SER  15           HN       SER  15  -1.762 -10.084   3.007
   88    HA   SER  15           HA       SER  15  -0.099  -7.791   3.821
   89    HG   SER  15           HG       SER  15   1.815  -9.576   5.244
   90    HB2  SER  15           HB2      SER  15  -0.917  -9.018   5.773
   91    HB3  SER  15           HB1      SER  15  -0.279 -10.524   5.113
   92    H    VAL  16           HN       VAL  16   1.812  -7.627   2.868
   93    HA   VAL  16           HA       VAL  16   2.981 -10.023   1.609
   94    HB   VAL  16           HB       VAL  16   3.215  -7.215   0.527
   95   HG11  VAL  16          HG11      VAL  16   4.042  -8.361  -1.488
   96   HG12  VAL  16          HG12      VAL  16   3.947  -9.899  -0.631
   97   HG13  VAL  16          HG13      VAL  16   5.064  -8.651  -0.081
   98   HG21  VAL  16          HG23      VAL  16   1.403  -9.445  -0.388
   99   HG22  VAL  16          HG21      VAL  16   1.652  -7.915  -1.230
  100   HG23  VAL  16          HG22      VAL  16   0.900  -7.932   0.365
  101    H    GLU  17           HN       GLU  17   5.307 -10.065   1.495
  102    HA   GLU  17           HA       GLU  17   6.595  -8.278   3.455
  103    HB2  GLU  17           HB2      GLU  17   7.147 -11.208   2.964
  104    HB3  GLU  17           HB1      GLU  17   8.087 -10.173   4.032
  105    HG2  GLU  17           HG2      GLU  17   6.125  -9.811   5.427
  106    HG3  GLU  17           HG1      GLU  17   5.164 -10.821   4.348
  107    H    LEU  18           HN       LEU  18   8.086  -7.029   2.603
  108    HA   LEU  18           HA       LEU  18   9.542  -7.953   0.216
  109    HG   LEU  18           HG       LEU  18   7.993  -4.986  -1.330
  110    HB2  LEU  18           HB2      LEU  18   8.530  -5.261   1.026
  111    HB3  LEU  18           HB1      LEU  18   9.977  -5.360   0.042
  112   HD11  LEU  18          HD11      LEU  18   9.864  -6.248  -2.267
  113   HD12  LEU  18          HD12      LEU  18   8.323  -6.787  -2.932
  114   HD13  LEU  18          HD13      LEU  18   9.138  -7.751  -1.700
  115   HD21  LEU  18          HD23      LEU  18   6.261  -6.686  -1.533
  116   HD22  LEU  18          HD21      LEU  18   6.347  -6.072   0.119
  117   HD23  LEU  18          HD22      LEU  18   7.039  -7.646  -0.275
  118    H    PHE  19           HN       PHE  19  11.768  -6.938   0.016
  119    HA   PHE  19           HA       PHE  19  13.009  -6.570   2.653
  120    HD1  PHE  19           HD2      PHE  19  12.008  -9.769   0.531
  121    HD2  PHE  19           HD1      PHE  19  14.320  -9.008   4.022
  122    HE1  PHE  19           HE2      PHE  19  10.883 -11.634   1.677
  123    HE2  PHE  19           HE1      PHE  19  13.201 -10.872   5.174
  124    HZ   PHE  19           HZ       PHE  19  11.480 -12.186   4.003
  125    HB2  PHE  19           HB2      PHE  19  14.027  -8.385   0.458
  126    HB3  PHE  19           HB1      PHE  19  14.902  -8.000   1.936
  127    H    ARG  20           HN       ARG  20  13.847  -4.592   2.652
  128    HA   ARG  20           HA       ARG  20  14.930  -3.491   0.162
  129    HE   ARG  20           HE       ARG  20  16.021   1.263  -0.455
  130    HB2  ARG  20           HB2      ARG  20  13.401  -2.009   1.233
  131    HB3  ARG  20           HB1      ARG  20  14.166  -2.238   2.798
  132    HG2  ARG  20           HG2      ARG  20  14.702  -0.060   1.875
  133    HG3  ARG  20           HG1      ARG  20  16.151  -1.055   2.010
  134    HD2  ARG  20           HD2      ARG  20  15.929  -1.619  -0.394
  135    HD3  ARG  20           HD1      ARG  20  14.560  -0.512  -0.495
  136   HH11  ARG  20          HH11      ARG  20  17.718  -1.666   0.376
  137   HH12  ARG  20          HH12      ARG  20  19.287  -0.940   0.263
  138   HH21  ARG  20          HH21      ARG  20  18.082   2.223  -0.612
  139   HH22  ARG  20          HH22      ARG  20  19.494   1.268  -0.300
  140    H    GLU  21           HN       GLU  21  16.969  -4.181  -0.132
  141    HA   GLU  21           HA       GLU  21  19.004  -3.266   1.677
  142    HB2  GLU  21           HB2      GLU  21  20.025  -5.472   2.063
  143    HB3  GLU  21           HB1      GLU  21  18.422  -5.362   2.777
  144    HG2  GLU  21           HG2      GLU  21  17.490  -6.608   0.904
  145    HG3  GLU  21           HG1      GLU  21  19.087  -6.698   0.163
  146    H    LYS  22           HN       LYS  22  18.048  -3.206  -1.200
  147    HA   LYS  22           HA       LYS  22  20.511  -4.125  -2.511
  148    HB2  LYS  22           HB2      LYS  22  17.782  -3.495  -3.639
  149    HB3  LYS  22           HB1      LYS  22  19.190  -3.834  -4.634
  150    HG2  LYS  22           HG2      LYS  22  18.047  -5.861  -4.532
  151    HG3  LYS  22           HG1      LYS  22  19.348  -6.037  -3.354
  152    HD2  LYS  22           HD2      LYS  22  17.775  -5.458  -1.553
  153    HD3  LYS  22           HD1      LYS  22  16.478  -5.329  -2.743
  154    HE2  LYS  22           HE2      LYS  22  16.788  -7.685  -3.330
  155    HE3  LYS  22           HE1      LYS  22  18.082  -7.812  -2.141
  156    HZ1  LYS  22           HZ3      LYS  22  15.237  -7.186  -1.555
  157    HZ2  LYS  22           HZ1      LYS  22  16.476  -7.279  -0.405
  158    HZ3  LYS  22           HZ2      LYS  22  16.009  -8.662  -1.261
  159    H    ASP  23           HN       ASP  23  21.366  -2.742  -4.246
  160    HA   ASP  23           HA       ASP  23  21.555  -0.010  -3.326
  161    HB2  ASP  23           HB2      ASP  23  23.276   0.196  -5.119
  162    HB3  ASP  23           HB1      ASP  23  23.597  -1.120  -3.992
  163    H    THR  24           HN       THR  24  19.009  -0.324  -4.089
  164    HA   THR  24           HA       THR  24  18.854   0.993  -6.723
  165    HB   THR  24           HB       THR  24  16.601   0.120  -6.977
  166    HG1  THR  24           HG1      THR  24  16.793  -0.270  -4.335
  167   HG21  THR  24          HG23      THR  24  18.531  -2.061  -6.174
  168   HG22  THR  24          HG21      THR  24  18.457  -1.281  -7.755
  169   HG23  THR  24          HG22      THR  24  17.105  -2.265  -7.192
  170    H    SER  25           HN       SER  25  18.078   1.139  -3.368
  171    HA   SER  25           HA       SER  25  17.139   2.723  -2.040
  172    HG   SER  25           HG       SER  25  19.241   4.157  -2.035
  173    HB2  SER  25           HB2      SER  25  17.727   4.528  -4.399
  174    HB3  SER  25           HB1      SER  25  17.341   5.070  -2.766
  175    H    SER  26           HN       SER  26  15.537   1.308  -4.261
  176    HA   SER  26           HA       SER  26  13.082   2.810  -3.778
  177    HG   SER  26           HG       SER  26  14.238   0.916  -6.395
  178    HB2  SER  26           HB2      SER  26  12.405   2.661  -6.147
  179    HB3  SER  26           HB1      SER  26  13.867   3.629  -5.953
  180    H    LEU  27           HN       LEU  27  11.158   1.559  -4.049
  181    HA   LEU  27           HA       LEU  27  11.652  -1.343  -3.973
  182    HG   LEU  27           HG       LEU  27  11.668   0.398  -1.440
  183    HB2  LEU  27           HB2      LEU  27   9.480   0.256  -2.616
  184    HB3  LEU  27           HB1      LEU  27   9.608  -1.492  -2.583
  185   HD11  LEU  27          HD11      LEU  27  10.823  -0.331   0.740
  186   HD12  LEU  27          HD12      LEU  27   9.544  -1.241  -0.063
  187   HD13  LEU  27          HD13      LEU  27   9.588   0.518  -0.189
  188   HD21  LEU  27          HD23      LEU  27  11.376  -2.599  -1.238
  189   HD22  LEU  27          HD21      LEU  27  12.579  -1.619  -0.399
  190   HD23  LEU  27          HD22      LEU  27  12.607  -1.735  -2.159
  191    H    GLY  28           HN       GLY  28   9.980   1.216  -5.523
  192    HA2  GLY  28           HA2      GLY  28   8.994   0.992  -7.660
  193    HA3  GLY  28           HA1      GLY  28   8.745  -0.717  -7.341
  194    H    ILE  29           HN       ILE  29   7.861   1.820  -5.088
  195    HA   ILE  29           HA       ILE  29   5.035   1.107  -5.514
  196    HB   ILE  29           HB       ILE  29   6.250   2.338  -3.040
  197   HG12  ILE  29          HG12      ILE  29   5.433  -0.539  -3.503
  198   HG13  ILE  29          HG11      ILE  29   7.097   0.034  -3.507
  199   HG21  ILE  29          HG21      ILE  29   3.548   1.091  -3.532
  200   HG22  ILE  29          HG22      ILE  29   3.877   2.815  -3.355
  201   HG23  ILE  29          HG23      ILE  29   4.129   1.724  -1.991
  202   HD11  ILE  29          HD13      ILE  29   6.567  -0.986  -1.390
  203   HD12  ILE  29          HD11      ILE  29   5.193   0.099  -1.178
  204   HD13  ILE  29          HD12      ILE  29   6.835   0.743  -1.171
  205    H    SER  30           HN       SER  30   3.905   2.585  -6.578
  206    HA   SER  30           HA       SER  30   4.648   5.419  -6.272
  207    HG   SER  30           HG       SER  30   3.249   6.598  -7.863
  208    HB2  SER  30           HB2      SER  30   4.939   4.603  -8.567
  209    HB3  SER  30           HB1      SER  30   3.260   4.065  -8.598
  210    H    ILE  31           HN       ILE  31   3.341   6.292  -4.799
  211    HA   ILE  31           HA       ILE  31   0.527   5.498  -4.707
  212    HB   ILE  31           HB       ILE  31   0.446   6.769  -2.587
  213   HG12  ILE  31          HG12      ILE  31   3.432   7.088  -2.973
  214   HG13  ILE  31          HG11      ILE  31   2.257   8.383  -3.183
  215   HG21  ILE  31          HG21      ILE  31   2.655   4.722  -2.749
  216   HG22  ILE  31          HG22      ILE  31   0.933   4.384  -2.578
  217   HG23  ILE  31          HG23      ILE  31   1.803   5.205  -1.282
  218   HD11  ILE  31          HD13      ILE  31   1.629   8.195  -0.835
  219   HD12  ILE  31          HD11      ILE  31   3.352   8.519  -1.021
  220   HD13  ILE  31          HD12      ILE  31   2.799   6.891  -0.626
  221    H    SER  32           HN       SER  32  -1.163   6.990  -4.824
  222    HA   SER  32           HA       SER  32  -0.455   9.538  -6.120
  223    HG   SER  32           HG       SER  32  -2.237  10.444  -7.277
  224    HB2  SER  32           HB2      SER  32  -1.723   8.021  -7.575
  225    HB3  SER  32           HB1      SER  32  -2.999   7.913  -6.364
  226    H    GLY  33           HN       GLY  33  -1.291  11.435  -5.361
  227    HA2  GLY  33           HA2      GLY  33  -2.470  11.336  -2.699
  228    HA3  GLY  33           HA1      GLY  33  -1.853  12.766  -3.515
  229    H    MET  34           HN       MET  34  -4.604  11.189  -2.504
  230    HA   MET  34           HA       MET  34  -6.327  12.328  -4.568
  231    HB2  MET  34           HB2      MET  34  -6.761  10.024  -3.819
  232    HB3  MET  34           HB1      MET  34  -7.022  10.608  -2.181
  233    HG2  MET  34           HG2      MET  34  -8.933  11.929  -2.976
  234    HG3  MET  34           HG1      MET  34  -8.682  11.285  -4.598
  235    HE1  MET  34           HE3      MET  34  -9.920   8.723  -0.964
  236    HE2  MET  34           HE1      MET  34  -9.685  10.469  -0.899
  237    HE3  MET  34           HE2      MET  34  -8.304   9.403  -1.155
  238    H    ARG  35           HN       ARG  35  -7.034  14.339  -4.340
  239    HA   ARG  35           HA       ARG  35  -7.372  15.408  -1.618
  240    HE   ARG  35           HE       ARG  35  -5.323  16.648  -5.338
  241    HB2  ARG  35           HB2      ARG  35  -6.805  16.823  -4.224
  242    HB3  ARG  35           HB1      ARG  35  -7.234  17.660  -2.741
  243    HG2  ARG  35           HG2      ARG  35  -4.914  17.780  -2.814
  244    HG3  ARG  35           HG1      ARG  35  -5.236  16.453  -1.697
  245    HD2  ARG  35           HD2      ARG  35  -3.449  15.868  -3.242
  246    HD3  ARG  35           HD1      ARG  35  -4.862  14.845  -3.501
  247   HH11  ARG  35          HH11      ARG  35  -2.263  15.247  -4.443
  248   HH12  ARG  35          HH12      ARG  35  -1.574  15.423  -6.023
  249   HH21  ARG  35          HH21      ARG  35  -4.423  16.887  -7.421
  250   HH22  ARG  35          HH22      ARG  35  -2.802  16.355  -7.714
  251    H    ASP  36           HN       ASP  36  -9.280  16.267  -0.992
  252    HA   ASP  36           HA       ASP  36 -11.430  16.513  -2.972
  253    HB2  ASP  36           HB2      ASP  36 -11.723  15.086  -0.319
  254    HB3  ASP  36           HB1      ASP  36 -13.004  15.363  -1.495
  255    H    GLN  37           HN       GLN  37 -12.357  18.443  -2.820
  256    HA   GLN  37           HA       GLN  37 -12.360  19.798  -0.205
  257    HB2  GLN  37           HB2      GLN  37 -12.142  21.944  -1.433
  258    HB3  GLN  37           HB1      GLN  37 -10.741  20.896  -1.613
  259    HG2  GLN  37           HG2      GLN  37 -11.485  20.228  -3.816
  260    HG3  GLN  37           HG1      GLN  37 -12.949  21.191  -3.636
  261   HE21  GLN  37          HE21      GLN  37 -11.556  23.369  -2.291
  262   HE22  GLN  37          HE22      GLN  37 -10.664  24.198  -3.516
  263    H    SER  38           HN       SER  38 -14.372  18.156  -1.823
  264    HA   SER  38           HA       SER  38 -16.507  20.175  -1.978
  265    HG   SER  38           HG       SER  38 -16.795  16.573  -3.771
  266    HB2  SER  38           HB2      SER  38 -17.743  18.416  -3.292
  267    HB3  SER  38           HB1      SER  38 -16.283  19.025  -4.072
  268    H    THR  39           HN       THR  39 -18.739  19.143  -1.510
  269    HA   THR  39           HA       THR  39 -20.166  18.516   0.151
  270    HB   THR  39           HB       THR  39 -20.001  16.208   0.896
  271    HG1  THR  39           HG1      THR  39 -17.466  16.083  -0.386
  272   HG21  THR  39          HG23      THR  39 -19.148  16.529  -1.984
  273   HG22  THR  39          HG21      THR  39 -20.803  16.597  -1.375
  274   HG23  THR  39          HG22      THR  39 -19.893  15.089  -1.288
  275    H    THR  40           HN       THR  40 -19.845  17.063   2.489
  276    HA   THR  40           HA       THR  40 -17.851  18.569   4.036
  277    HB   THR  40           HB       THR  40 -19.460  19.017   5.811
  278    HG1  THR  40           HG1      THR  40 -20.887  17.154   4.638
  279   HG21  THR  40          HG23      THR  40 -20.829  20.699   4.690
  280   HG22  THR  40          HG21      THR  40 -20.499  19.943   3.130
  281   HG23  THR  40          HG22      THR  40 -19.190  20.698   4.039
  282    H    GLY  41           HN       GLY  41 -17.752  15.851   3.147
  283    HA2  GLY  41           HA2      GLY  41 -17.300  14.580   5.694
  284    HA3  GLY  41           HA1      GLY  41 -18.624  13.867   4.788
  285    H    GLU  42           HN       GLU  42 -15.703  15.228   3.369
  286    HA   GLU  42           HA       GLU  42 -15.209  12.770   1.956
  287    HB2  GLU  42           HB2      GLU  42 -13.664  15.367   2.048
  288    HB3  GLU  42           HB1      GLU  42 -13.285  14.021   0.983
  289    HG2  GLU  42           HG2      GLU  42 -15.846  15.602   0.985
  290    HG3  GLU  42           HG1      GLU  42 -14.528  15.765  -0.174
  291    H    ALA  43           HN       ALA  43 -12.982  11.826   1.893
  292    HA   ALA  43           HA       ALA  43 -11.476  12.072   4.377
  293    HB1  ALA  43           HB3      ALA  43 -13.151  10.347   4.846
  294    HB2  ALA  43           HB1      ALA  43 -11.518   9.683   4.829
  295    HB3  ALA  43           HB2      ALA  43 -12.588   9.427   3.450
  296    H    THR  44           HN       THR  44  -9.406  12.234   3.857
  297    HA   THR  44           HA       THR  44  -8.476  11.369   1.250
  298    HB   THR  44           HB       THR  44  -6.352  12.455   1.870
  299    HG1  THR  44           HG1      THR  44  -7.680  13.078   4.318
  300   HG21  THR  44          HG23      THR  44  -8.792  14.141   2.450
  301   HG22  THR  44          HG21      THR  44  -8.121  13.802   0.855
  302   HG23  THR  44          HG22      THR  44  -7.197  14.757   2.016
  303    H    GLY  45           HN       GLY  45  -6.606  10.018   0.950
  304    HA2  GLY  45           HA2      GLY  45  -5.508   8.520   3.127
  305    HA3  GLY  45           HA1      GLY  45  -6.682   7.581   2.220
  306    H    ILE  46           HN       ILE  46  -3.877   7.037   2.512
  307    HA   ILE  46           HA       ILE  46  -2.701   7.678  -0.074
  308    HB   ILE  46           HB       ILE  46  -1.560   6.004   2.166
  309   HG12  ILE  46          HG12      ILE  46  -1.973   8.298   2.916
  310   HG13  ILE  46          HG11      ILE  46  -0.246   8.004   2.748
  311   HG21  ILE  46          HG21      ILE  46   0.591   6.408   1.051
  312   HG22  ILE  46          HG22      ILE  46  -0.254   7.248  -0.250
  313   HG23  ILE  46          HG23      ILE  46  -0.538   5.528   0.019
  314   HD11  ILE  46          HD13      ILE  46  -0.287   9.160   0.578
  315   HD12  ILE  46          HD11      ILE  46  -0.801  10.191   1.913
  316   HD13  ILE  46          HD12      ILE  46  -2.001   9.503   0.818
  317    H    TYR  47           HN       TYR  47  -2.529   6.299  -1.751
  318    HA   TYR  47           HA       TYR  47  -2.923   3.451  -1.390
  319    HD1  TYR  47           HD1      TYR  47  -5.134   6.856  -2.028
  320    HD2  TYR  47           HD2      TYR  47  -4.907   3.983  -5.157
  321    HE1  TYR  47           HE1      TYR  47  -5.747   8.591  -3.659
  322    HE2  TYR  47           HE2      TYR  47  -5.520   5.708  -6.796
  323    HH   TYR  47           HH       TYR  47  -6.663   7.869  -6.855
  324    HB2  TYR  47           HB2      TYR  47  -4.793   3.269  -2.925
  325    HB3  TYR  47           HB1      TYR  47  -5.227   4.351  -1.607
  326    H    VAL  48           HN       VAL  48  -2.056   2.224  -3.043
  327    HA   VAL  48           HA       VAL  48  -0.170   3.558  -4.744
  328    HB   VAL  48           HB       VAL  48  -0.933   0.635  -4.614
  329   HG11  VAL  48          HG11      VAL  48   1.398   1.996  -5.964
  330   HG12  VAL  48          HG12      VAL  48   0.060   1.163  -6.759
  331   HG13  VAL  48          HG13      VAL  48   1.208   0.252  -5.776
  332   HG21  VAL  48          HG23      VAL  48   1.130   0.377  -3.325
  333   HG22  VAL  48          HG21      VAL  48   0.004   1.468  -2.519
  334   HG23  VAL  48          HG22      VAL  48   1.392   2.119  -3.391
  335    H    LYS  49           HN       LYS  49  -0.565   4.337  -6.693
  336    HA   LYS  49           HA       LYS  49  -2.969   3.464  -8.121
  337    HB2  LYS  49           HB2      LYS  49  -2.693   5.879  -7.692
  338    HB3  LYS  49           HB1      LYS  49  -1.188   5.861  -8.599
  339    HG2  LYS  49           HG2      LYS  49  -2.389   5.269 -10.624
  340    HG3  LYS  49           HG1      LYS  49  -3.906   5.215  -9.724
  341    HD2  LYS  49           HD2      LYS  49  -3.707   7.582  -9.205
  342    HD3  LYS  49           HD1      LYS  49  -2.152   7.651 -10.037
  343    HE2  LYS  49           HE2      LYS  49  -3.944   8.524 -11.443
  344    HE3  LYS  49           HE1      LYS  49  -3.243   7.064 -12.139
  345    HZ1  LYS  49           HZ3      LYS  49  -5.106   5.799 -11.250
  346    HZ2  LYS  49           HZ1      LYS  49  -5.647   7.029 -12.280
  347    HZ3  LYS  49           HZ2      LYS  49  -5.782   7.209 -10.604
  348    H    SER  50           HN       SER  50   0.477   3.349  -8.252
  349    HA   SER  50           HA       SER  50   0.355   1.651 -10.592
  350    HG   SER  50           HG       SER  50   2.029   1.896 -12.166
  351    HB2  SER  50           HB2      SER  50   0.543   3.870 -11.616
  352    HB3  SER  50           HB1      SER  50   1.968   4.214 -10.633
  353    H    LEU  51           HN       LEU  51   2.514   0.716 -11.113
  354    HA   LEU  51           HA       LEU  51   4.310   0.653  -8.785
  355    HG   LEU  51           HG       LEU  51   1.764  -0.910  -8.511
  356    HB2  LEU  51           HB2      LEU  51   3.290  -1.726 -10.339
  357    HB3  LEU  51           HB1      LEU  51   4.577  -1.795  -9.150
  358   HD11  LEU  51          HD11      LEU  51   1.467  -3.123  -7.518
  359   HD12  LEU  51          HD12      LEU  51   3.050  -3.609  -8.123
  360   HD13  LEU  51          HD13      LEU  51   1.751  -3.230  -9.255
  361   HD21  LEU  51          HD23      LEU  51   3.465  -0.075  -6.979
  362   HD22  LEU  51          HD21      LEU  51   4.083  -1.713  -6.757
  363   HD23  LEU  51          HD22      LEU  51   2.461  -1.299  -6.199
  364    H    ILE  52           HN       ILE  52   6.493   0.021  -9.262
  365    HA   ILE  52           HA       ILE  52   7.270   0.742 -11.991
  366    HB   ILE  52           HB       ILE  52   9.024   0.419  -9.554
  367   HG12  ILE  52          HG12      ILE  52   7.410   2.240  -9.242
  368   HG13  ILE  52          HG11      ILE  52   9.038   2.874  -9.451
  369   HG21  ILE  52          HG21      ILE  52  10.671   1.673 -10.878
  370   HG22  ILE  52          HG22      ILE  52   9.568   1.646 -12.253
  371   HG23  ILE  52          HG23      ILE  52  10.239   0.139 -11.632
  372   HD11  ILE  52          HD13      ILE  52   8.519   3.415 -11.779
  373   HD12  ILE  52          HD11      ILE  52   7.419   4.213 -10.654
  374   HD13  ILE  52          HD12      ILE  52   6.883   2.793 -11.553
  375    HA   PRO  53           HA       PRO  53   7.733  -3.724 -12.664
  376    HB2  PRO  53           HB2      PRO  53   8.807  -2.743 -15.249
  377    HB3  PRO  53           HB1      PRO  53   7.530  -3.924 -14.934
  378    HG2  PRO  53           HG2      PRO  53   6.942  -1.479 -15.822
  379    HG3  PRO  53           HG1      PRO  53   5.912  -2.292 -14.627
  380    HD2  PRO  53           HD2      PRO  53   7.939  -0.126 -14.227
  381    HD3  PRO  53           HD1      PRO  53   6.346  -0.333 -13.469
  382    H    GLY  54           HN       GLY  54   9.446  -5.068 -12.428
  383    HA2  GLY  54           HA2      GLY  54  11.695  -5.747 -12.651
  384    HA3  GLY  54           HA1      GLY  54  12.140  -4.083 -13.000
  385    H    SER  55           HN       SER  55  10.321  -3.449 -10.547
  386    HA   SER  55           HA       SER  55  12.506  -3.392  -8.670
  387    HG   SER  55           HG       SER  55  10.486  -0.450  -8.820
  388    HB2  SER  55           HB2      SER  55   9.637  -2.463  -8.397
  389    HB3  SER  55           HB1      SER  55  10.919  -2.154  -7.225
  390    H    ALA  56           HN       ALA  56  11.712  -3.832  -6.245
  391    HA   ALA  56           HA       ALA  56  11.390  -6.655  -6.075
  392    HB1  ALA  56           HB3      ALA  56  11.259  -4.591  -3.880
  393    HB2  ALA  56           HB1      ALA  56  12.725  -5.378  -4.462
  394    HB3  ALA  56           HB2      ALA  56  11.471  -6.329  -3.666
  395    H    ALA  57           HN       ALA  57   9.296  -3.917  -5.215
  396    HA   ALA  57           HA       ALA  57   7.141  -5.368  -4.200
  397    HB1  ALA  57           HB3      ALA  57   7.366  -2.959  -3.928
  398    HB2  ALA  57           HB1      ALA  57   5.805  -3.369  -4.636
  399    HB3  ALA  57           HB2      ALA  57   7.094  -2.728  -5.654
  400    H    ALA  58           HN       ALA  58   7.900  -4.424  -7.525
  401    HA   ALA  58           HA       ALA  58   5.452  -5.358  -8.640
  402    HB1  ALA  58           HB3      ALA  58   6.533  -5.044 -10.796
  403    HB2  ALA  58           HB1      ALA  58   8.098  -4.871 -10.002
  404    HB3  ALA  58           HB2      ALA  58   6.839  -3.665  -9.741
  405    H    LEU  59           HN       LEU  59   8.759  -6.693  -8.710
  406    HA   LEU  59           HA       LEU  59   8.101  -9.091 -10.001
  407    HG   LEU  59           HG       LEU  59  10.386  -7.203 -10.287
  408    HB2  LEU  59           HB2      LEU  59  10.357  -8.438  -8.109
  409    HB3  LEU  59           HB1      LEU  59  10.246  -9.936  -9.012
  410   HD11  LEU  59          HD11      LEU  59  12.447  -7.675  -9.087
  411   HD12  LEU  59          HD12      LEU  59  12.703  -7.776 -10.829
  412   HD13  LEU  59          HD13      LEU  59  12.561  -9.251  -9.872
  413   HD21  LEU  59          HD23      LEU  59  10.666  -9.979 -11.434
  414   HD22  LEU  59          HD21      LEU  59  10.875  -8.471 -12.322
  415   HD23  LEU  59          HD22      LEU  59   9.295  -8.895 -11.664
  416    H    ASP  60           HN       ASP  60   7.537  -8.064  -6.785
  417    HA   ASP  60           HA       ASP  60   7.604 -10.406  -5.320
  418    HB2  ASP  60           HB2      ASP  60   7.116  -8.080  -4.463
  419    HB3  ASP  60           HB1      ASP  60   5.466  -8.290  -5.040
  420    H    GLY  61           HN       GLY  61   4.855  -9.087  -7.169
  421    HA2  GLY  61           HA2      GLY  61   3.433 -10.434  -8.515
  422    HA3  GLY  61           HA1      GLY  61   3.901 -11.832  -7.563
  423    H    ARG  62           HN       ARG  62   3.459 -10.471  -5.006
  424    HA   ARG  62           HA       ARG  62   0.698 -11.108  -4.709
  425    HE   ARG  62           HE       ARG  62   0.261 -12.051  -1.532
  426    HB2  ARG  62           HB2      ARG  62   2.586  -9.756  -2.775
  427    HB3  ARG  62           HB1      ARG  62   1.007 -10.411  -2.369
  428    HG2  ARG  62           HG2      ARG  62   3.328 -12.022  -3.409
  429    HG3  ARG  62           HG1      ARG  62   2.852 -11.895  -1.715
  430    HD2  ARG  62           HD2      ARG  62   1.163 -13.000  -3.956
  431    HD3  ARG  62           HD1      ARG  62   1.999 -13.947  -2.728
  432   HH11  ARG  62          HH11      ARG  62   0.282 -15.108  -3.211
  433   HH12  ARG  62          HH12      ARG  62  -1.191 -15.662  -2.489
  434   HH21  ARG  62          HH21      ARG  62  -1.681 -12.776  -0.579
  435   HH22  ARG  62          HH22      ARG  62  -2.306 -14.337  -0.991
  436    H    ILE  63           HN       ILE  63   2.527  -8.062  -4.618
  437    HA   ILE  63           HA       ILE  63   0.315  -6.400  -4.051
  438    HB   ILE  63           HB       ILE  63   2.835  -5.620  -5.516
  439   HG12  ILE  63          HG12      ILE  63   2.290  -5.580  -2.539
  440   HG13  ILE  63          HG11      ILE  63   3.268  -6.797  -3.354
  441   HG21  ILE  63          HG21      ILE  63   2.377  -3.394  -4.608
  442   HG22  ILE  63          HG22      ILE  63   0.894  -4.000  -3.870
  443   HG23  ILE  63          HG23      ILE  63   1.052  -3.960  -5.627
  444   HD11  ILE  63          HD13      ILE  63   3.856  -3.851  -3.204
  445   HD12  ILE  63          HD11      ILE  63   4.827  -5.049  -4.061
  446   HD13  ILE  63          HD12      ILE  63   4.668  -5.133  -2.306
  447    H    GLU  64           HN       GLU  64  -1.206  -5.519  -5.304
  448    HA   GLU  64           HA       GLU  64  -0.953  -5.803  -8.224
  449    HB2  GLU  64           HB2      GLU  64  -2.524  -7.475  -7.359
  450    HB3  GLU  64           HB1      GLU  64  -3.441  -6.212  -6.551
  451    HG2  GLU  64           HG2      GLU  64  -4.029  -5.240  -8.701
  452    HG3  GLU  64           HG1      GLU  64  -3.079  -6.474  -9.528
  453    HA   PRO  65           HA       PRO  65  -1.510  -1.404  -8.492
  454    HB2  PRO  65           HB2      PRO  65  -3.289  -2.124 -10.782
  455    HB3  PRO  65           HB1      PRO  65  -1.975  -0.944 -10.708
  456    HG2  PRO  65           HG2      PRO  65  -1.618  -3.296 -11.899
  457    HG3  PRO  65           HG1      PRO  65  -0.330  -2.565 -10.923
  458    HD2  PRO  65           HD2      PRO  65  -2.128  -4.849 -10.286
  459    HD3  PRO  65           HD1      PRO  65  -0.447  -4.563  -9.795
  460    H    ASN  66           HN       ASN  66  -3.131   0.210  -8.226
  461    HA   ASN  66           HA       ASN  66  -5.007   1.084  -7.289
  462    HB2  ASN  66           HB2      ASN  66  -6.026   0.198  -9.375
  463    HB3  ASN  66           HB1      ASN  66  -6.383  -1.307  -8.534
  464   HD21  ASN  66          HD21      ASN  66  -8.588  -1.091  -8.834
  465   HD22  ASN  66          HD22      ASN  66  -9.531   0.071  -7.970
  466    H    ASP  67           HN       ASP  67  -3.800   0.298  -5.301
  467    HA   ASP  67           HA       ASP  67  -5.623  -1.378  -3.718
  468    HB2  ASP  67           HB2      ASP  67  -3.741  -2.802  -4.262
  469    HB3  ASP  67           HB1      ASP  67  -2.602  -1.555  -3.766
  470    H    LYS  68           HN       LYS  68  -5.585  -0.938  -1.421
  471    HA   LYS  68           HA       LYS  68  -4.767   1.833  -0.873
  472    HB2  LYS  68           HB2      LYS  68  -7.159   1.346  -0.608
  473    HB3  LYS  68           HB1      LYS  68  -6.778   0.091   0.561
  474    HG2  LYS  68           HG2      LYS  68  -5.848   1.761   2.071
  475    HG3  LYS  68           HG1      LYS  68  -6.199   3.028   0.893
  476    HD2  LYS  68           HD2      LYS  68  -8.582   2.547   1.067
  477    HD3  LYS  68           HD1      LYS  68  -8.247   1.243   2.207
  478    HE2  LYS  68           HE2      LYS  68  -7.308   2.852   3.783
  479    HE3  LYS  68           HE1      LYS  68  -7.608   4.159   2.638
  480    HZ1  LYS  68           HZ3      LYS  68  -9.332   4.057   4.318
  481    HZ2  LYS  68           HZ1      LYS  68  -9.684   2.454   3.906
  482    HZ3  LYS  68           HZ2      LYS  68  -9.978   3.697   2.798
  483    H    ILE  69           HN       ILE  69  -3.254   2.291   0.599
  484    HA   ILE  69           HA       ILE  69  -1.969   0.075   2.000
  485    HB   ILE  69           HB       ILE  69  -1.108   2.966   1.885
  486   HG12  ILE  69          HG12      ILE  69  -1.204   2.003  -0.375
  487   HG13  ILE  69          HG11      ILE  69   0.459   2.281   0.128
  488   HG21  ILE  69          HG21      ILE  69  -0.139   1.755   3.739
  489   HG22  ILE  69          HG22      ILE  69   1.093   2.057   2.513
  490   HG23  ILE  69          HG23      ILE  69   0.369   0.456   2.660
  491   HD11  ILE  69          HD13      ILE  69   0.238   0.168  -1.034
  492   HD12  ILE  69          HD11      ILE  69  -0.972  -0.365   0.132
  493   HD13  ILE  69          HD12      ILE  69   0.692  -0.094   0.649
  494    H    LEU  70           HN       LEU  70  -1.697  -0.025   4.228
  495    HA   LEU  70           HA       LEU  70  -3.421   1.792   5.781
  496    HG   LEU  70           HG       LEU  70  -4.217  -1.057   4.575
  497    HB2  LEU  70           HB2      LEU  70  -2.635  -1.040   6.467
  498    HB3  LEU  70           HB1      LEU  70  -3.736  -0.018   7.371
  499   HD11  LEU  70          HD11      LEU  70  -4.313  -2.823   6.253
  500   HD12  LEU  70          HD12      LEU  70  -5.917  -2.461   5.617
  501   HD13  LEU  70          HD13      LEU  70  -5.444  -1.864   7.208
  502   HD21  LEU  70          HD23      LEU  70  -5.993   0.519   6.436
  503   HD22  LEU  70          HD21      LEU  70  -6.485  -0.179   4.892
  504   HD23  LEU  70          HD22      LEU  70  -5.273   1.102   4.934
  505    H    ARG  71           HN       ARG  71  -0.707  -0.430   6.469
  506    HA   ARG  71           HA       ARG  71   0.843   1.770   7.548
  507    HE   ARG  71           HE       ARG  71   1.578  -0.840  11.374
  508    HB2  ARG  71           HB2      ARG  71   1.139   0.728   9.750
  509    HB3  ARG  71           HB1      ARG  71  -0.541   1.150   9.455
  510    HG2  ARG  71           HG2      ARG  71  -1.029  -1.181   8.899
  511    HG3  ARG  71           HG1      ARG  71   0.658  -1.601   9.204
  512    HD2  ARG  71           HD2      ARG  71  -1.268  -0.449  11.220
  513    HD3  ARG  71           HD1      ARG  71  -0.770  -2.137  11.119
  514   HH11  ARG  71          HH11      ARG  71  -1.406  -0.699  13.172
  515   HH12  ARG  71          HH12      ARG  71  -0.634  -0.295  14.668
  516   HH21  ARG  71          HH21      ARG  71   2.600  -0.307  13.340
  517   HH22  ARG  71          HH22      ARG  71   1.644  -0.073  14.765
  518    H    VAL  72           HN       VAL  72   3.002   1.411   7.550
  519    HA   VAL  72           HA       VAL  72   3.934  -0.997   6.199
  520    HB   VAL  72           HB       VAL  72   5.742   1.235   7.063
  521   HG11  VAL  72          HG11      VAL  72   5.673  -0.537   4.624
  522   HG12  VAL  72          HG12      VAL  72   6.742  -0.714   6.014
  523   HG13  VAL  72          HG13      VAL  72   6.889   0.694   4.964
  524   HG21  VAL  72          HG23      VAL  72   3.890   1.338   4.683
  525   HG22  VAL  72          HG21      VAL  72   5.201   2.471   5.009
  526   HG23  VAL  72          HG22      VAL  72   3.823   2.378   6.105
  527    H    ASP  73           HN       ASP  73   6.225  -1.751   7.055
  528    HA   ASP  73           HA       ASP  73   5.865  -2.979   9.520
  529    HB2  ASP  73           HB2      ASP  73   8.293  -3.479   9.440
  530    HB3  ASP  73           HB1      ASP  73   7.483  -3.812   7.913
  531    H    ASP  74           HN       ASP  74   5.679  -2.081  11.447
  532    HA   ASP  74           HA       ASP  74   6.009  -0.776  13.275
  533    HB2  ASP  74           HB2      ASP  74   8.739  -0.348  12.045
  534    HB3  ASP  74           HB1      ASP  74   8.295   0.043  13.704
  535    H    VAL  75           HN       VAL  75   5.181   0.424  10.570
  536    HA   VAL  75           HA       VAL  75   5.278   3.198  11.492
  537    HB   VAL  75           HB       VAL  75   5.996   2.393   8.666
  538   HG11  VAL  75          HG11      VAL  75   5.758   5.118   9.938
  539   HG12  VAL  75          HG12      VAL  75   4.712   4.445   8.688
  540   HG13  VAL  75          HG13      VAL  75   6.401   4.802   8.326
  541   HG21  VAL  75          HG23      VAL  75   7.834   1.996  10.209
  542   HG22  VAL  75          HG21      VAL  75   7.685   3.639  10.835
  543   HG23  VAL  75          HG22      VAL  75   8.190   3.373   9.166
  544    H    ASN  76           HN       ASN  76   3.553   4.494  10.751
  545    HA   ASN  76           HA       ASN  76   1.373   3.010   9.430
  546    HB2  ASN  76           HB2      ASN  76  -0.224   4.306  10.754
  547    HB3  ASN  76           HB1      ASN  76   0.885   3.435  11.809
  548   HD21  ASN  76          HD21      ASN  76  -0.727   5.818  12.309
  549   HD22  ASN  76          HD22      ASN  76   0.382   7.047  12.806
  550    H    VAL  77           HN       VAL  77   0.298   4.000   7.767
  551    HA   VAL  77           HA       VAL  77   1.281   6.679   7.014
  552    HB   VAL  77           HB       VAL  77   0.859   6.056   4.661
  553   HG11  VAL  77          HG11      VAL  77   2.767   4.478   4.443
  554   HG12  VAL  77          HG12      VAL  77   2.741   4.268   6.195
  555   HG13  VAL  77          HG13      VAL  77   3.100   5.850   5.500
  556   HG21  VAL  77          HG23      VAL  77  -0.848   4.338   5.074
  557   HG22  VAL  77          HG21      VAL  77   0.390   3.286   5.760
  558   HG23  VAL  77          HG22      VAL  77   0.460   3.736   4.057
  559    H    GLN  78           HN       GLN  78  -1.061   5.973   8.659
  560    HA   GLN  78           HA       GLN  78  -3.288   6.746   6.925
  561    HB2  GLN  78           HB2      GLN  78  -3.234   5.821   9.802
  562    HB3  GLN  78           HB1      GLN  78  -4.694   6.249   8.921
  563    HG2  GLN  78           HG2      GLN  78  -2.800   4.025   8.191
  564    HG3  GLN  78           HG1      GLN  78  -4.345   3.832   9.018
  565   HE21  GLN  78          HE21      GLN  78  -6.256   4.125   7.872
  566   HE22  GLN  78          HE22      GLN  78  -6.302   4.135   6.145
  567    H    GLY  79           HN       GLY  79  -1.226   8.671   7.534
  568    HA2  GLY  79           HA2      GLY  79  -2.756  10.925   8.075
  569    HA3  GLY  79           HA1      GLY  79  -2.060  10.424   9.608
  570    H    MET  80           HN       MET  80  -0.369   9.930   6.590
  571    HA   MET  80           HA       MET  80   1.430  12.163   7.269
  572    HB2  MET  80           HB2      MET  80   2.305   9.499   6.142
  573    HB3  MET  80           HB1      MET  80   3.342  10.829   6.639
  574    HG2  MET  80           HG2      MET  80   2.419  10.524   8.964
  575    HG3  MET  80           HG1      MET  80   1.681   9.034   8.382
  576    HE1  MET  80           HE3      MET  80   4.092   8.237   6.239
  577    HE2  MET  80           HE1      MET  80   3.159   7.088   7.199
  578    HE3  MET  80           HE2      MET  80   4.922   7.048   7.243
  579    H    ALA  81           HN       ALA  81   2.331  13.300   5.552
  580    HA   ALA  81           HA       ALA  81   0.777  13.459   3.202
  581    HB1  ALA  81           HB3      ALA  81   3.515  14.608   3.728
  582    HB2  ALA  81           HB1      ALA  81   1.980  15.378   4.126
  583    HB3  ALA  81           HB2      ALA  81   2.414  15.095   2.440
  584    H    GLN  82           HN       GLN  82   1.536  13.196   0.986
  585    HA   GLN  82           HA       GLN  82   2.337  10.640   0.371
  586    HB2  GLN  82           HB2      GLN  82   1.277  12.076  -1.265
  587    HB3  GLN  82           HB1      GLN  82   2.666  13.155  -1.272
  588    HG2  GLN  82           HG2      GLN  82   4.046  11.417  -2.244
  589    HG3  GLN  82           HG1      GLN  82   2.698  10.282  -2.175
  590   HE21  GLN  82          HE21      GLN  82   0.991  10.505  -3.615
  591   HE22  GLN  82          HE22      GLN  82   1.109  11.476  -5.039
  592    H    SER  83           HN       SER  83   4.406  13.539   0.135
  593    HA   SER  83           HA       SER  83   6.777  12.289  -0.529
  594    HG   SER  83           HG       SER  83   8.622  14.455  -0.429
  595    HB2  SER  83           HB2      SER  83   6.523  14.713  -0.580
  596    HB3  SER  83           HB1      SER  83   6.389  14.757   1.178
  597    H    ASP  84           HN       ASP  84   5.379  12.795   2.679
  598    HA   ASP  84           HA       ASP  84   7.586  11.955   4.196
  599    HB2  ASP  84           HB2      ASP  84   5.598  13.120   5.123
  600    HB3  ASP  84           HB1      ASP  84   4.656  11.653   4.885
  601    H    VAL  85           HN       VAL  85   4.790  10.123   2.984
  602    HA   VAL  85           HA       VAL  85   5.427   7.641   4.082
  603    HB   VAL  85           HB       VAL  85   4.065   8.157   1.432
  604   HG11  VAL  85          HG11      VAL  85   2.989   5.982   1.835
  605   HG12  VAL  85          HG12      VAL  85   3.995   5.765   3.267
  606   HG13  VAL  85          HG13      VAL  85   4.739   5.841   1.670
  607   HG21  VAL  85          HG23      VAL  85   2.894   7.900   4.200
  608   HG22  VAL  85          HG21      VAL  85   1.975   8.044   2.703
  609   HG23  VAL  85          HG22      VAL  85   2.990   9.379   3.245
  610    H    VAL  86           HN       VAL  86   6.466   9.130   1.045
  611    HA   VAL  86           HA       VAL  86   7.808   6.894  -0.013
  612    HB   VAL  86           HB       VAL  86   8.364   9.830  -0.467
  613   HG11  VAL  86          HG11      VAL  86  10.270   8.496  -1.142
  614   HG12  VAL  86          HG12      VAL  86   9.416   9.083  -2.569
  615   HG13  VAL  86          HG13      VAL  86   9.221   7.409  -2.051
  616   HG21  VAL  86          HG23      VAL  86   6.671   7.867  -2.011
  617   HG22  VAL  86          HG21      VAL  86   7.011   9.528  -2.495
  618   HG23  VAL  86          HG22      VAL  86   6.080   9.209  -1.030
  619    H    GLU  87           HN       GLU  87   8.860   9.488   2.144
  620    HA   GLU  87           HA       GLU  87  11.602   8.935   2.159
  621    HB2  GLU  87           HB2      GLU  87   9.832  10.043   4.346
  622    HB3  GLU  87           HB1      GLU  87  11.589  10.025   4.416
  623    HG2  GLU  87           HG2      GLU  87  11.693  11.449   2.444
  624    HG3  GLU  87           HG1      GLU  87   9.933  11.450   2.345
  625    H    VAL  88           HN       VAL  88   8.952   7.589   4.057
  626    HA   VAL  88           HA       VAL  88  10.453   6.044   5.843
  627    HB   VAL  88           HB       VAL  88   7.676   5.640   4.733
  628   HG11  VAL  88          HG11      VAL  88   7.320   4.027   6.554
  629   HG12  VAL  88          HG12      VAL  88   9.035   4.122   6.959
  630   HG13  VAL  88          HG13      VAL  88   8.531   3.468   5.398
  631   HG21  VAL  88          HG23      VAL  88   8.641   6.604   7.424
  632   HG22  VAL  88          HG21      VAL  88   6.962   6.467   6.904
  633   HG23  VAL  88          HG22      VAL  88   8.034   7.631   6.125
  634    H    LEU  89           HN       LEU  89   8.933   5.089   2.766
  635    HA   LEU  89           HA       LEU  89   9.751   2.448   2.699
  636    HG   LEU  89           HG       LEU  89   7.409   4.277   1.690
  637    HB2  LEU  89           HB2      LEU  89   9.494   4.309   0.337
  638    HB3  LEU  89           HB1      LEU  89   9.451   2.558   0.279
  639   HD11  LEU  89          HD11      LEU  89   7.262   2.864  -0.969
  640   HD12  LEU  89          HD12      LEU  89   7.315   4.609  -0.717
  641   HD13  LEU  89          HD13      LEU  89   5.924   3.679  -0.160
  642   HD21  LEU  89          HD23      LEU  89   6.110   2.205   1.803
  643   HD22  LEU  89          HD21      LEU  89   7.640   2.055   2.666
  644   HD23  LEU  89          HD22      LEU  89   7.452   1.324   1.072
  645    H    ARG  90           HN       ARG  90  11.511   5.349   1.742
  646    HA   ARG  90           HA       ARG  90  13.740   3.858   0.683
  647    HE   ARG  90           HE       ARG  90  12.027   8.345   0.241
  648    HB2  ARG  90           HB2      ARG  90  13.443   6.809   1.271
  649    HB3  ARG  90           HB1      ARG  90  14.792   6.078   0.412
  650    HG2  ARG  90           HG2      ARG  90  13.332   5.386  -1.379
  651    HG3  ARG  90           HG1      ARG  90  11.924   5.984  -0.500
  652    HD2  ARG  90           HD2      ARG  90  14.231   7.654  -1.496
  653    HD3  ARG  90           HD1      ARG  90  12.636   7.553  -2.239
  654   HH11  ARG  90          HH11      ARG  90  14.415   9.495  -2.024
  655   HH12  ARG  90          HH12      ARG  90  14.376  11.123  -1.434
  656   HH21  ARG  90          HH21      ARG  90  11.971  10.484   1.022
  657   HH22  ARG  90          HH22      ARG  90  12.988  11.685   0.298
  658    H    ASN  91           HN       ASN  91  12.782   5.070   3.752
  659    HA   ASN  91           HA       ASN  91  15.488   5.014   4.823
  660    HB2  ASN  91           HB2      ASN  91  12.818   5.802   5.963
  661    HB3  ASN  91           HB1      ASN  91  14.225   5.585   6.997
  662   HD21  ASN  91          HD21      ASN  91  14.387   6.815   3.725
  663   HD22  ASN  91          HD22      ASN  91  14.844   8.425   4.151
  664    H    ALA  92           HN       ALA  92  13.121   2.786   4.205
  665    HA   ALA  92           HA       ALA  92  12.943   1.190   6.459
  666    HB1  ALA  92           HB3      ALA  92  12.440  -0.658   4.935
  667    HB2  ALA  92           HB1      ALA  92  13.044   0.294   3.580
  668    HB3  ALA  92           HB2      ALA  92  11.604   0.818   4.454
  669    H    GLY  93           HN       GLY  93  15.057   0.340   3.704
  670    HA2  GLY  93           HA2      GLY  93  17.142  -0.624   3.642
  671    HA3  GLY  93           HA1      GLY  93  17.430   0.119   5.207
  672    H    ASN  94           HN       ASN  94  14.697  -1.836   5.230
  673    HA   ASN  94           HA       ASN  94  16.109  -4.288   5.901
  674    HB2  ASN  94           HB2      ASN  94  15.454  -4.434   8.130
  675    HB3  ASN  94           HB1      ASN  94  15.828  -2.723   7.978
  676   HD21  ASN  94          HD21      ASN  94  13.461  -1.973   6.579
  677   HD22  ASN  94          HD22      ASN  94  12.147  -2.090   7.688
  678    HA   PRO  95           HA       PRO  95  12.590  -6.572   4.413
  679    HB2  PRO  95           HB2      PRO  95  11.813  -7.272   7.217
  680    HB3  PRO  95           HB1      PRO  95  11.961  -8.319   5.800
  681    HG2  PRO  95           HG2      PRO  95  13.857  -8.297   7.665
  682    HG3  PRO  95           HG1      PRO  95  14.275  -8.410   5.945
  683    HD2  PRO  95           HD2      PRO  95  14.525  -6.104   7.808
  684    HD3  PRO  95           HD1      PRO  95  15.528  -6.544   6.412
  685    H    VAL  96           HN       VAL  96  11.315  -4.906   3.668
  686    HA   VAL  96           HA       VAL  96   9.716  -3.309   5.458
  687    HB   VAL  96           HB       VAL  96   9.320  -3.342   2.488
  688   HG11  VAL  96          HG11      VAL  96   8.783  -1.032   2.786
  689   HG12  VAL  96          HG12      VAL  96   9.352  -1.061   4.455
  690   HG13  VAL  96          HG13      VAL  96   7.899  -1.956   4.002
  691   HG21  VAL  96          HG23      VAL  96  11.698  -3.301   2.654
  692   HG22  VAL  96          HG21      VAL  96  11.645  -2.120   3.962
  693   HG23  VAL  96          HG22      VAL  96  11.161  -1.653   2.333
  694    H    ARG  97           HN       ARG  97   7.900  -4.055   6.316
  695    HA   ARG  97           HA       ARG  97   6.358  -6.102   4.927
  696    HE   ARG  97           HE       ARG  97   2.783  -8.035   7.793
  697    HB2  ARG  97           HB2      ARG  97   6.830  -6.365   7.349
  698    HB3  ARG  97           HB1      ARG  97   5.930  -4.888   7.668
  699    HG2  ARG  97           HG2      ARG  97   3.904  -5.934   6.778
  700    HG3  ARG  97           HG1      ARG  97   4.810  -7.417   6.475
  701    HD2  ARG  97           HD2      ARG  97   5.295  -7.588   8.880
  702    HD3  ARG  97           HD1      ARG  97   4.343  -6.131   9.164
  703   HH11  ARG  97          HH11      ARG  97   4.167  -7.418  10.931
  704   HH12  ARG  97          HH12      ARG  97   2.954  -8.313  11.784
  705   HH21  ARG  97          HH21      ARG  97   1.180  -9.210   8.905
  706   HH22  ARG  97          HH22      ARG  97   1.255  -9.333  10.631
  707    H    LEU  98           HN       LEU  98   4.577  -5.654   3.791
  708    HA   LEU  98           HA       LEU  98   3.494  -2.926   3.985
  709    HG   LEU  98           HG       LEU  98   5.587  -4.260   1.946
  710    HB2  LEU  98           HB2      LEU  98   3.177  -4.842   1.686
  711    HB3  LEU  98           HB1      LEU  98   2.799  -3.131   1.708
  712   HD11  LEU  98          HD11      LEU  98   4.172  -3.061  -0.432
  713   HD12  LEU  98          HD12      LEU  98   4.647  -4.749  -0.242
  714   HD13  LEU  98          HD13      LEU  98   5.881  -3.494  -0.363
  715   HD21  LEU  98          HD23      LEU  98   5.360  -2.081   2.986
  716   HD22  LEU  98          HD21      LEU  98   4.574  -1.449   1.540
  717   HD23  LEU  98          HD22      LEU  98   6.265  -1.943   1.478
  718    H    LEU  99           HN       LEU  99   1.810  -3.002   5.368
  719    HA   LEU  99           HA       LEU  99  -0.124  -5.188   5.136
  720    HG   LEU  99           HG       LEU  99  -2.242  -4.103   7.025
  721    HB2  LEU  99           HB2      LEU  99   0.738  -4.464   7.383
  722    HB3  LEU  99           HB1      LEU  99  -0.069  -2.926   7.137
  723   HD11  LEU  99          HD11      LEU  99  -0.600  -6.533   7.728
  724   HD12  LEU  99          HD12      LEU  99  -1.481  -6.261   6.223
  725   HD13  LEU  99          HD13      LEU  99  -2.362  -6.448   7.740
  726   HD21  LEU  99          HD23      LEU  99  -1.536  -3.170   9.135
  727   HD22  LEU  99          HD21      LEU  99  -0.592  -4.614   9.497
  728   HD23  LEU  99          HD22      LEU  99  -2.351  -4.707   9.418
  729    H    LEU 100           HN       LEU 100  -1.385  -4.795   3.396
  730    HA   LEU 100           HA       LEU 100  -2.829  -2.232   3.358
  731    HG   LEU 100           HG       LEU 100  -0.298  -4.093   1.663
  732    HB2  LEU 100           HB2      LEU 100  -2.797  -2.659   0.771
  733    HB3  LEU 100           HB1      LEU 100  -1.465  -1.845   1.570
  734   HD11  LEU 100          HD11      LEU 100  -1.024  -5.806   0.116
  735   HD12  LEU 100          HD12      LEU 100  -2.428  -4.837  -0.333
  736   HD13  LEU 100          HD13      LEU 100  -2.287  -5.480   1.303
  737   HD21  LEU 100          HD23      LEU 100   0.441  -3.965  -0.667
  738   HD22  LEU 100          HD21      LEU 100   0.330  -2.367   0.072
  739   HD23  LEU 100          HD22      LEU 100  -0.925  -2.914  -1.040
  740    H    ILE 101           HN       ILE 101  -4.795  -2.328   1.939
  741    HA   ILE 101           HA       ILE 101  -6.108  -4.952   2.203
  742    HB   ILE 101           HB       ILE 101  -7.025  -3.267   3.759
  743   HG12  ILE 101          HG12      ILE 101  -8.949  -3.948   1.523
  744   HG13  ILE 101          HG11      ILE 101  -8.454  -5.064   2.791
  745   HG21  ILE 101          HG21      ILE 101  -7.763  -1.759   1.253
  746   HG22  ILE 101          HG22      ILE 101  -6.558  -1.268   2.445
  747   HG23  ILE 101          HG23      ILE 101  -8.263  -1.343   2.893
  748   HD11  ILE 101          HD13      ILE 101  -9.440  -3.564   4.465
  749   HD12  ILE 101          HD11      ILE 101 -10.623  -4.131   3.286
  750   HD13  ILE 101          HD12      ILE 101  -9.974  -2.495   3.167
  751    H    ARG 102           HN       ARG 102  -7.388  -5.671   0.525
  752    HA   ARG 102           HA       ARG 102  -7.479  -4.009  -1.900
  753    HE   ARG 102           HE       ARG 102  -5.996  -4.389  -5.904
  754    HB2  ARG 102           HB2      ARG 102  -5.809  -6.179  -1.629
  755    HB3  ARG 102           HB1      ARG 102  -7.223  -6.889  -2.395
  756    HG2  ARG 102           HG2      ARG 102  -5.612  -4.561  -3.424
  757    HG3  ARG 102           HG1      ARG 102  -5.610  -6.207  -4.060
  758    HD2  ARG 102           HD2      ARG 102  -8.001  -5.972  -4.606
  759    HD3  ARG 102           HD1      ARG 102  -7.953  -4.308  -4.023
  760   HH11  ARG 102          HH11      ARG 102  -9.377  -5.228  -5.886
  761   HH12  ARG 102          HH12      ARG 102  -9.608  -4.865  -7.565
  762   HH21  ARG 102          HH21      ARG 102  -6.293  -3.904  -8.115
  763   HH22  ARG 102          HH22      ARG 102  -7.857  -4.111  -8.829
  764    H    ARG 103           HN       ARG 103  -9.493  -3.787  -2.629
  765    HA   ARG 103           HA       ARG 103 -11.623  -5.346  -1.480
  766    HE   ARG 103           HE       ARG 103 -13.460  -2.467  -4.808
  767    HB2  ARG 103           HB2      ARG 103 -11.801  -2.893  -1.952
  768    HB3  ARG 103           HB1      ARG 103 -11.797  -3.271  -3.670
  769    HG2  ARG 103           HG2      ARG 103 -13.851  -4.544  -3.415
  770    HG3  ARG 103           HG1      ARG 103 -13.847  -4.225  -1.680
  771    HD2  ARG 103           HD2      ARG 103 -15.364  -2.690  -2.692
  772    HD3  ARG 103           HD1      ARG 103 -13.930  -1.785  -2.211
  773   HH11  ARG 103          HH11      ARG 103 -16.016  -0.803  -3.129
  774   HH12  ARG 103          HH12      ARG 103 -16.425   0.202  -4.479
  775   HH21  ARG 103          HH21      ARG 103 -13.990  -1.147  -6.594
  776   HH22  ARG 103          HH22      ARG 103 -15.274   0.006  -6.448
  777    H    LEU 104           HN       LEU 104 -12.796  -6.933  -2.389
  778    HA   LEU 104           HA       LEU 104 -11.956  -7.871  -5.047
  779    HG   LEU 104           HG       LEU 104 -11.041  -8.733  -2.241
  780    HB2  LEU 104           HB2      LEU 104 -13.413  -9.423  -2.909
  781    HB3  LEU 104           HB1      LEU 104 -12.693 -10.063  -4.374
  782   HD11  LEU 104          HD11      LEU 104 -12.214 -10.560  -1.174
  783   HD12  LEU 104          HD12      LEU 104 -10.522 -10.994  -1.418
  784   HD13  LEU 104          HD13      LEU 104 -11.763 -11.650  -2.485
  785   HD21  LEU 104          HD23      LEU 104 -10.034  -8.978  -4.462
  786   HD22  LEU 104          HD21      LEU 104 -10.362 -10.710  -4.416
  787   HD23  LEU 104          HD22      LEU 104  -9.231  -9.996  -3.267
  788    HA   PRO 105           HA       PRO 105 -16.061  -7.074  -6.528
  789    HB2  PRO 105           HB2      PRO 105 -16.135  -8.598  -8.721
  790    HB3  PRO 105           HB1      PRO 105 -15.027  -7.225  -8.601
  791    HG2  PRO 105           HG2      PRO 105 -14.478 -10.142  -8.247
  792    HG3  PRO 105           HG1      PRO 105 -13.504  -8.913  -9.072
  793    HD2  PRO 105           HD2      PRO 105 -13.046  -9.816  -6.501
  794    HD3  PRO 105           HD1      PRO 105 -12.496  -8.251  -7.131
  795    H    LEU 106           HN       LEU 106 -18.144  -8.043  -6.937
  796    HA   LEU 106           HA       LEU 106 -18.471 -10.814  -6.052
  797    HG   LEU 106           HG       LEU 106 -17.772  -8.792  -3.834
  798    HB2  LEU 106           HB2      LEU 106 -19.990  -8.467  -4.911
  799    HB3  LEU 106           HB1      LEU 106 -20.360 -10.151  -4.596
  800   HD11  LEU 106          HD11      LEU 106 -19.666  -7.897  -2.576
  801   HD12  LEU 106          HD12      LEU 106 -18.617  -8.875  -1.549
  802   HD13  LEU 106          HD13      LEU 106 -20.146  -9.534  -2.130
  803   HD21  LEU 106          HD23      LEU 106 -17.531 -11.190  -4.214
  804   HD22  LEU 106          HD21      LEU 106 -18.886 -11.508  -3.133
  805   HD23  LEU 106          HD22      LEU 106 -17.397 -10.809  -2.497
  806    H    LEU 107           HN       LEU 107 -18.769 -10.929  -8.431
  807    HA   LEU 107           HA       LEU 107 -21.023  -9.705  -9.661
  808    HG   LEU 107           HG       LEU 107 -17.990 -10.149 -10.438
  809    HB2  LEU 107           HB2      LEU 107 -19.433 -12.125 -10.510
  810    HB3  LEU 107           HB1      LEU 107 -20.582 -11.263 -11.515
  811   HD11  LEU 107          HD11      LEU 107 -17.301 -10.146 -12.783
  812   HD12  LEU 107          HD12      LEU 107 -18.823 -10.917 -13.229
  813   HD13  LEU 107          HD13      LEU 107 -17.663 -11.776 -12.215
  814   HD21  LEU 107          HD23      LEU 107 -20.073  -8.901 -12.228
  815   HD22  LEU 107          HD21      LEU 107 -18.488  -8.212 -11.872
  816   HD23  LEU 107          HD22      LEU 107 -19.675  -8.408 -10.582
  817    H    GLU 108           HN       GLU 108 -22.761 -11.048 -10.726
  818    HA   GLU 108           HA       GLU 108 -23.764 -13.046  -8.808
  819    HB2  GLU 108           HB2      GLU 108 -25.354 -11.194 -10.594
  820    HB3  GLU 108           HB1      GLU 108 -26.028 -12.363  -9.465
  821    HG2  GLU 108           HG2      GLU 108 -24.337  -9.983  -8.727
  822    HG3  GLU 108           HG1      GLU 108 -26.090 -10.090  -8.580
  Start of MODEL   13
    1    H1   GLY   1           HT1      GLY   1  -8.123 -15.195   6.782
    2    H2   GLY   1           HT2      GLY   1  -7.167 -15.561   8.127
    3    H3   GLY   1           HT3      GLY   1  -8.209 -14.230   8.169
    4    HA2  GLY   1           HA1      GLY   1 -10.131 -15.683   8.023
    5    HA3  GLY   1           HA2      GLY   1  -9.053 -17.068   7.969
    6    H    SER   2           HN       SER   2  -7.326 -15.378   9.937
    7    HA   SER   2           HA       SER   2  -8.602 -16.481  12.317
    8    HG   SER   2           HG       SER   2  -5.213 -17.262  11.540
    9    HB2  SER   2           HB2      SER   2  -5.848 -15.285  11.925
   10    HB3  SER   2           HB1      SER   2  -6.433 -16.025  13.415
   11    H    HIS   3           HN       HIS   3  -7.693 -13.411  10.903
   12    HA   HIS   3           HA       HIS   3  -8.423 -11.942  13.305
   13    HD1  HIS   3           HD1      HIS   3  -5.861  -9.960  13.749
   14    HD2  HIS   3           HD2      HIS   3  -5.266 -12.648  10.637
   15    HE1  HIS   3           HE1      HIS   3  -3.482 -10.745  13.983
   16    HE2  HIS   3           HE2      HIS   3  -3.115 -12.290  12.026
   17    HB2  HIS   3           HB2      HIS   3  -7.536 -10.934  10.593
   18    HB3  HIS   3           HB1      HIS   3  -7.743  -9.949  12.037
   19    H    GLY   4           HN       GLY   4  -9.984 -13.209  10.625
   20    HA2  GLY   4           HA2      GLY   4 -12.331 -13.117  10.350
   21    HA3  GLY   4           HA1      GLY   4 -12.346 -11.575  11.192
   22    H    TYR   5           HN       TYR   5 -13.688 -10.767   9.494
   23    HA   TYR   5           HA       TYR   5 -14.117  -9.654   7.560
   24    HD1  TYR   5           HD2      TYR   5 -11.227  -8.754  10.120
   25    HD2  TYR   5           HD1      TYR   5 -13.659  -6.597   7.376
   26    HE1  TYR   5           HE2      TYR   5 -11.664  -7.060  11.847
   27    HE2  TYR   5           HE1      TYR   5 -14.103  -4.897   9.094
   28    HH   TYR   5           HH       TYR   5 -14.084  -4.685  11.524
   29    HB2  TYR   5           HB2      TYR   5 -11.131  -9.197   7.705
   30    HB3  TYR   5           HB1      TYR   5 -12.211  -8.355   6.599
   31    H    SER   6           HN       SER   6 -14.620 -11.839   6.689
   32    HA   SER   6           HA       SER   6 -12.682 -12.779   4.701
   33    HG   SER   6           HG       SER   6 -14.361 -15.903   4.598
   34    HB2  SER   6           HB2      SER   6 -13.595 -14.486   6.203
   35    HB3  SER   6           HB1      SER   6 -15.234 -14.063   5.711
   36    H    ASP   7           HN       ASP   7 -12.852 -11.769   2.813
   37    HA   ASP   7           HA       ASP   7 -13.748 -10.613   1.049
   38    HB2  ASP   7           HB2      ASP   7 -15.337 -11.971  -0.263
   39    HB3  ASP   7           HB1      ASP   7 -13.986 -12.928   0.334
   40    H    ALA   8           HN       ALA   8 -14.608  -9.334   3.221
   41    HA   ALA   8           HA       ALA   8 -17.461  -9.147   3.385
   42    HB1  ALA   8           HB3      ALA   8 -17.042  -7.284   4.908
   43    HB2  ALA   8           HB1      ALA   8 -15.333  -7.305   4.471
   44    HB3  ALA   8           HB2      ALA   8 -16.045  -8.680   5.318
   45    H    SER   9           HN       SER   9 -18.460  -8.483   1.565
   46    HA   SER   9           HA       SER   9 -19.153  -7.143  -0.137
   47    HG   SER   9           HG       SER   9 -20.641  -5.680   1.277
   48    HB2  SER   9           HB2      SER   9 -17.909  -5.024   1.628
   49    HB3  SER   9           HB1      SER   9 -18.938  -4.685   0.235
   50    H    GLY  10           HN       GLY  10 -16.438  -8.328  -0.218
   51    HA2  GLY  10           HA2      GLY  10 -14.882  -8.398  -1.945
   52    HA3  GLY  10           HA1      GLY  10 -15.510  -6.867  -2.536
   53    H    PHE  11           HN       PHE  11 -14.397  -7.491   0.747
   54    HA   PHE  11           HA       PHE  11 -11.962  -5.941   0.233
   55    HD1  PHE  11           HD1      PHE  11 -15.654  -4.599   0.713
   56    HD2  PHE  11           HD2      PHE  11 -11.729  -2.958   0.782
   57    HE1  PHE  11           HE1      PHE  11 -16.402  -2.758  -0.739
   58    HE2  PHE  11           HE2      PHE  11 -12.469  -1.114  -0.668
   59    HZ   PHE  11           HZ       PHE  11 -14.809  -1.014  -1.431
   60    HB2  PHE  11           HB2      PHE  11 -14.019  -5.313   2.357
   61    HB3  PHE  11           HB1      PHE  11 -12.387  -4.655   2.356
   62    H    SER  12           HN       SER  12 -10.240  -6.848   1.118
   63    HA   SER  12           HA       SER  12 -10.466  -8.334   3.608
   64    HG   SER  12           HG       SER  12  -9.430 -11.380   2.851
   65    HB2  SER  12           HB2      SER  12 -10.849 -10.083   1.981
   66    HB3  SER  12           HB1      SER  12  -9.448  -9.571   1.041
   67    H    LEU  13           HN       LEU  13  -8.607  -8.336   4.809
   68    HA   LEU  13           HA       LEU  13  -6.588  -6.437   4.017
   69    HG   LEU  13           HG       LEU  13  -8.691  -6.557   6.285
   70    HB2  LEU  13           HB2      LEU  13  -6.760  -8.142   6.502
   71    HB3  LEU  13           HB1      LEU  13  -5.682  -6.781   6.256
   72   HD11  LEU  13          HD11      LEU  13  -7.871  -7.280   8.465
   73   HD12  LEU  13          HD12      LEU  13  -8.424  -5.605   8.520
   74   HD13  LEU  13          HD13      LEU  13  -6.698  -5.963   8.468
   75   HD21  LEU  13          HD23      LEU  13  -7.650  -4.787   5.033
   76   HD22  LEU  13          HD21      LEU  13  -6.472  -4.518   6.317
   77   HD23  LEU  13          HD22      LEU  13  -8.174  -4.148   6.591
   78    H    TYR  14           HN       TYR  14  -4.843  -6.932   2.901
   79    HA   TYR  14           HA       TYR  14  -3.738  -9.656   3.120
   80    HD1  TYR  14           HD2      TYR  14  -3.730 -11.480   0.851
   81    HD2  TYR  14           HD1      TYR  14  -6.266  -8.089   0.402
   82    HE1  TYR  14           HE2      TYR  14  -5.540 -12.944   0.061
   83    HE2  TYR  14           HE1      TYR  14  -8.079  -9.548  -0.390
   84    HH   TYR  14           HH       TYR  14  -7.964 -12.946  -0.118
   85    HB2  TYR  14           HB2      TYR  14  -3.899  -7.805   0.742
   86    HB3  TYR  14           HB1      TYR  14  -2.815  -9.190   0.787
   87    H    SER  15           HN       SER  15  -1.446  -9.870   3.064
   88    HA   SER  15           HA       SER  15   0.100  -7.405   3.366
   89    HG   SER  15           HG       SER  15  -0.782 -10.294   5.233
   90    HB2  SER  15           HB2      SER  15   1.227  -8.294   5.384
   91    HB3  SER  15           HB1      SER  15  -0.496  -8.026   5.647
   92    H    VAL  16           HN       VAL  16   2.258  -7.561   2.811
   93    HA   VAL  16           HA       VAL  16   3.230 -10.172   1.875
   94    HB   VAL  16           HB       VAL  16   3.518  -7.603   0.309
   95   HG11  VAL  16          HG11      VAL  16   4.467  -9.049  -1.432
   96   HG12  VAL  16          HG12      VAL  16   4.345 -10.430  -0.342
   97   HG13  VAL  16          HG13      VAL  16   5.423  -9.090   0.049
   98   HG21  VAL  16          HG23      VAL  16   2.042  -8.669  -1.342
   99   HG22  VAL  16          HG21      VAL  16   1.230  -8.407   0.201
  100   HG23  VAL  16          HG22      VAL  16   1.796 -10.019  -0.235
  101    H    GLU  17           HN       GLU  17   5.381 -10.546   2.218
  102    HA   GLU  17           HA       GLU  17   6.812  -8.506   3.764
  103    HB2  GLU  17           HB2      GLU  17   7.483 -11.434   3.428
  104    HB3  GLU  17           HB1      GLU  17   8.224 -10.310   4.561
  105    HG2  GLU  17           HG2      GLU  17   6.081 -10.077   5.722
  106    HG3  GLU  17           HG1      GLU  17   5.356 -11.225   4.596
  107    H    LEU  18           HN       LEU  18   8.153  -7.259   2.635
  108    HA   LEU  18           HA       LEU  18   9.739  -8.505   0.489
  109    HG   LEU  18           HG       LEU  18   6.883  -7.225  -0.254
  110    HB2  LEU  18           HB2      LEU  18   8.563  -5.735   0.556
  111    HB3  LEU  18           HB1      LEU  18   9.720  -6.289  -0.640
  112   HD11  LEU  18          HD11      LEU  18   7.170  -5.183  -1.530
  113   HD12  LEU  18          HD12      LEU  18   6.664  -6.507  -2.581
  114   HD13  LEU  18          HD13      LEU  18   8.348  -5.984  -2.569
  115   HD21  LEU  18          HD23      LEU  18   7.319  -8.784  -2.127
  116   HD22  LEU  18          HD21      LEU  18   8.205  -9.204  -0.662
  117   HD23  LEU  18          HD22      LEU  18   9.039  -8.413  -1.998
  118    H    PHE  19           HN       PHE  19  11.886  -8.026   0.382
  119    HA   PHE  19           HA       PHE  19  12.958  -6.279   2.502
  120    HD1  PHE  19           HD2      PHE  19  12.481 -10.277   1.617
  121    HD2  PHE  19           HD1      PHE  19  16.047  -8.306   0.389
  122    HE1  PHE  19           HE2      PHE  19  12.845 -12.011  -0.090
  123    HE2  PHE  19           HE1      PHE  19  16.417 -10.035  -1.321
  124    HZ   PHE  19           HZ       PHE  19  14.826 -11.904  -1.546
  125    HB2  PHE  19           HB2      PHE  19  14.978  -7.746   2.474
  126    HB3  PHE  19           HB1      PHE  19  13.518  -8.575   3.004
  127    H    ARG  20           HN       ARG  20  14.563  -4.820   1.970
  128    HA   ARG  20           HA       ARG  20  15.227  -4.705  -0.908
  129    HE   ARG  20           HE       ARG  20  14.859  -0.330   0.945
  130    HB2  ARG  20           HB2      ARG  20  13.717  -2.879  -0.129
  131    HB3  ARG  20           HB1      ARG  20  14.988  -2.346   0.963
  132    HG2  ARG  20           HG2      ARG  20  16.449  -1.894  -0.924
  133    HG3  ARG  20           HG1      ARG  20  15.212  -2.479  -2.038
  134    HD2  ARG  20           HD2      ARG  20  15.208  -0.053  -1.959
  135    HD3  ARG  20           HD1      ARG  20  13.708  -0.695  -1.292
  136   HH11  ARG  20          HH11      ARG  20  15.454   1.626  -1.876
  137   HH12  ARG  20          HH12      ARG  20  15.903   3.029  -0.966
  138   HH21  ARG  20          HH21      ARG  20  15.456   1.512   2.151
  139   HH22  ARG  20          HH22      ARG  20  15.910   2.962   1.320
  140    H    GLU  21           HN       GLU  21  17.097  -6.007  -0.461
  141    HA   GLU  21           HA       GLU  21  19.211  -4.684   1.083
  142    HB2  GLU  21           HB2      GLU  21  19.179  -7.463  -0.108
  143    HB3  GLU  21           HB1      GLU  21  20.395  -6.810   0.981
  144    HG2  GLU  21           HG2      GLU  21  18.577  -6.538   2.685
  145    HG3  GLU  21           HG1      GLU  21  17.526  -7.444   1.598
  146    H    LYS  22           HN       LYS  22  18.121  -4.317  -1.850
  147    HA   LYS  22           HA       LYS  22  20.743  -4.407  -3.180
  148    HB2  LYS  22           HB2      LYS  22  17.957  -4.322  -4.346
  149    HB3  LYS  22           HB1      LYS  22  19.428  -4.210  -5.300
  150    HG2  LYS  22           HG2      LYS  22  18.778  -6.442  -5.476
  151    HG3  LYS  22           HG1      LYS  22  20.068  -6.453  -4.273
  152    HD2  LYS  22           HD2      LYS  22  18.427  -6.528  -2.482
  153    HD3  LYS  22           HD1      LYS  22  17.113  -6.436  -3.658
  154    HE2  LYS  22           HE2      LYS  22  17.453  -8.730  -2.895
  155    HE3  LYS  22           HE1      LYS  22  17.813  -8.571  -4.614
  156    HZ1  LYS  22           HZ3      LYS  22  20.170  -8.470  -4.067
  157    HZ2  LYS  22           HZ1      LYS  22  19.478  -9.905  -3.495
  158    HZ3  LYS  22           HZ2      LYS  22  19.817  -8.643  -2.422
  159    H    ASP  23           HN       ASP  23  21.338  -2.605  -4.541
  160    HA   ASP  23           HA       ASP  23  20.579  -0.078  -3.339
  161    HB2  ASP  23           HB2      ASP  23  22.622  -0.680  -5.489
  162    HB3  ASP  23           HB1      ASP  23  22.417   0.865  -4.671
  163    H    THR  24           HN       THR  24  18.354  -0.270  -4.219
  164    HA   THR  24           HA       THR  24  18.217   0.616  -7.027
  165    HB   THR  24           HB       THR  24  15.943  -0.228  -7.116
  166    HG1  THR  24           HG1      THR  24  15.756  -1.658  -4.893
  167   HG21  THR  24          HG23      THR  24  16.376  -2.628  -6.887
  168   HG22  THR  24          HG21      THR  24  17.816  -2.281  -5.929
  169   HG23  THR  24          HG22      THR  24  17.749  -1.804  -7.626
  170    H    SER  25           HN       SER  25  17.516   1.397  -3.751
  171    HA   SER  25           HA       SER  25  16.662   3.231  -2.723
  172    HG   SER  25           HG       SER  25  18.847   3.616  -3.567
  173    HB2  SER  25           HB2      SER  25  17.178   4.532  -5.408
  174    HB3  SER  25           HB1      SER  25  16.845   5.392  -3.905
  175    H    SER  26           HN       SER  26  14.932   1.419  -4.456
  176    HA   SER  26           HA       SER  26  12.497   2.906  -4.073
  177    HG   SER  26           HG       SER  26  14.355   2.275  -7.259
  178    HB2  SER  26           HB2      SER  26  11.724   2.678  -6.418
  179    HB3  SER  26           HB1      SER  26  13.127   3.737  -6.278
  180    H    LEU  27           HN       LEU  27  10.785   1.591  -3.710
  181    HA   LEU  27           HA       LEU  27  11.299  -1.289  -3.797
  182    HG   LEU  27           HG       LEU  27  11.562   0.143  -1.318
  183    HB2  LEU  27           HB2      LEU  27   9.254   0.377  -2.341
  184    HB3  LEU  27           HB1      LEU  27   9.186  -1.373  -2.389
  185   HD11  LEU  27          HD11      LEU  27  10.699  -0.298   0.906
  186   HD12  LEU  27          HD12      LEU  27   9.251  -1.031   0.218
  187   HD13  LEU  27          HD13      LEU  27   9.561   0.690  -0.011
  188   HD21  LEU  27          HD23      LEU  27  11.998  -2.156  -2.018
  189   HD22  LEU  27          HD21      LEU  27  10.665  -2.720  -1.008
  190   HD23  LEU  27          HD22      LEU  27  12.090  -1.995  -0.263
  191    H    GLY  28           HN       GLY  28   9.733   1.095  -5.563
  192    HA2  GLY  28           HA2      GLY  28   8.665   0.717  -7.625
  193    HA3  GLY  28           HA1      GLY  28   8.337  -0.935  -7.129
  194    H    ILE  29           HN       ILE  29   7.586   1.407  -4.772
  195    HA   ILE  29           HA       ILE  29   4.732   0.998  -5.291
  196    HB   ILE  29           HB       ILE  29   6.087   2.105  -2.828
  197   HG12  ILE  29          HG12      ILE  29   4.860  -0.624  -3.282
  198   HG13  ILE  29          HG11      ILE  29   6.589  -0.293  -3.307
  199   HG21  ILE  29          HG21      ILE  29   3.226   1.281  -3.306
  200   HG22  ILE  29          HG22      ILE  29   3.815   2.928  -3.080
  201   HG23  ILE  29          HG23      ILE  29   3.905   1.770  -1.754
  202   HD11  ILE  29          HD13      ILE  29   6.492   0.405  -0.975
  203   HD12  ILE  29          HD11      ILE  29   5.898  -1.242  -1.184
  204   HD13  ILE  29          HD12      ILE  29   4.758   0.082  -0.950
  205    H    SER  30           HN       SER  30   3.812   2.523  -6.511
  206    HA   SER  30           HA       SER  30   4.643   5.323  -6.118
  207    HG   SER  30           HG       SER  30   2.816   6.220  -8.518
  208    HB2  SER  30           HB2      SER  30   5.017   4.459  -8.401
  209    HB3  SER  30           HB1      SER  30   3.301   4.076  -8.530
  210    H    ILE  31           HN       ILE  31   3.297   6.101  -4.598
  211    HA   ILE  31           HA       ILE  31   0.447   5.495  -4.709
  212    HB   ILE  31           HB       ILE  31   0.321   6.758  -2.579
  213   HG12  ILE  31          HG12      ILE  31   3.336   6.907  -2.820
  214   HG13  ILE  31          HG11      ILE  31   2.247   8.270  -3.059
  215   HG21  ILE  31          HG21      ILE  31   0.650   4.356  -2.549
  216   HG22  ILE  31          HG22      ILE  31   1.546   5.108  -1.229
  217   HG23  ILE  31          HG23      ILE  31   2.396   4.572  -2.678
  218   HD11  ILE  31          HD13      ILE  31   2.585   6.715  -0.505
  219   HD12  ILE  31          HD11      ILE  31   1.511   8.093  -0.746
  220   HD13  ILE  31          HD12      ILE  31   3.258   8.308  -0.852
  221    H    SER  32           HN       SER  32  -1.088   7.337  -4.312
  222    HA   SER  32           HA       SER  32  -0.232   9.804  -5.667
  223    HG   SER  32           HG       SER  32  -2.874   9.998  -7.894
  224    HB2  SER  32           HB2      SER  32  -1.441   8.453  -7.308
  225    HB3  SER  32           HB1      SER  32  -2.793   8.272  -6.190
  226    H    GLY  33           HN       GLY  33  -0.928  11.660  -4.750
  227    HA2  GLY  33           HA2      GLY  33  -1.938  11.678  -2.141
  228    HA3  GLY  33           HA1      GLY  33  -1.883  13.070  -3.213
  229    H    MET  34           HN       MET  34  -3.913  11.518  -1.308
  230    HA   MET  34           HA       MET  34  -6.188  11.322  -3.098
  231    HB2  MET  34           HB2      MET  34  -5.892   9.674  -1.287
  232    HB3  MET  34           HB1      MET  34  -6.025  10.963  -0.099
  233    HG2  MET  34           HG2      MET  34  -8.312  11.394  -0.794
  234    HG3  MET  34           HG1      MET  34  -8.183  10.148  -2.033
  235    HE1  MET  34           HE3      MET  34 -10.348   8.983  -1.179
  236    HE2  MET  34           HE1      MET  34 -10.566  10.161   0.115
  237    HE3  MET  34           HE2      MET  34 -10.611   8.436   0.476
  238    H    ARG  35           HN       ARG  35  -6.906  13.260  -3.766
  239    HA   ARG  35           HA       ARG  35  -7.312  15.367  -1.758
  240    HE   ARG  35           HE       ARG  35  -6.630  14.044  -7.333
  241    HB2  ARG  35           HB2      ARG  35  -7.694  16.744  -3.971
  242    HB3  ARG  35           HB1      ARG  35  -6.071  16.395  -3.393
  243    HG2  ARG  35           HG2      ARG  35  -6.110  16.007  -5.736
  244    HG3  ARG  35           HG1      ARG  35  -6.019  14.438  -4.937
  245    HD2  ARG  35           HD2      ARG  35  -8.433  14.150  -5.244
  246    HD3  ARG  35           HD1      ARG  35  -8.516  15.717  -6.047
  247   HH11  ARG  35          HH11      ARG  35 -10.064  14.511  -6.948
  248   HH12  ARG  35          HH12      ARG  35 -10.461  13.809  -8.481
  249   HH21  ARG  35          HH21      ARG  35  -7.147  13.120  -9.353
  250   HH22  ARG  35          HH22      ARG  35  -8.803  13.018  -9.846
  251    H    ASP  36           HN       ASP  36  -9.106  13.225  -1.818
  252    HA   ASP  36           HA       ASP  36 -11.522  14.465  -2.961
  253    HB2  ASP  36           HB2      ASP  36 -11.039  11.545  -2.327
  254    HB3  ASP  36           HB1      ASP  36 -12.507  12.220  -3.027
  255    H    GLN  37           HN       GLN  37 -13.505  14.199  -1.734
  256    HA   GLN  37           HA       GLN  37 -14.742  14.485   0.151
  257    HB2  GLN  37           HB2      GLN  37 -12.729  12.548   1.307
  258    HB3  GLN  37           HB1      GLN  37 -14.269  12.974   2.044
  259    HG2  GLN  37           HG2      GLN  37 -15.445  12.035   0.116
  260    HG3  GLN  37           HG1      GLN  37 -13.899  11.596  -0.608
  261   HE21  GLN  37          HE21      GLN  37 -12.703   9.911   0.280
  262   HE22  GLN  37          HE22      GLN  37 -13.404   8.757   1.360
  263    H    SER  38           HN       SER  38 -14.234  16.674   0.419
  264    HA   SER  38           HA       SER  38 -11.933  17.586   1.808
  265    HG   SER  38           HG       SER  38 -13.582  18.520  -0.621
  266    HB2  SER  38           HB2      SER  38 -14.579  18.977   1.319
  267    HB3  SER  38           HB1      SER  38 -13.103  19.763   1.877
  268    H    THR  39           HN       THR  39 -11.851  16.332   3.714
  269    HA   THR  39           HA       THR  39 -13.645  17.310   5.825
  270    HB   THR  39           HB       THR  39 -13.731  15.085   6.847
  271    HG1  THR  39           HG1      THR  39 -12.015  14.486   4.714
  272   HG21  THR  39          HG23      THR  39 -15.236  14.016   5.255
  273   HG22  THR  39          HG21      THR  39 -14.613  15.035   3.959
  274   HG23  THR  39          HG22      THR  39 -15.514  15.757   5.291
  275    H    THR  40           HN       THR  40 -12.706  17.622   7.814
  276    HA   THR  40           HA       THR  40  -9.777  17.374   7.878
  277    HB   THR  40           HB       THR  40  -9.829  19.112   9.633
  278    HG1  THR  40           HG1      THR  40 -12.229  20.137   9.332
  279   HG21  THR  40          HG23      THR  40 -10.495  20.989   8.176
  280   HG22  THR  40          HG21      THR  40 -11.271  19.844   7.083
  281   HG23  THR  40          HG22      THR  40  -9.524  19.792   7.318
  282    H    GLY  41           HN       GLY  41 -11.651  15.212   8.519
  283    HA2  GLY  41           HA2      GLY  41 -10.720  14.711  11.267
  284    HA3  GLY  41           HA1      GLY  41 -12.400  14.419  10.847
  285    H    GLU  42           HN       GLU  42 -12.237  13.228   8.414
  286    HA   GLU  42           HA       GLU  42 -10.420  10.951   8.724
  287    HB2  GLU  42           HB2      GLU  42 -13.411  10.733   8.348
  288    HB3  GLU  42           HB1      GLU  42 -12.289   9.387   8.201
  289    HG2  GLU  42           HG2      GLU  42 -11.645   9.654  10.534
  290    HG3  GLU  42           HG1      GLU  42 -12.746  11.023  10.687
  291    H    ALA  43           HN       ALA  43  -9.229  11.521   6.941
  292    HA   ALA  43           HA       ALA  43 -10.532  11.102   4.369
  293    HB1  ALA  43           HB3      ALA  43 -10.453  13.575   4.880
  294    HB2  ALA  43           HB1      ALA  43  -9.677  13.077   3.376
  295    HB3  ALA  43           HB2      ALA  43  -8.696  13.449   4.793
  296    H    THR  44           HN       THR  44  -8.277  11.839   2.846
  297    HA   THR  44           HA       THR  44  -6.477  10.816   1.893
  298    HB   THR  44           HB       THR  44  -4.506  10.547   3.331
  299    HG1  THR  44           HG1      THR  44  -4.657  10.600   5.504
  300   HG21  THR  44          HG23      THR  44  -4.372  12.859   4.158
  301   HG22  THR  44          HG21      THR  44  -6.115  13.029   3.947
  302   HG23  THR  44          HG22      THR  44  -5.077  12.783   2.542
  303    H    GLY  45           HN       GLY  45  -4.711   8.864   2.708
  304    HA2  GLY  45           HA2      GLY  45  -5.501   6.602   3.956
  305    HA3  GLY  45           HA1      GLY  45  -6.372   6.512   2.434
  306    H    ILE  46           HN       ILE  46  -4.085   7.960   1.105
  307    HA   ILE  46           HA       ILE  46  -2.250   7.421  -0.126
  308    HB   ILE  46           HB       ILE  46  -1.544   5.702   2.256
  309   HG12  ILE  46          HG12      ILE  46  -1.893   8.036   2.896
  310   HG13  ILE  46          HG11      ILE  46  -0.183   7.627   2.975
  311   HG21  ILE  46          HG21      ILE  46   0.135   6.738  -0.019
  312   HG22  ILE  46          HG22      ILE  46  -0.233   5.055   0.358
  313   HG23  ILE  46          HG23      ILE  46   0.785   6.000   1.445
  314   HD11  ILE  46          HD13      ILE  46  -1.522   9.133   0.739
  315   HD12  ILE  46          HD11      ILE  46   0.197   8.753   0.855
  316   HD13  ILE  46          HD12      ILE  46  -0.548   9.840   2.028
  317    H    TYR  47           HN       TYR  47  -3.169   6.342  -1.828
  318    HA   TYR  47           HA       TYR  47  -3.218   3.403  -1.625
  319    HD1  TYR  47           HD1      TYR  47  -5.570   6.766  -1.902
  320    HD2  TYR  47           HD2      TYR  47  -4.827   4.526  -5.443
  321    HE1  TYR  47           HE1      TYR  47  -6.135   8.736  -3.261
  322    HE2  TYR  47           HE2      TYR  47  -5.388   6.491  -6.810
  323    HH   TYR  47           HH       TYR  47  -6.706   8.575  -6.588
  324    HB2  TYR  47           HB2      TYR  47  -4.995   3.416  -3.337
  325    HB3  TYR  47           HB1      TYR  47  -5.475   4.284  -1.884
  326    H    VAL  48           HN       VAL  48  -2.190   2.230  -3.165
  327    HA   VAL  48           HA       VAL  48  -0.329   3.623  -4.869
  328    HB   VAL  48           HB       VAL  48  -0.856   0.655  -4.638
  329   HG11  VAL  48          HG11      VAL  48   0.255   1.255  -6.724
  330   HG12  VAL  48          HG12      VAL  48   1.364   0.408  -5.645
  331   HG13  VAL  48          HG13      VAL  48   1.476   2.158  -5.826
  332   HG21  VAL  48          HG23      VAL  48  -0.158   1.646  -2.509
  333   HG22  VAL  48          HG21      VAL  48   1.250   2.354  -3.303
  334   HG23  VAL  48          HG22      VAL  48   1.096   0.601  -3.179
  335    H    LYS  49           HN       LYS  49  -0.667   4.185  -6.906
  336    HA   LYS  49           HA       LYS  49  -2.939   2.991  -8.338
  337    HB2  LYS  49           HB2      LYS  49  -3.090   5.407  -8.036
  338    HB3  LYS  49           HB1      LYS  49  -1.511   5.618  -8.781
  339    HG2  LYS  49           HG2      LYS  49  -2.446   4.648 -10.877
  340    HG3  LYS  49           HG1      LYS  49  -4.034   4.655 -10.107
  341    HD2  LYS  49           HD2      LYS  49  -2.317   7.111 -10.436
  342    HD3  LYS  49           HD1      LYS  49  -3.567   6.628 -11.583
  343    HE2  LYS  49           HE2      LYS  49  -5.234   6.738  -9.771
  344    HE3  LYS  49           HE1      LYS  49  -3.972   7.281  -8.666
  345    HZ1  LYS  49           HZ3      LYS  49  -3.648   9.234 -10.054
  346    HZ2  LYS  49           HZ1      LYS  49  -5.250   9.139  -9.521
  347    HZ3  LYS  49           HZ2      LYS  49  -4.863   8.714 -11.110
  348    H    SER  50           HN       SER  50   0.506   3.547  -8.466
  349    HA   SER  50           HA       SER  50   0.618   1.857 -10.861
  350    HG   SER  50           HG       SER  50   0.935   4.596 -12.707
  351    HB2  SER  50           HB2      SER  50   2.154   4.442 -10.510
  352    HB3  SER  50           HB1      SER  50   2.378   3.297 -11.833
  353    H    LEU  51           HN       LEU  51   2.880   1.082 -11.295
  354    HA   LEU  51           HA       LEU  51   4.494   0.828  -8.859
  355    HG   LEU  51           HG       LEU  51   1.866  -0.826  -8.998
  356    HB2  LEU  51           HB2      LEU  51   3.646  -1.486 -10.606
  357    HB3  LEU  51           HB1      LEU  51   4.776  -1.582  -9.270
  358   HD11  LEU  51          HD11      LEU  51   3.283  -3.433  -8.470
  359   HD12  LEU  51          HD12      LEU  51   2.051  -3.127  -9.695
  360   HD13  LEU  51          HD13      LEU  51   1.627  -3.063  -7.984
  361   HD21  LEU  51          HD23      LEU  51   3.960  -1.477  -6.926
  362   HD22  LEU  51          HD21      LEU  51   2.257  -1.149  -6.610
  363   HD23  LEU  51          HD22      LEU  51   3.293   0.123  -7.256
  364    H    ILE  52           HN       ILE  52   6.670  -0.077  -9.320
  365    HA   ILE  52           HA       ILE  52   7.631   0.922 -11.906
  366    HB   ILE  52           HB       ILE  52   9.144   0.372  -9.355
  367   HG12  ILE  52          HG12      ILE  52   8.403   2.960 -10.741
  368   HG13  ILE  52          HG11      ILE  52   7.679   2.345  -9.259
  369   HG21  ILE  52          HG21      ILE  52  11.051   1.426 -10.493
  370   HG22  ILE  52          HG22      ILE  52  10.107   1.506 -11.980
  371   HG23  ILE  52          HG23      ILE  52  10.543  -0.060 -11.295
  372   HD11  ILE  52          HD13      ILE  52   9.816   2.556  -8.122
  373   HD12  ILE  52          HD11      ILE  52   9.298   4.095  -8.808
  374   HD13  ILE  52          HD12      ILE  52  10.553   3.150  -9.609
  375    HA   PRO  53           HA       PRO  53   7.827  -3.551 -12.839
  376    HB2  PRO  53           HB2      PRO  53   8.679  -3.102 -15.434
  377    HB3  PRO  53           HB1      PRO  53   6.990  -3.216 -14.930
  378    HG2  PRO  53           HG2      PRO  53   8.667  -0.787 -15.409
  379    HG3  PRO  53           HG1      PRO  53   6.969  -1.081 -15.830
  380    HD2  PRO  53           HD2      PRO  53   7.633   0.421 -13.719
  381    HD3  PRO  53           HD1      PRO  53   6.232  -0.670 -13.666
  382    H    GLY  54           HN       GLY  54   9.605  -3.998 -11.519
  383    HA2  GLY  54           HA2      GLY  54  11.866  -5.000 -12.373
  384    HA3  GLY  54           HA1      GLY  54  12.263  -3.296 -12.537
  385    H    SER  55           HN       SER  55  10.295  -3.210 -10.020
  386    HA   SER  55           HA       SER  55  12.506  -3.368  -8.113
  387    HG   SER  55           HG       SER  55  12.272  -0.850  -8.025
  388    HB2  SER  55           HB2      SER  55   9.755  -2.135  -7.835
  389    HB3  SER  55           HB1      SER  55  11.029  -2.067  -6.619
  390    H    ALA  56           HN       ALA  56  11.576  -3.914  -5.769
  391    HA   ALA  56           HA       ALA  56  11.113  -6.665  -5.727
  392    HB1  ALA  56           HB3      ALA  56  12.108  -5.413  -3.868
  393    HB2  ALA  56           HB1      ALA  56  10.759  -6.419  -3.341
  394    HB3  ALA  56           HB2      ALA  56  10.539  -4.680  -3.534
  395    H    ALA  57           HN       ALA  57   8.827  -4.028  -5.000
  396    HA   ALA  57           HA       ALA  57   6.578  -5.564  -4.485
  397    HB1  ALA  57           HB3      ALA  57   6.702  -3.167  -4.042
  398    HB2  ALA  57           HB1      ALA  57   5.271  -3.569  -4.991
  399    HB3  ALA  57           HB2      ALA  57   6.673  -2.840  -5.774
  400    H    ALA  58           HN       ALA  58   7.883  -4.500  -7.587
  401    HA   ALA  58           HA       ALA  58   5.614  -5.415  -9.093
  402    HB1  ALA  58           HB3      ALA  58   6.948  -4.857 -11.059
  403    HB2  ALA  58           HB1      ALA  58   8.361  -4.603 -10.035
  404    HB3  ALA  58           HB2      ALA  58   6.959  -3.544  -9.882
  405    H    LEU  59           HN       LEU  59   8.731  -6.752  -8.177
  406    HA   LEU  59           HA       LEU  59   8.818  -8.868 -10.027
  407    HG   LEU  59           HG       LEU  59  11.052  -7.208  -9.181
  408    HB2  LEU  59           HB2      LEU  59  10.036  -8.488  -7.307
  409    HB3  LEU  59           HB1      LEU  59  10.277  -9.965  -8.222
  410   HD11  LEU  59          HD11      LEU  59  13.352  -7.936  -8.766
  411   HD12  LEU  59          HD12      LEU  59  12.747  -9.430  -8.051
  412   HD13  LEU  59          HD13      LEU  59  12.406  -7.882  -7.279
  413   HD21  LEU  59          HD23      LEU  59  11.610  -9.952 -10.302
  414   HD22  LEU  59          HD21      LEU  59  12.283  -8.440 -10.910
  415   HD23  LEU  59          HD22      LEU  59  10.547  -8.733 -11.003
  416    H    ASP  60           HN       ASP  60   7.771  -8.891  -6.618
  417    HA   ASP  60           HA       ASP  60   6.894 -11.537  -6.549
  418    HB2  ASP  60           HB2      ASP  60   5.928  -9.139  -4.980
  419    HB3  ASP  60           HB1      ASP  60   5.500 -10.807  -4.604
  420    H    GLY  61           HN       GLY  61   5.166  -8.577  -7.428
  421    HA2  GLY  61           HA2      GLY  61   3.355  -8.346  -8.854
  422    HA3  GLY  61           HA1      GLY  61   3.319 -10.092  -9.041
  423    H    ARG  62           HN       ARG  62   3.354  -9.949  -5.878
  424    HA   ARG  62           HA       ARG  62   0.618 -10.522  -5.556
  425    HE   ARG  62           HE       ARG  62   1.102 -11.793  -1.777
  426    HB2  ARG  62           HB2      ARG  62   2.713  -9.811  -3.497
  427    HB3  ARG  62           HB1      ARG  62   1.115 -10.435  -3.115
  428    HG2  ARG  62           HG2      ARG  62   1.635 -12.486  -4.365
  429    HG3  ARG  62           HG1      ARG  62   3.252 -11.859  -4.689
  430    HD2  ARG  62           HD2      ARG  62   3.252 -13.424  -2.808
  431    HD3  ARG  62           HD1      ARG  62   3.726 -11.802  -2.302
  432   HH11  ARG  62          HH11      ARG  62   3.596 -14.116  -1.041
  433   HH12  ARG  62          HH12      ARG  62   2.830 -14.668   0.412
  434   HH21  ARG  62          HH21      ARG  62   0.090 -12.515   0.135
  435   HH22  ARG  62          HH22      ARG  62   0.839 -13.760   1.078
  436    H    ILE  63           HN       ILE  63   2.280  -7.564  -5.731
  437    HA   ILE  63           HA       ILE  63   0.090  -6.114  -4.413
  438    HB   ILE  63           HB       ILE  63   2.804  -5.104  -5.279
  439   HG12  ILE  63          HG12      ILE  63   1.727  -5.634  -2.500
  440   HG13  ILE  63          HG11      ILE  63   2.830  -6.699  -3.364
  441   HG21  ILE  63          HG21      ILE  63   2.219  -3.085  -4.006
  442   HG22  ILE  63          HG22      ILE  63   0.607  -3.741  -3.724
  443   HG23  ILE  63          HG23      ILE  63   1.126  -3.351  -5.364
  444   HD11  ILE  63          HD13      ILE  63   4.503  -4.912  -3.402
  445   HD12  ILE  63          HD11      ILE  63   4.025  -5.342  -1.760
  446   HD13  ILE  63          HD12      ILE  63   3.399  -3.872  -2.504
  447    H    GLU  64           HN       GLU  64  -1.476  -5.423  -5.708
  448    HA   GLU  64           HA       GLU  64  -1.005  -5.096  -8.552
  449    HB2  GLU  64           HB2      GLU  64  -3.371  -5.334  -6.792
  450    HB3  GLU  64           HB1      GLU  64  -3.581  -4.345  -8.231
  451    HG2  GLU  64           HG2      GLU  64  -4.274  -6.631  -8.631
  452    HG3  GLU  64           HG1      GLU  64  -2.884  -6.210  -9.629
  453    HA   PRO  65           HA       PRO  65  -0.671  -0.684  -8.480
  454    HB2  PRO  65           HB2      PRO  65  -1.523  -0.031 -10.938
  455    HB3  PRO  65           HB1      PRO  65  -0.033  -0.950 -10.692
  456    HG2  PRO  65           HG2      PRO  65  -2.761  -1.937 -11.445
  457    HG3  PRO  65           HG1      PRO  65  -1.186  -2.386 -12.125
  458    HD2  PRO  65           HD2      PRO  65  -2.501  -3.887 -10.266
  459    HD3  PRO  65           HD1      PRO  65  -0.733  -3.858 -10.424
  460    H    ASN  66           HN       ASN  66  -3.115  -1.705  -7.264
  461    HA   ASN  66           HA       ASN  66  -4.664   0.691  -7.333
  462    HB2  ASN  66           HB2      ASN  66  -5.510  -0.456  -9.372
  463    HB3  ASN  66           HB1      ASN  66  -5.990  -1.824  -8.373
  464   HD21  ASN  66          HD21      ASN  66  -8.147  -1.616  -8.903
  465   HD22  ASN  66          HD22      ASN  66  -9.132  -0.330  -8.305
  466    H    ASP  67           HN       ASP  67  -3.602   0.055  -5.160
  467    HA   ASP  67           HA       ASP  67  -5.655  -1.321  -3.563
  468    HB2  ASP  67           HB2      ASP  67  -3.933  -2.347  -2.175
  469    HB3  ASP  67           HB1      ASP  67  -3.710  -2.823  -3.856
  470    H    LYS  68           HN       LYS  68  -5.427  -0.773  -1.179
  471    HA   LYS  68           HA       LYS  68  -4.656   2.061  -0.938
  472    HB2  LYS  68           HB2      LYS  68  -7.072   1.673  -0.732
  473    HB3  LYS  68           HB1      LYS  68  -6.781   0.547   0.587
  474    HG2  LYS  68           HG2      LYS  68  -5.873   2.339   1.948
  475    HG3  LYS  68           HG1      LYS  68  -6.091   3.477   0.617
  476    HD2  LYS  68           HD2      LYS  68  -8.510   3.091   0.694
  477    HD3  LYS  68           HD1      LYS  68  -8.284   1.963   2.034
  478    HE2  LYS  68           HE2      LYS  68  -7.372   3.748   3.405
  479    HE3  LYS  68           HE1      LYS  68  -7.523   4.881   2.063
  480    HZ1  LYS  68           HZ3      LYS  68  -9.767   3.495   3.433
  481    HZ2  LYS  68           HZ1      LYS  68  -9.925   4.557   2.126
  482    HZ3  LYS  68           HZ2      LYS  68  -9.350   5.125   3.612
  483    H    ILE  69           HN       ILE  69  -2.736   2.165   0.028
  484    HA   ILE  69           HA       ILE  69  -1.684   0.237   1.796
  485    HB   ILE  69           HB       ILE  69  -0.874   3.136   1.520
  486   HG12  ILE  69          HG12      ILE  69  -0.826   1.964  -0.636
  487   HG13  ILE  69          HG11      ILE  69   0.804   2.326  -0.077
  488   HG21  ILE  69          HG21      ILE  69   0.011   2.090   3.536
  489   HG22  ILE  69          HG22      ILE  69   1.295   2.394   2.366
  490   HG23  ILE  69          HG23      ILE  69   0.659   0.763   2.573
  491   HD11  ILE  69          HD13      ILE  69   0.704   0.113  -1.035
  492   HD12  ILE  69          HD11      ILE  69  -0.584  -0.340   0.081
  493   HD13  ILE  69          HD12      ILE  69   1.033   0.010   0.695
  494    H    LEU  70           HN       LEU  70  -1.500   0.187   4.021
  495    HA   LEU  70           HA       LEU  70  -3.241   2.065   5.480
  496    HG   LEU  70           HG       LEU  70  -4.179  -0.607   4.250
  497    HB2  LEU  70           HB2      LEU  70  -2.592  -0.798   6.182
  498    HB3  LEU  70           HB1      LEU  70  -3.647   0.270   7.088
  499   HD11  LEU  70          HD11      LEU  70  -5.306  -1.676   6.833
  500   HD12  LEU  70          HD12      LEU  70  -4.213  -2.529   5.743
  501   HD13  LEU  70          HD13      LEU  70  -5.845  -2.116   5.213
  502   HD21  LEU  70          HD23      LEU  70  -6.431   0.228   4.690
  503   HD22  LEU  70          HD21      LEU  70  -5.232   1.507   4.878
  504   HD23  LEU  70          HD22      LEU  70  -5.934   0.739   6.303
  505    H    ARG  71           HN       ARG  71  -0.492  -0.142   6.061
  506    HA   ARG  71           HA       ARG  71   1.031   1.972   7.271
  507    HE   ARG  71           HE       ARG  71   1.338  -0.304  11.141
  508    HB2  ARG  71           HB2      ARG  71   1.259   0.832   9.473
  509    HB3  ARG  71           HB1      ARG  71  -0.355   1.459   9.167
  510    HG2  ARG  71           HG2      ARG  71  -1.083  -0.802   8.521
  511    HG3  ARG  71           HG1      ARG  71   0.526  -1.408   8.917
  512    HD2  ARG  71           HD2      ARG  71  -1.375  -0.055  10.830
  513    HD3  ARG  71           HD1      ARG  71  -1.058  -1.788  10.746
  514   HH11  ARG  71          HH11      ARG  71  -1.489  -1.518  12.779
  515   HH12  ARG  71          HH12      ARG  71  -0.715  -1.600  14.327
  516   HH21  ARG  71          HH21      ARG  71   2.364  -0.409  13.176
  517   HH22  ARG  71          HH22      ARG  71   1.474  -0.969  14.551
  518    H    VAL  72           HN       VAL  72   3.154   1.598   7.158
  519    HA   VAL  72           HA       VAL  72   4.047  -0.894   5.955
  520    HB   VAL  72           HB       VAL  72   5.855   1.400   6.665
  521   HG11  VAL  72          HG11      VAL  72   6.986   0.677   4.567
  522   HG12  VAL  72          HG12      VAL  72   5.845  -0.665   4.472
  523   HG13  VAL  72          HG13      VAL  72   6.962  -0.552   5.832
  524   HG21  VAL  72          HG23      VAL  72   4.063   1.260   4.243
  525   HG22  VAL  72          HG21      VAL  72   5.347   2.440   4.503
  526   HG23  VAL  72          HG22      VAL  72   3.939   2.420   5.566
  527    H    ASP  73           HN       ASP  73   6.348  -1.605   6.821
  528    HA   ASP  73           HA       ASP  73   6.113  -2.877   9.206
  529    HB2  ASP  73           HB2      ASP  73   7.969  -3.090   7.482
  530    HB3  ASP  73           HB1      ASP  73   8.744  -1.727   8.279
  531    H    ASP  74           HN       ASP  74   5.518  -2.031  11.098
  532    HA   ASP  74           HA       ASP  74   5.428  -0.725  12.958
  533    HB2  ASP  74           HB2      ASP  74   8.361  -0.441  12.287
  534    HB3  ASP  74           HB1      ASP  74   7.642   0.081  13.807
  535    H    VAL  75           HN       VAL  75   4.745   0.600  10.486
  536    HA   VAL  75           HA       VAL  75   5.063   3.351  11.389
  537    HB   VAL  75           HB       VAL  75   5.798   2.502   8.580
  538   HG11  VAL  75          HG11      VAL  75   4.555   4.581   8.540
  539   HG12  VAL  75          HG12      VAL  75   6.257   4.889   8.197
  540   HG13  VAL  75          HG13      VAL  75   5.599   5.257   9.791
  541   HG21  VAL  75          HG23      VAL  75   7.463   3.762  10.758
  542   HG22  VAL  75          HG21      VAL  75   8.001   3.435   9.110
  543   HG23  VAL  75          HG22      VAL  75   7.588   2.099  10.185
  544    H    ASN  76           HN       ASN  76   3.162   4.366  11.290
  545    HA   ASN  76           HA       ASN  76   1.009   3.163   9.712
  546    HB2  ASN  76           HB2      ASN  76   0.553   3.565  12.087
  547    HB3  ASN  76           HB1      ASN  76   0.921   5.275  11.882
  548   HD21  ASN  76          HD21      ASN  76  -1.359   2.732  11.244
  549   HD22  ASN  76          HD22      ASN  76  -2.674   3.752  10.781
  550    H    VAL  77           HN       VAL  77   0.397   4.031   7.828
  551    HA   VAL  77           HA       VAL  77   1.269   6.782   7.235
  552    HB   VAL  77           HB       VAL  77   1.067   6.182   4.853
  553   HG11  VAL  77          HG11      VAL  77   2.835   4.385   6.506
  554   HG12  VAL  77          HG12      VAL  77   3.230   5.988   5.885
  555   HG13  VAL  77          HG13      VAL  77   3.008   4.640   4.770
  556   HG21  VAL  77          HG23      VAL  77   0.767   3.853   4.192
  557   HG22  VAL  77          HG21      VAL  77  -0.644   4.448   5.067
  558   HG23  VAL  77          HG22      VAL  77   0.518   3.398   5.878
  559    H    GLN  78           HN       GLN  78  -1.209   5.952   8.654
  560    HA   GLN  78           HA       GLN  78  -3.291   6.694   6.745
  561    HB2  GLN  78           HB2      GLN  78  -3.453   5.793   9.626
  562    HB3  GLN  78           HB1      GLN  78  -4.845   6.188   8.627
  563    HG2  GLN  78           HG2      GLN  78  -2.861   3.991   8.090
  564    HG3  GLN  78           HG1      GLN  78  -4.476   3.784   8.765
  565   HE21  GLN  78          HE21      GLN  78  -2.625   4.509   5.918
  566   HE22  GLN  78          HE22      GLN  78  -3.912   4.315   4.782
  567    H    GLY  79           HN       GLY  79  -1.210   8.575   7.775
  568    HA2  GLY  79           HA2      GLY  79  -2.934  10.810   8.180
  569    HA3  GLY  79           HA1      GLY  79  -2.133  10.352   9.675
  570    H    MET  80           HN       MET  80  -0.355   9.704   6.827
  571    HA   MET  80           HA       MET  80   1.247  12.138   7.270
  572    HB2  MET  80           HB2      MET  80   2.181   9.381   6.455
  573    HB3  MET  80           HB1      MET  80   3.209  10.806   6.509
  574    HG2  MET  80           HG2      MET  80   2.650  11.004   8.941
  575    HG3  MET  80           HG1      MET  80   1.858   9.435   8.816
  576    HE1  MET  80           HE3      MET  80   4.903   7.158   7.739
  577    HE2  MET  80           HE1      MET  80   3.894   8.076   6.620
  578    HE3  MET  80           HE2      MET  80   3.158   7.231   7.982
  579    H    ALA  81           HN       ALA  81   2.003  13.256   5.499
  580    HA   ALA  81           HA       ALA  81   0.450  13.141   3.148
  581    HB1  ALA  81           HB3      ALA  81   1.544  15.188   4.039
  582    HB2  ALA  81           HB1      ALA  81   1.834  14.916   2.320
  583    HB3  ALA  81           HB2      ALA  81   3.092  14.544   3.497
  584    H    GLN  82           HN       GLN  82   1.383  12.978   0.926
  585    HA   GLN  82           HA       GLN  82   2.316  10.440   0.392
  586    HB2  GLN  82           HB2      GLN  82   1.266  11.830  -1.306
  587    HB3  GLN  82           HB1      GLN  82   2.629  12.939  -1.279
  588    HG2  GLN  82           HG2      GLN  82   4.087  11.200  -2.147
  589    HG3  GLN  82           HG1      GLN  82   2.746  10.055  -2.135
  590   HE21  GLN  82          HE21      GLN  82   1.110  10.253  -3.660
  591   HE22  GLN  82          HE22      GLN  82   1.296  11.207  -5.089
  592    H    SER  83           HN       SER  83   4.236  13.444   0.302
  593    HA   SER  83           HA       SER  83   6.702  12.383  -0.297
  594    HG   SER  83           HG       SER  83   6.907  15.015  -1.087
  595    HB2  SER  83           HB2      SER  83   6.112  14.694   1.565
  596    HB3  SER  83           HB1      SER  83   7.669  14.365   0.807
  597    H    ASP  84           HN       ASP  84   5.185  12.660   2.895
  598    HA   ASP  84           HA       ASP  84   7.375  11.799   4.420
  599    HB2  ASP  84           HB2      ASP  84   4.414  11.507   4.966
  600    HB3  ASP  84           HB1      ASP  84   5.684  11.236   6.155
  601    H    VAL  85           HN       VAL  85   4.645   9.952   3.084
  602    HA   VAL  85           HA       VAL  85   5.399   7.444   4.077
  603    HB   VAL  85           HB       VAL  85   3.916   7.973   1.499
  604   HG11  VAL  85          HG11      VAL  85   3.946   5.601   3.361
  605   HG12  VAL  85          HG12      VAL  85   4.604   5.665   1.725
  606   HG13  VAL  85          HG13      VAL  85   2.863   5.792   1.982
  607   HG21  VAL  85          HG23      VAL  85   1.873   7.848   2.851
  608   HG22  VAL  85          HG21      VAL  85   2.889   9.210   3.325
  609   HG23  VAL  85          HG22      VAL  85   2.854   7.750   4.314
  610    H    VAL  86           HN       VAL  86   6.415   9.206   1.216
  611    HA   VAL  86           HA       VAL  86   7.691   7.041  -0.092
  612    HB   VAL  86           HB       VAL  86   8.241  10.005  -0.326
  613   HG11  VAL  86          HG11      VAL  86   9.257   9.430  -2.494
  614   HG12  VAL  86          HG12      VAL  86   9.053   7.719  -2.121
  615   HG13  VAL  86          HG13      VAL  86  10.129   8.712  -1.140
  616   HG21  VAL  86          HG23      VAL  86   6.589   8.213  -2.102
  617   HG22  VAL  86          HG21      VAL  86   6.802   9.956  -2.253
  618   HG23  VAL  86          HG22      VAL  86   5.925   9.291  -0.876
  619    H    GLU  87           HN       GLU  87   8.868   9.540   2.138
  620    HA   GLU  87           HA       GLU  87  11.586   8.924   2.057
  621    HB2  GLU  87           HB2      GLU  87   9.910   9.966   4.346
  622    HB3  GLU  87           HB1      GLU  87  11.667   9.911   4.359
  623    HG2  GLU  87           HG2      GLU  87  11.744  11.420   2.454
  624    HG3  GLU  87           HG1      GLU  87   9.982  11.452   2.400
  625    H    VAL  88           HN       VAL  88   9.023   7.614   4.132
  626    HA   VAL  88           HA       VAL  88  10.570   5.946   5.734
  627    HB   VAL  88           HB       VAL  88   7.737   5.610   4.748
  628   HG11  VAL  88          HG11      VAL  88   7.464   3.948   6.552
  629   HG12  VAL  88          HG12      VAL  88   9.202   4.005   6.840
  630   HG13  VAL  88          HG13      VAL  88   8.584   3.410   5.298
  631   HG21  VAL  88          HG23      VAL  88   8.125   7.547   6.173
  632   HG22  VAL  88          HG21      VAL  88   8.865   6.513   7.395
  633   HG23  VAL  88          HG22      VAL  88   7.153   6.339   7.011
  634    H    LEU  89           HN       LEU  89   8.890   5.158   2.698
  635    HA   LEU  89           HA       LEU  89   9.787   2.512   2.521
  636    HG   LEU  89           HG       LEU  89   7.188   4.036   1.953
  637    HB2  LEU  89           HB2      LEU  89   9.023   4.409   0.300
  638    HB3  LEU  89           HB1      LEU  89   9.174   2.671   0.136
  639   HD11  LEU  89          HD11      LEU  89   5.510   3.405   0.293
  640   HD12  LEU  89          HD12      LEU  89   6.783   2.805  -0.770
  641   HD13  LEU  89          HD13      LEU  89   6.694   4.524  -0.381
  642   HD21  LEU  89          HD23      LEU  89   6.158   1.821   2.070
  643   HD22  LEU  89          HD21      LEU  89   7.812   1.793   2.680
  644   HD23  LEU  89          HD22      LEU  89   7.454   1.163   1.071
  645    H    ARG  90           HN       ARG  90  11.340   5.520   1.790
  646    HA   ARG  90           HA       ARG  90  13.442   4.273   0.222
  647    HE   ARG  90           HE       ARG  90  11.897   8.831   0.060
  648    HB2  ARG  90           HB2      ARG  90  12.960   7.115   1.110
  649    HB3  ARG  90           HB1      ARG  90  14.404   6.617   0.236
  650    HG2  ARG  90           HG2      ARG  90  12.931   5.798  -1.595
  651    HG3  ARG  90           HG1      ARG  90  11.558   6.495  -0.733
  652    HD2  ARG  90           HD2      ARG  90  13.976   8.000  -1.728
  653    HD3  ARG  90           HD1      ARG  90  12.380   8.000  -2.477
  654   HH11  ARG  90          HH11      ARG  90  14.077   9.878  -2.448
  655   HH12  ARG  90          HH12      ARG  90  14.066  11.535  -1.943
  656   HH21  ARG  90          HH21      ARG  90  11.878  11.007   0.733
  657   HH22  ARG  90          HH22      ARG  90  12.819  12.177  -0.131
  658    H    ASN  91           HN       ASN  91  12.775   4.786   3.479
  659    HA   ASN  91           HA       ASN  91  15.604   4.843   4.239
  660    HB2  ASN  91           HB2      ASN  91  13.051   5.341   5.755
  661    HB3  ASN  91           HB1      ASN  91  14.570   5.052   6.596
  662   HD21  ASN  91          HD21      ASN  91  14.416   6.703   3.528
  663   HD22  ASN  91          HD22      ASN  91  14.830   8.268   4.129
  664    H    ALA  92           HN       ALA  92  13.069   2.683   3.755
  665    HA   ALA  92           HA       ALA  92  13.416   0.777   5.755
  666    HB1  ALA  92           HB3      ALA  92  11.544   0.696   4.236
  667    HB2  ALA  92           HB1      ALA  92  12.438  -0.822   4.146
  668    HB3  ALA  92           HB2      ALA  92  12.620   0.386   2.873
  669    H    GLY  93           HN       GLY  93  14.390  -0.128   2.482
  670    HA2  GLY  93           HA2      GLY  93  16.261  -1.209   1.698
  671    HA3  GLY  93           HA1      GLY  93  17.159  -0.344   2.937
  672    H    ASN  94           HN       ASN  94  14.541  -2.349   3.916
  673    HA   ASN  94           HA       ASN  94  16.255  -4.637   4.475
  674    HB2  ASN  94           HB2      ASN  94  15.104  -2.792   6.541
  675    HB3  ASN  94           HB1      ASN  94  15.284  -4.502   6.920
  676   HD21  ASN  94          HD21      ASN  94  17.638  -4.810   5.249
  677   HD22  ASN  94          HD22      ASN  94  18.938  -4.054   6.093
  678    HA   PRO  95           HA       PRO  95  12.514  -7.018   4.066
  679    HB2  PRO  95           HB2      PRO  95  12.358  -8.593   6.292
  680    HB3  PRO  95           HB1      PRO  95  13.464  -8.905   4.950
  681    HG2  PRO  95           HG2      PRO  95  14.000  -7.562   7.571
  682    HG3  PRO  95           HG1      PRO  95  14.981  -8.760   6.706
  683    HD2  PRO  95           HD2      PRO  95  15.578  -6.148   6.640
  684    HD3  PRO  95           HD1      PRO  95  15.818  -7.189   5.224
  685    H    VAL  96           HN       VAL  96  11.274  -5.015   4.311
  686    HA   VAL  96           HA       VAL  96   9.988  -4.589   6.888
  687    HB   VAL  96           HB       VAL  96   8.894  -2.658   5.757
  688   HG11  VAL  96          HG11      VAL  96  10.987  -2.376   6.985
  689   HG12  VAL  96          HG12      VAL  96  10.911  -1.290   5.597
  690   HG13  VAL  96          HG13      VAL  96  11.900  -2.749   5.522
  691   HG21  VAL  96          HG23      VAL  96   9.670  -1.973   3.546
  692   HG22  VAL  96          HG21      VAL  96   8.881  -3.550   3.480
  693   HG23  VAL  96          HG22      VAL  96  10.640  -3.441   3.424
  694    H    ARG  97           HN       ARG  97   7.705  -4.525   7.135
  695    HA   ARG  97           HA       ARG  97   6.329  -6.504   5.498
  696    HE   ARG  97           HE       ARG  97   2.087  -8.032   7.677
  697    HB2  ARG  97           HB2      ARG  97   6.293  -6.763   7.955
  698    HB3  ARG  97           HB1      ARG  97   5.500  -5.200   8.100
  699    HG2  ARG  97           HG2      ARG  97   3.587  -6.075   6.827
  700    HG3  ARG  97           HG1      ARG  97   4.378  -7.651   6.757
  701    HD2  ARG  97           HD2      ARG  97   4.353  -7.764   9.205
  702    HD3  ARG  97           HD1      ARG  97   3.558  -6.192   9.268
  703   HH11  ARG  97          HH11      ARG  97   2.800  -7.167  10.976
  704   HH12  ARG  97          HH12      ARG  97   1.311  -7.795  11.598
  705   HH21  ARG  97          HH21      ARG  97   0.124  -8.860   8.487
  706   HH22  ARG  97          HH22      ARG  97  -0.211  -8.758  10.183
  707    H    LEU  98           HN       LEU  98   4.414  -6.086   4.426
  708    HA   LEU  98           HA       LEU  98   3.713  -3.237   4.149
  709    HG   LEU  98           HG       LEU  98   5.865  -4.795   2.526
  710    HB2  LEU  98           HB2      LEU  98   3.455  -5.389   2.054
  711    HB3  LEU  98           HB1      LEU  98   3.150  -3.676   1.840
  712   HD11  LEU  98          HD11      LEU  98   4.753  -4.070  -0.180
  713   HD12  LEU  98          HD12      LEU  98   5.133  -5.697   0.381
  714   HD13  LEU  98          HD13      LEU  98   6.424  -4.515   0.168
  715   HD21  LEU  98          HD23      LEU  98   5.555  -2.454   3.091
  716   HD22  LEU  98          HD21      LEU  98   4.966  -2.121   1.463
  717   HD23  LEU  98          HD22      LEU  98   6.640  -2.617   1.711
  718    H    LEU  99           HN       LEU  99   1.907  -3.000   5.367
  719    HA   LEU  99           HA       LEU  99  -0.188  -5.043   5.162
  720    HG   LEU  99           HG       LEU  99  -2.295  -3.803   6.874
  721    HB2  LEU  99           HB2      LEU  99   0.642  -4.272   7.414
  722    HB3  LEU  99           HB1      LEU  99  -0.071  -2.707   7.065
  723   HD11  LEU  99          HD11      LEU  99  -0.808  -6.233   7.860
  724   HD12  LEU  99          HD12      LEU  99  -1.557  -6.040   6.276
  725   HD13  LEU  99          HD13      LEU  99  -2.560  -6.081   7.726
  726   HD21  LEU  99          HD23      LEU  99  -0.772  -4.121   9.454
  727   HD22  LEU  99          HD21      LEU  99  -2.523  -4.289   9.317
  728   HD23  LEU  99          HD22      LEU  99  -1.753  -2.747   8.942
  729    H    LEU 100           HN       LEU 100  -1.437  -4.667   3.441
  730    HA   LEU 100           HA       LEU 100  -2.724  -2.038   3.241
  731    HG   LEU 100           HG       LEU 100  -0.128  -3.933   1.664
  732    HB2  LEU 100           HB2      LEU 100  -2.615  -2.545   0.659
  733    HB3  LEU 100           HB1      LEU 100  -1.301  -1.728   1.483
  734   HD11  LEU 100          HD11      LEU 100  -0.860  -5.768   0.257
  735   HD12  LEU 100          HD12      LEU 100  -2.285  -4.850  -0.230
  736   HD13  LEU 100          HD13      LEU 100  -2.102  -5.370   1.445
  737   HD21  LEU 100          HD23      LEU 100   0.480  -2.346  -0.058
  738   HD22  LEU 100          HD21      LEU 100  -0.809  -2.946  -1.102
  739   HD23  LEU 100          HD22      LEU 100   0.556  -3.988  -0.699
  740    H    ILE 101           HN       ILE 101  -4.678  -2.151   1.748
  741    HA   ILE 101           HA       ILE 101  -6.021  -4.739   2.160
  742    HB   ILE 101           HB       ILE 101  -7.003  -2.935   3.501
  743   HG12  ILE 101          HG12      ILE 101  -8.851  -3.702   1.234
  744   HG13  ILE 101          HG11      ILE 101  -8.387  -4.801   2.528
  745   HG21  ILE 101          HG21      ILE 101  -7.593  -1.613   0.856
  746   HG22  ILE 101          HG22      ILE 101  -6.425  -1.055   2.055
  747   HG23  ILE 101          HG23      ILE 101  -8.147  -1.063   2.437
  748   HD11  ILE 101          HD13      ILE 101  -9.410  -3.303   4.162
  749   HD12  ILE 101          HD11      ILE 101 -10.568  -3.828   2.940
  750   HD13  ILE 101          HD12      ILE 101  -9.875  -2.207   2.860
  751    H    ARG 102           HN       ARG 102  -6.947  -5.745   0.502
  752    HA   ARG 102           HA       ARG 102  -6.885  -4.423  -2.131
  753    HE   ARG 102           HE       ARG 102  -5.007  -7.132  -4.721
  754    HB2  ARG 102           HB2      ARG 102  -6.430  -7.298  -1.349
  755    HB3  ARG 102           HB1      ARG 102  -6.763  -6.819  -3.006
  756    HG2  ARG 102           HG2      ARG 102  -4.504  -5.619  -1.441
  757    HG3  ARG 102           HG1      ARG 102  -4.329  -7.133  -2.329
  758    HD2  ARG 102           HD2      ARG 102  -5.173  -4.483  -3.497
  759    HD3  ARG 102           HD1      ARG 102  -3.582  -5.224  -3.661
  760   HH11  ARG 102          HH11      ARG 102  -5.487  -3.699  -5.079
  761   HH12  ARG 102          HH12      ARG 102  -6.199  -3.834  -6.652
  762   HH21  ARG 102          HH21      ARG 102  -5.946  -7.318  -6.789
  763   HH22  ARG 102          HH22      ARG 102  -6.461  -5.890  -7.623
  764    H    ARG 103           HN       ARG 103  -8.633  -4.711  -3.526
  765    HA   ARG 103           HA       ARG 103 -11.111  -5.495  -2.183
  766    HE   ARG 103           HE       ARG 103 -10.768  -0.418  -2.282
  767    HB2  ARG 103           HB2      ARG 103 -10.740  -4.028  -4.801
  768    HB3  ARG 103           HB1      ARG 103 -12.258  -4.265  -3.945
  769    HG2  ARG 103           HG2      ARG 103 -11.429  -2.910  -2.090
  770    HG3  ARG 103           HG1      ARG 103  -9.904  -2.674  -2.945
  771    HD2  ARG 103           HD2      ARG 103 -11.135  -1.595  -4.786
  772    HD3  ARG 103           HD1      ARG 103 -12.631  -1.782  -3.872
  773   HH11  ARG 103          HH11      ARG 103 -12.668   0.054  -5.166
  774   HH12  ARG 103          HH12      ARG 103 -12.776   1.771  -4.968
  775   HH21  ARG 103          HH21      ARG 103 -10.905   1.842  -2.015
  776   HH22  ARG 103          HH22      ARG 103 -11.774   2.787  -3.179
  777    H    LEU 104           HN       LEU 104 -12.078  -7.356  -2.622
  778    HA   LEU 104           HA       LEU 104 -11.144  -8.943  -4.889
  779    HG   LEU 104           HG       LEU 104 -10.696  -9.234  -1.771
  780    HB2  LEU 104           HB2      LEU 104 -12.973  -9.733  -2.620
  781    HB3  LEU 104           HB1      LEU 104 -12.270 -10.814  -3.808
  782   HD11  LEU 104          HD11      LEU 104 -10.338 -11.394  -0.680
  783   HD12  LEU 104          HD12      LEU 104 -11.429 -12.157  -1.837
  784   HD13  LEU 104          HD13      LEU 104 -12.046 -10.953  -0.707
  785   HD21  LEU 104          HD23      LEU 104  -9.428  -9.671  -3.800
  786   HD22  LEU 104          HD21      LEU 104  -9.855 -11.380  -3.718
  787   HD23  LEU 104          HD22      LEU 104  -8.831 -10.666  -2.472
  788    HA   PRO 105           HA       PRO 105 -14.912  -8.117  -7.103
  789    HB2  PRO 105           HB2      PRO 105 -14.657  -9.873  -9.103
  790    HB3  PRO 105           HB1      PRO 105 -13.564  -8.492  -8.949
  791    HG2  PRO 105           HG2      PRO 105 -13.118 -11.355  -8.216
  792    HG3  PRO 105           HG1      PRO 105 -12.005 -10.206  -8.979
  793    HD2  PRO 105           HD2      PRO 105 -12.004 -10.854  -6.291
  794    HD3  PRO 105           HD1      PRO 105 -11.322  -9.365  -6.973
  795    H    LEU 106           HN       LEU 106 -16.894  -9.179  -7.860
  796    HA   LEU 106           HA       LEU 106 -17.444 -11.760  -6.572
  797    HG   LEU 106           HG       LEU 106 -17.367  -9.258  -4.756
  798    HB2  LEU 106           HB2      LEU 106 -19.210  -9.315  -6.425
  799    HB3  LEU 106           HB1      LEU 106 -19.648 -10.911  -5.848
  800   HD11  LEU 106          HD11      LEU 106 -20.111  -9.776  -3.620
  801   HD12  LEU 106          HD12      LEU 106 -19.529  -8.240  -4.262
  802   HD13  LEU 106          HD13      LEU 106 -18.800  -8.924  -2.808
  803   HD21  LEU 106          HD23      LEU 106 -18.607 -11.836  -3.802
  804   HD22  LEU 106          HD21      LEU 106 -17.364 -10.918  -2.953
  805   HD23  LEU 106          HD22      LEU 106 -17.006 -11.653  -4.516
  806    H    LEU 107           HN       LEU 107 -19.208 -12.938  -7.490
  807    HA   LEU 107           HA       LEU 107 -19.627 -12.281 -10.313
  808    HG   LEU 107           HG       LEU 107 -18.382 -15.755 -10.529
  809    HB2  LEU 107           HB2      LEU 107 -19.700 -14.819  -8.733
  810    HB3  LEU 107           HB1      LEU 107 -20.590 -14.720 -10.240
  811   HD11  LEU 107          HD11      LEU 107 -18.545 -13.065 -11.874
  812   HD12  LEU 107          HD12      LEU 107 -19.481 -14.483 -12.346
  813   HD13  LEU 107          HD13      LEU 107 -17.721 -14.508 -12.469
  814   HD21  LEU 107          HD23      LEU 107 -17.304 -13.061  -9.700
  815   HD22  LEU 107          HD21      LEU 107 -16.355 -14.406 -10.331
  816   HD23  LEU 107          HD22      LEU 107 -17.174 -14.557  -8.777
  817    H    GLU 108           HN       GLU 108 -21.611 -11.964 -11.190
  818    HA   GLU 108           HA       GLU 108 -23.985 -12.393  -9.539
  819    HB2  GLU 108           HB2      GLU 108 -23.265 -10.064  -9.135
  820    HB3  GLU 108           HB1      GLU 108 -23.345  -9.750 -10.863
  821    HG2  GLU 108           HG2      GLU 108 -25.739 -10.175 -10.844
  822    HG3  GLU 108           HG1      GLU 108 -25.671 -10.530  -9.119
  Start of MODEL   14
    1    H1   GLY   1           HT1      GLY   1 -12.232  -9.646  11.846
    2    H2   GLY   1           HT2      GLY   1 -13.356  -9.386  13.083
    3    H3   GLY   1           HT3      GLY   1 -13.887  -9.623  11.495
    4    HA2  GLY   1           HA1      GLY   1 -14.251 -11.623  12.759
    5    HA3  GLY   1           HA2      GLY   1 -13.033 -11.888  11.519
    6    H    SER   2           HN       SER   2 -10.882 -12.197  12.109
    7    HA   SER   2           HA       SER   2 -10.535 -13.113  14.853
    8    HG   SER   2           HG       SER   2 -10.174 -15.442  13.726
    9    HB2  SER   2           HB2      SER   2  -8.735 -13.390  12.435
   10    HB3  SER   2           HB1      SER   2  -8.442 -14.125  14.011
   11    H    HIS   3           HN       HIS   3  -8.721 -11.101  12.533
   12    HA   HIS   3           HA       HIS   3  -7.295  -9.863  14.766
   13    HD1  HIS   3           HD1      HIS   3  -4.456  -9.363  14.699
   14    HD2  HIS   3           HD2      HIS   3  -5.892  -7.090  11.530
   15    HE1  HIS   3           HE1      HIS   3  -3.066  -7.268  14.690
   16    HE2  HIS   3           HE2      HIS   3  -3.948  -5.908  12.760
   17    HB2  HIS   3           HB2      HIS   3  -5.947 -10.665  12.885
   18    HB3  HIS   3           HB1      HIS   3  -6.854  -9.638  11.781
   19    H    GLY   4           HN       GLY   4  -8.739  -8.672  11.721
   20    HA2  GLY   4           HA2      GLY   4 -10.021  -6.516  13.243
   21    HA3  GLY   4           HA1      GLY   4  -8.929  -6.076  11.938
   22    H    TYR   5           HN       TYR   5  -9.620  -6.176   9.851
   23    HA   TYR   5           HA       TYR   5 -12.478  -6.642   9.483
   24    HD1  TYR   5           HD1      TYR   5 -14.059  -4.824   8.238
   25    HD2  TYR   5           HD2      TYR   5 -10.229  -3.243   9.205
   26    HE1  TYR   5           HE1      TYR   5 -15.130  -2.811   9.156
   27    HE2  TYR   5           HE2      TYR   5 -11.291  -1.224  10.129
   28    HH   TYR   5           HH       TYR   5 -14.627  -1.023  10.750
   29    HB2  TYR   5           HB2      TYR   5 -10.379  -5.188   7.903
   30    HB3  TYR   5           HB1      TYR   5 -11.904  -5.646   7.151
   31    H    SER   6           HN       SER   6 -13.237  -8.430   8.598
   32    HA   SER   6           HA       SER   6 -11.378 -10.183   7.144
   33    HG   SER   6           HG       SER   6 -13.633 -12.643   7.258
   34    HB2  SER   6           HB2      SER   6 -12.488 -11.090   9.202
   35    HB3  SER   6           HB1      SER   6 -14.040 -10.915   8.387
   36    H    ASP   7           HN       ASP   7 -13.123 -11.786   5.781
   37    HA   ASP   7           HA       ASP   7 -13.624 -10.392   3.441
   38    HB2  ASP   7           HB2      ASP   7 -14.944 -12.923   4.441
   39    HB3  ASP   7           HB1      ASP   7 -15.021 -12.339   2.781
   40    H    ALA   8           HN       ALA   8 -14.853  -8.606   3.417
   41    HA   ALA   8           HA       ALA   8 -17.691  -8.908   4.024
   42    HB1  ALA   8           HB3      ALA   8 -17.781  -6.845   5.319
   43    HB2  ALA   8           HB1      ALA   8 -16.033  -6.668   5.179
   44    HB3  ALA   8           HB2      ALA   8 -16.713  -8.020   6.086
   45    H    SER   9           HN       SER   9 -18.636  -8.403   2.168
   46    HA   SER   9           HA       SER   9 -19.179  -7.364   0.221
   47    HG   SER   9           HG       SER   9 -19.921  -4.716   2.506
   48    HB2  SER   9           HB2      SER   9 -17.987  -4.973   1.643
   49    HB3  SER   9           HB1      SER   9 -18.977  -4.895   0.187
   50    H    GLY  10           HN       GLY  10 -16.357  -8.433   0.712
   51    HA2  GLY  10           HA2      GLY  10 -14.886  -8.858  -1.151
   52    HA3  GLY  10           HA1      GLY  10 -15.201  -7.224  -1.713
   53    H    PHE  11           HN       PHE  11 -14.788  -5.759   0.583
   54    HA   PHE  11           HA       PHE  11 -12.069  -5.306   0.579
   55    HD1  PHE  11           HD1      PHE  11 -15.417  -3.953   0.537
   56    HD2  PHE  11           HD2      PHE  11 -11.758  -2.205   1.830
   57    HE1  PHE  11           HE1      PHE  11 -15.885  -1.964  -0.834
   58    HE2  PHE  11           HE2      PHE  11 -12.221  -0.213   0.461
   59    HZ   PHE  11           HZ       PHE  11 -14.287  -0.091  -0.873
   60    HB2  PHE  11           HB2      PHE  11 -14.176  -4.686   2.641
   61    HB3  PHE  11           HB1      PHE  11 -12.506  -4.165   2.833
   62    H    SER  12           HN       SER  12 -10.512  -6.674   1.073
   63    HA   SER  12           HA       SER  12 -10.697  -8.169   3.599
   64    HG   SER  12           HG       SER  12  -8.455  -9.952   2.803
   65    HB2  SER  12           HB2      SER  12 -11.101  -9.753   1.793
   66    HB3  SER  12           HB1      SER  12  -9.649  -9.208   0.954
   67    H    LEU  13           HN       LEU  13  -8.841  -8.287   4.803
   68    HA   LEU  13           HA       LEU  13  -6.797  -6.356   4.187
   69    HG   LEU  13           HG       LEU  13  -8.816  -6.514   6.485
   70    HB2  LEU  13           HB2      LEU  13  -7.068  -8.287   6.491
   71    HB3  LEU  13           HB1      LEU  13  -5.846  -7.035   6.371
   72   HD11  LEU  13          HD11      LEU  13  -6.710  -6.264   8.629
   73   HD12  LEU  13          HD12      LEU  13  -8.006  -7.459   8.582
   74   HD13  LEU  13          HD13      LEU  13  -8.391  -5.748   8.768
   75   HD21  LEU  13          HD23      LEU  13  -7.672  -4.759   5.321
   76   HD22  LEU  13          HD21      LEU  13  -6.411  -4.702   6.553
   77   HD23  LEU  13          HD22      LEU  13  -8.052  -4.190   6.948
   78    H    TYR  14           HN       TYR  14  -5.034  -6.747   3.051
   79    HA   TYR  14           HA       TYR  14  -4.016  -9.508   2.917
   80    HD1  TYR  14           HD2      TYR  14  -3.959 -10.923   0.305
   81    HD2  TYR  14           HD1      TYR  14  -6.372  -7.420   0.474
   82    HE1  TYR  14           HE2      TYR  14  -5.801 -12.146  -0.771
   83    HE2  TYR  14           HE1      TYR  14  -8.218  -8.635  -0.602
   84    HH   TYR  14           HH       TYR  14  -8.239 -12.015  -0.955
   85    HB2  TYR  14           HB2      TYR  14  -3.985  -7.298   0.862
   86    HB3  TYR  14           HB1      TYR  14  -2.969  -8.728   0.728
   87    H    SER  15           HN       SER  15  -1.680  -9.750   2.736
   88    HA   SER  15           HA       SER  15  -0.065  -7.461   3.516
   89    HG   SER  15           HG       SER  15   1.333  -7.595   5.524
   90    HB2  SER  15           HB2      SER  15  -0.829  -8.362   5.669
   91    HB3  SER  15           HB1      SER  15  -0.216  -9.956   5.226
   92    H    VAL  16           HN       VAL  16   1.904  -7.528   2.636
   93    HA   VAL  16           HA       VAL  16   2.879 -10.105   1.592
   94    HB   VAL  16           HB       VAL  16   3.236  -7.417   0.258
   95   HG11  VAL  16          HG11      VAL  16   5.089  -8.937  -0.145
   96   HG12  VAL  16          HG12      VAL  16   4.127  -8.738  -1.610
   97   HG13  VAL  16          HG13      VAL  16   3.966 -10.202  -0.643
   98   HG21  VAL  16          HG23      VAL  16   1.440  -9.721  -0.499
   99   HG22  VAL  16          HG21      VAL  16   1.711  -8.269  -1.463
  100   HG23  VAL  16          HG22      VAL  16   0.918  -8.149   0.108
  101    H    GLU  17           HN       GLU  17   4.885 -10.647   2.181
  102    HA   GLU  17           HA       GLU  17   6.428  -8.718   3.740
  103    HB2  GLU  17           HB2      GLU  17   6.818 -11.693   3.372
  104    HB3  GLU  17           HB1      GLU  17   7.748 -10.668   4.455
  105    HG2  GLU  17           HG2      GLU  17   5.745 -10.185   5.745
  106    HG3  GLU  17           HG1      GLU  17   4.788 -11.177   4.646
  107    H    LEU  18           HN       LEU  18   7.788  -7.502   2.604
  108    HA   LEU  18           HA       LEU  18   9.341  -8.784   0.454
  109    HG   LEU  18           HG       LEU  18   6.701  -7.171  -0.293
  110    HB2  LEU  18           HB2      LEU  18   8.452  -5.925   0.749
  111    HB3  LEU  18           HB1      LEU  18   9.625  -6.457  -0.439
  112   HD11  LEU  18          HD11      LEU  18   6.650  -6.186  -2.513
  113   HD12  LEU  18          HD12      LEU  18   8.382  -5.867  -2.420
  114   HD13  LEU  18          HD13      LEU  18   7.272  -5.036  -1.329
  115   HD21  LEU  18          HD23      LEU  18   7.907  -9.207  -0.836
  116   HD22  LEU  18          HD21      LEU  18   8.833  -8.355  -2.073
  117   HD23  LEU  18          HD22      LEU  18   7.096  -8.584  -2.274
  118    H    PHE  19           HN       PHE  19  11.505  -7.742   0.086
  119    HA   PHE  19           HA       PHE  19  12.700  -6.522   2.433
  120    HD1  PHE  19           HD2      PHE  19  11.788 -10.292   1.176
  121    HD2  PHE  19           HD1      PHE  19  15.833  -9.012   0.854
  122    HE1  PHE  19           HE2      PHE  19  12.192 -12.019  -0.528
  123    HE2  PHE  19           HE1      PHE  19  16.246 -10.737  -0.852
  124    HZ   PHE  19           HZ       PHE  19  14.442 -12.254  -1.531
  125    HB2  PHE  19           HB2      PHE  19  14.478  -8.215   2.610
  126    HB3  PHE  19           HB1      PHE  19  12.892  -8.907   2.932
  127    H    ARG  20           HN       ARG  20  14.298  -5.131   1.915
  128    HA   ARG  20           HA       ARG  20  15.200  -5.173  -0.890
  129    HE   ARG  20           HE       ARG  20  14.015  -2.590  -2.445
  130    HB2  ARG  20           HB2      ARG  20  13.990  -3.150  -0.374
  131    HB3  ARG  20           HB1      ARG  20  14.977  -2.872   1.053
  132    HG2  ARG  20           HG2      ARG  20  15.594  -1.416  -0.823
  133    HG3  ARG  20           HG1      ARG  20  16.922  -2.462  -0.317
  134    HD2  ARG  20           HD2      ARG  20  16.728  -2.318  -2.763
  135    HD3  ARG  20           HD1      ARG  20  16.492  -3.960  -2.169
  136   HH11  ARG  20          HH11      ARG  20  16.506  -4.222  -4.254
  137   HH12  ARG  20          HH12      ARG  20  15.447  -4.686  -5.543
  138   HH21  ARG  20          HH21      ARG  20  12.613  -3.198  -4.140
  139   HH22  ARG  20          HH22      ARG  20  13.234  -4.102  -5.479
  140    H    GLU  21           HN       GLU  21  17.222  -5.713  -1.268
  141    HA   GLU  21           HA       GLU  21  19.212  -5.347   0.873
  142    HB2  GLU  21           HB2      GLU  21  18.596  -7.733   0.471
  143    HB3  GLU  21           HB1      GLU  21  19.164  -7.561  -1.183
  144    HG2  GLU  21           HG2      GLU  21  20.861  -8.630   0.114
  145    HG3  GLU  21           HG1      GLU  21  21.409  -7.011  -0.315
  146    H    LYS  22           HN       LYS  22  18.391  -5.006  -2.456
  147    HA   LYS  22           HA       LYS  22  21.008  -4.458  -3.445
  148    HB2  LYS  22           HB2      LYS  22  18.270  -3.804  -4.548
  149    HB3  LYS  22           HB1      LYS  22  19.772  -3.521  -5.416
  150    HG2  LYS  22           HG2      LYS  22  18.870  -6.224  -4.446
  151    HG3  LYS  22           HG1      LYS  22  18.580  -5.600  -6.071
  152    HD2  LYS  22           HD2      LYS  22  21.023  -5.357  -6.375
  153    HD3  LYS  22           HD1      LYS  22  21.267  -6.078  -4.781
  154    HE2  LYS  22           HE2      LYS  22  21.558  -7.730  -6.559
  155    HE3  LYS  22           HE1      LYS  22  20.183  -8.129  -5.530
  156    HZ1  LYS  22           HZ3      LYS  22  20.044  -6.833  -8.200
  157    HZ2  LYS  22           HZ1      LYS  22  18.715  -7.169  -7.207
  158    HZ3  LYS  22           HZ2      LYS  22  19.633  -8.436  -7.848
  159    H    ASP  23           HN       ASP  23  21.465  -2.280  -4.519
  160    HA   ASP  23           HA       ASP  23  21.039  -0.209  -2.503
  161    HB2  ASP  23           HB2      ASP  23  23.354  -0.777  -3.288
  162    HB3  ASP  23           HB1      ASP  23  22.910  -0.159  -4.877
  163    H    THR  24           HN       THR  24  18.738  -0.565  -3.775
  164    HA   THR  24           HA       THR  24  18.598   1.449  -5.909
  165    HB   THR  24           HB       THR  24  16.362   0.567  -6.397
  166    HG1  THR  24           HG1      THR  24  16.562  -0.448  -3.956
  167   HG21  THR  24          HG23      THR  24  18.270  -0.449  -7.529
  168   HG22  THR  24          HG21      THR  24  17.025  -1.656  -7.210
  169   HG23  THR  24          HG22      THR  24  18.468  -1.591  -6.199
  170    H    SER  25           HN       SER  25  17.695   0.807  -2.643
  171    HA   SER  25           HA       SER  25  16.625   2.014  -1.043
  172    HG   SER  25           HG       SER  25  17.294   5.214  -0.537
  173    HB2  SER  25           HB2      SER  25  18.282   3.724  -1.683
  174    HB3  SER  25           HB1      SER  25  17.171   4.337  -2.908
  175    H    SER  26           HN       SER  26  15.135   0.973  -3.477
  176    HA   SER  26           HA       SER  26  12.621   2.316  -2.850
  177    HG   SER  26           HG       SER  26  14.192   2.468  -6.532
  178    HB2  SER  26           HB2      SER  26  12.014   2.501  -5.242
  179    HB3  SER  26           HB1      SER  26  13.417   3.491  -4.839
  180    H    LEU  27           HN       LEU  27  10.749   1.082  -3.351
  181    HA   LEU  27           HA       LEU  27  11.310  -1.785  -3.727
  182    HG   LEU  27           HG       LEU  27  11.402  -0.808  -0.993
  183    HB2  LEU  27           HB2      LEU  27   9.181  -0.395  -2.110
  184    HB3  LEU  27           HB1      LEU  27   9.124  -2.106  -2.486
  185   HD11  LEU  27          HD11      LEU  27   9.008  -2.283   0.094
  186   HD12  LEU  27          HD12      LEU  27   9.354  -0.566   0.296
  187   HD13  LEU  27          HD13      LEU  27  10.414  -1.771   1.028
  188   HD21  LEU  27          HD23      LEU  27  11.904  -3.128  -0.351
  189   HD22  LEU  27          HD21      LEU  27  11.992  -2.885  -2.096
  190   HD23  LEU  27          HD22      LEU  27  10.589  -3.685  -1.387
  191    H    GLY  28           HN       GLY  28   9.934   0.908  -5.142
  192    HA2  GLY  28           HA2      GLY  28   9.045   0.847  -7.342
  193    HA3  GLY  28           HA1      GLY  28   8.494  -0.794  -7.047
  194    H    ILE  29           HN       ILE  29   7.565   0.502  -4.322
  195    HA   ILE  29           HA       ILE  29   4.839   0.673  -5.005
  196    HB   ILE  29           HB       ILE  29   6.210   1.748  -2.535
  197   HG12  ILE  29          HG12      ILE  29   4.848  -0.923  -2.934
  198   HG13  ILE  29          HG11      ILE  29   6.592  -0.689  -3.028
  199   HG21  ILE  29          HG21      ILE  29   3.979   2.664  -2.806
  200   HG22  ILE  29          HG22      ILE  29   4.004   1.503  -1.479
  201   HG23  ILE  29          HG23      ILE  29   3.320   1.044  -3.039
  202   HD11  ILE  29          HD13      ILE  29   6.636   0.030  -0.712
  203   HD12  ILE  29          HD11      ILE  29   5.898  -1.565  -0.860
  204   HD13  ILE  29          HD12      ILE  29   4.884  -0.144  -0.611
  205    H    SER  30           HN       SER  30   4.042   2.215  -6.297
  206    HA   SER  30           HA       SER  30   4.912   4.995  -5.849
  207    HG   SER  30           HG       SER  30   4.820   5.989  -8.966
  208    HB2  SER  30           HB2      SER  30   5.406   4.147  -8.112
  209    HB3  SER  30           HB1      SER  30   3.697   3.777  -8.341
  210    H    ILE  31           HN       ILE  31   3.492   6.134  -4.712
  211    HA   ILE  31           HA       ILE  31   0.665   5.386  -4.769
  212    HB   ILE  31           HB       ILE  31   0.415   6.884  -2.836
  213   HG12  ILE  31          HG12      ILE  31   3.415   7.246  -3.011
  214   HG13  ILE  31          HG11      ILE  31   2.244   8.462  -3.508
  215   HG21  ILE  31          HG21      ILE  31   1.703   5.543  -1.242
  216   HG22  ILE  31          HG22      ILE  31   2.679   4.909  -2.567
  217   HG23  ILE  31          HG23      ILE  31   0.958   4.536  -2.483
  218   HD11  ILE  31          HD13      ILE  31   3.116   8.944  -1.302
  219   HD12  ILE  31          HD11      ILE  31   2.585   7.363  -0.728
  220   HD13  ILE  31          HD12      ILE  31   1.395   8.569  -1.219
  221    H    SER  32           HN       SER  32  -0.753   7.522  -4.326
  222    HA   SER  32           HA       SER  32  -0.001   9.821  -5.854
  223    HG   SER  32           HG       SER  32  -2.062   7.055  -6.373
  224    HB2  SER  32           HB2      SER  32  -1.757   9.587  -7.590
  225    HB3  SER  32           HB1      SER  32  -0.522   8.333  -7.717
  226    H    GLY  33           HN       GLY  33  -1.208  11.567  -5.300
  227    HA2  GLY  33           HA2      GLY  33  -3.209  11.159  -3.224
  228    HA3  GLY  33           HA1      GLY  33  -2.493  12.693  -3.697
  229    H    MET  34           HN       MET  34  -5.306  11.053  -3.627
  230    HA   MET  34           HA       MET  34  -6.391  11.631  -6.199
  231    HB2  MET  34           HB2      MET  34  -7.296   9.866  -4.737
  232    HB3  MET  34           HB1      MET  34  -7.811  11.088  -3.584
  233    HG2  MET  34           HG2      MET  34  -9.365  12.001  -5.186
  234    HG3  MET  34           HG1      MET  34  -8.795  10.879  -6.420
  235    HE1  MET  34           HE3      MET  34 -10.712  11.282  -3.031
  236    HE2  MET  34           HE1      MET  34  -9.427  10.156  -2.589
  237    HE3  MET  34           HE2      MET  34 -11.103   9.609  -2.629
  238    H    ARG  35           HN       ARG  35  -7.830  13.257  -6.813
  239    HA   ARG  35           HA       ARG  35  -8.348  15.445  -4.970
  240    HE   ARG  35           HE       ARG  35  -5.726  14.994 -10.186
  241    HB2  ARG  35           HB2      ARG  35  -7.457  17.151  -6.490
  242    HB3  ARG  35           HB1      ARG  35  -6.194  16.060  -5.940
  243    HG2  ARG  35           HG2      ARG  35  -7.576  15.604  -8.555
  244    HG3  ARG  35           HG1      ARG  35  -6.250  16.761  -8.414
  245    HD2  ARG  35           HD2      ARG  35  -4.818  14.977  -7.512
  246    HD3  ARG  35           HD1      ARG  35  -6.139  13.829  -7.709
  247   HH11  ARG  35          HH11      ARG  35  -3.920  13.048  -7.930
  248   HH12  ARG  35          HH12      ARG  35  -2.970  12.276  -9.155
  249   HH21  ARG  35          HH21      ARG  35  -4.478  13.986 -11.808
  250   HH22  ARG  35          HH22      ARG  35  -3.286  12.811 -11.359
  251    H    ASP  36           HN       ASP  36 -10.186  16.567  -5.429
  252    HA   ASP  36           HA       ASP  36 -11.704  15.656  -7.782
  253    HB2  ASP  36           HB2      ASP  36 -12.738  16.706  -5.139
  254    HB3  ASP  36           HB1      ASP  36 -13.735  16.182  -6.495
  255    H    GLN  37           HN       GLN  37 -13.444  17.311  -8.429
  256    HA   GLN  37           HA       GLN  37 -12.073  19.817  -8.949
  257    HB2  GLN  37           HB2      GLN  37 -13.843  20.245 -10.560
  258    HB3  GLN  37           HB1      GLN  37 -13.192  18.629 -10.794
  259    HG2  GLN  37           HG2      GLN  37 -15.680  19.148  -9.199
  260    HG3  GLN  37           HG1      GLN  37 -15.700  18.888 -10.943
  261   HE21  GLN  37          HE21      GLN  37 -16.861  17.308  -8.763
  262   HE22  GLN  37          HE22      GLN  37 -16.208  15.719  -8.934
  263    H    SER  38           HN       SER  38 -13.110  19.205  -6.261
  264    HA   SER  38           HA       SER  38 -14.461  21.722  -5.819
  265    HG   SER  38           HG       SER  38 -16.867  19.375  -6.799
  266    HB2  SER  38           HB2      SER  38 -15.785  19.112  -5.033
  267    HB3  SER  38           HB1      SER  38 -16.341  20.720  -4.567
  268    H    THR  39           HN       THR  39 -12.368  22.015  -4.796
  269    HA   THR  39           HA       THR  39 -11.427  20.468  -2.656
  270    HB   THR  39           HB       THR  39 -10.060  22.421  -2.043
  271    HG1  THR  39           HG1      THR  39 -12.015  23.815  -3.007
  272   HG21  THR  39          HG23      THR  39 -10.234  21.976  -5.026
  273   HG22  THR  39          HG21      THR  39  -9.325  20.985  -3.884
  274   HG23  THR  39          HG22      THR  39  -8.858  22.663  -4.163
  275    H    THR  40           HN       THR  40 -11.872  20.408  -0.532
  276    HA   THR  40           HA       THR  40 -13.141  22.509   0.899
  277    HB   THR  40           HB       THR  40 -15.130  21.733  -0.297
  278    HG1  THR  40           HG1      THR  40 -15.439  20.736   2.323
  279   HG21  THR  40          HG23      THR  40 -14.574  19.064   1.004
  280   HG22  THR  40          HG21      THR  40 -14.441  19.423  -0.717
  281   HG23  THR  40          HG22      THR  40 -16.016  19.479   0.076
  282    H    GLY  41           HN       GLY  41 -11.036  20.223   0.845
  283    HA2  GLY  41           HA2      GLY  41  -9.817  19.277   2.574
  284    HA3  GLY  41           HA1      GLY  41 -11.050  19.824   3.700
  285    H    GLU  42           HN       GLU  42 -10.017  17.406   4.157
  286    HA   GLU  42           HA       GLU  42 -10.524  15.218   4.503
  287    HB2  GLU  42           HB2      GLU  42 -13.303  16.188   3.819
  288    HB3  GLU  42           HB1      GLU  42 -12.938  14.616   4.515
  289    HG2  GLU  42           HG2      GLU  42 -12.012  15.702   6.492
  290    HG3  GLU  42           HG1      GLU  42 -12.372  17.281   5.794
  291    H    ALA  43           HN       ALA  43 -11.921  13.302   3.397
  292    HA   ALA  43           HA       ALA  43 -12.008  11.863   1.640
  293    HB1  ALA  43           HB3      ALA  43 -12.728  12.762  -0.518
  294    HB2  ALA  43           HB1      ALA  43 -12.382  14.397   0.046
  295    HB3  ALA  43           HB2      ALA  43 -13.662  13.453   0.810
  296    H    THR  44           HN       THR  44  -9.493  12.251   2.470
  297    HA   THR  44           HA       THR  44  -7.970  12.080  -0.025
  298    HB   THR  44           HB       THR  44  -6.091  13.360   0.995
  299    HG1  THR  44           HG1      THR  44  -8.026  14.212   2.903
  300   HG21  THR  44          HG23      THR  44  -7.085  15.590   0.665
  301   HG22  THR  44          HG21      THR  44  -8.693  14.866   0.711
  302   HG23  THR  44          HG22      THR  44  -7.578  14.455  -0.593
  303    H    GLY  45           HN       GLY  45  -6.724  10.321  -0.061
  304    HA2  GLY  45           HA2      GLY  45  -5.575   9.294   2.419
  305    HA3  GLY  45           HA1      GLY  45  -6.684   8.231   1.567
  306    H    ILE  46           HN       ILE  46  -4.015   7.577   2.083
  307    HA   ILE  46           HA       ILE  46  -2.556   7.978  -0.407
  308    HB   ILE  46           HB       ILE  46  -1.735   6.393   2.031
  309   HG12  ILE  46          HG12      ILE  46  -2.126   8.747   2.609
  310   HG13  ILE  46          HG11      ILE  46  -0.410   8.360   2.665
  311   HG21  ILE  46          HG21      ILE  46  -0.517   5.771   0.026
  312   HG22  ILE  46          HG22      ILE  46   0.534   6.653   1.135
  313   HG23  ILE  46          HG23      ILE  46  -0.127   7.462  -0.285
  314   HD11  ILE  46          HD13      ILE  46  -0.111   9.412   0.478
  315   HD12  ILE  46          HD11      ILE  46  -0.781  10.532   1.664
  316   HD13  ILE  46          HD12      ILE  46  -1.828   9.811   0.442
  317    H    TYR  47           HN       TYR  47  -2.393   6.504  -1.996
  318    HA   TYR  47           HA       TYR  47  -2.916   3.700  -1.496
  319    HD1  TYR  47           HD1      TYR  47  -5.369   6.958  -2.016
  320    HD2  TYR  47           HD2      TYR  47  -4.461   4.547  -5.403
  321    HE1  TYR  47           HE1      TYR  47  -5.958   8.829  -3.499
  322    HE2  TYR  47           HE2      TYR  47  -5.043   6.412  -6.893
  323    HH   TYR  47           HH       TYR  47  -6.391   8.451  -6.853
  324    HB2  TYR  47           HB2      TYR  47  -4.679   3.552  -3.234
  325    HB3  TYR  47           HB1      TYR  47  -5.177   4.502  -1.838
  326    H    VAL  48           HN       VAL  48  -2.065   2.341  -3.044
  327    HA   VAL  48           HA       VAL  48  -0.072   3.498  -4.770
  328    HB   VAL  48           HB       VAL  48  -0.897   0.609  -4.432
  329   HG11  VAL  48          HG11      VAL  48   1.536   1.817  -5.745
  330   HG12  VAL  48          HG12      VAL  48   0.221   0.967  -6.555
  331   HG13  VAL  48          HG13      VAL  48   1.283   0.097  -5.448
  332   HG21  VAL  48          HG23      VAL  48   1.387   2.147  -3.198
  333   HG22  VAL  48          HG21      VAL  48   1.086   0.419  -3.014
  334   HG23  VAL  48          HG22      VAL  48  -0.062   1.588  -2.360
  335    H    LYS  49           HN       LYS  49  -0.166   3.793  -6.917
  336    HA   LYS  49           HA       LYS  49  -2.491   2.715  -8.367
  337    HB2  LYS  49           HB2      LYS  49  -2.787   5.118  -7.938
  338    HB3  LYS  49           HB1      LYS  49  -1.244   5.448  -8.710
  339    HG2  LYS  49           HG2      LYS  49  -2.128   4.571 -10.826
  340    HG3  LYS  49           HG1      LYS  49  -3.686   4.295 -10.043
  341    HD2  LYS  49           HD2      LYS  49  -2.341   6.988 -10.221
  342    HD3  LYS  49           HD1      LYS  49  -3.547   6.411 -11.372
  343    HE2  LYS  49           HE2      LYS  49  -5.171   6.186  -9.555
  344    HE3  LYS  49           HE1      LYS  49  -3.964   6.759  -8.404
  345    HZ1  LYS  49           HZ3      LYS  49  -3.880   8.859  -9.642
  346    HZ2  LYS  49           HZ1      LYS  49  -5.425   8.549  -9.025
  347    HZ3  LYS  49           HZ2      LYS  49  -5.106   8.306 -10.668
  348    H    SER  50           HN       SER  50   0.907   3.427  -8.332
  349    HA   SER  50           HA       SER  50   1.174   2.033 -10.908
  350    HG   SER  50           HG       SER  50   1.746   5.481 -11.668
  351    HB2  SER  50           HB2      SER  50   2.771   4.442 -10.007
  352    HB3  SER  50           HB1      SER  50   3.080   3.506 -11.469
  353    H    LEU  51           HN       LEU  51   3.314   1.065 -11.246
  354    HA   LEU  51           HA       LEU  51   4.812   0.484  -8.802
  355    HG   LEU  51           HG       LEU  51   2.056  -0.791  -8.919
  356    HB2  LEU  51           HB2      LEU  51   3.675  -1.625 -10.641
  357    HB3  LEU  51           HB1      LEU  51   4.816  -1.934  -9.347
  358   HD11  LEU  51          HD11      LEU  51   1.884  -3.039  -9.815
  359   HD12  LEU  51          HD12      LEU  51   1.461  -3.025  -8.103
  360   HD13  LEU  51          HD13      LEU  51   3.039  -3.624  -8.618
  361   HD21  LEU  51          HD23      LEU  51   4.102  -1.915  -7.010
  362   HD22  LEU  51          HD21      LEU  51   2.470  -1.401  -6.579
  363   HD23  LEU  51          HD22      LEU  51   3.643  -0.221  -7.166
  364    H    ILE  52           HN       ILE  52   6.943   0.521  -9.147
  365    HA   ILE  52           HA       ILE  52   8.000   1.135 -11.701
  366    HB   ILE  52           HB       ILE  52   9.406   0.322  -9.159
  367   HG12  ILE  52          HG12      ILE  52   8.890   3.017 -10.437
  368   HG13  ILE  52          HG11      ILE  52   8.117   2.395  -8.984
  369   HG21  ILE  52          HG21      ILE  52  11.428   1.269 -10.196
  370   HG22  ILE  52          HG22      ILE  52  10.538   1.486 -11.704
  371   HG23  ILE  52          HG23      ILE  52  10.827  -0.137 -11.075
  372   HD11  ILE  52          HD13      ILE  52  11.041   3.018  -9.297
  373   HD12  ILE  52          HD11      ILE  52  10.267   2.399  -7.839
  374   HD13  ILE  52          HD12      ILE  52   9.849   4.002  -8.447
  375    HA   PRO  53           HA       PRO  53   8.249  -3.152 -13.064
  376    HB2  PRO  53           HB2      PRO  53   9.294  -2.652 -15.517
  377    HB3  PRO  53           HB1      PRO  53   7.584  -2.415 -15.138
  378    HG2  PRO  53           HG2      PRO  53   9.791  -0.396 -15.267
  379    HG3  PRO  53           HG1      PRO  53   8.135  -0.285 -15.892
  380    HD2  PRO  53           HD2      PRO  53   8.893   0.867 -13.562
  381    HD3  PRO  53           HD1      PRO  53   7.256   0.236 -13.826
  382    H    GLY  54           HN       GLY  54   9.856  -3.904 -11.676
  383    HA2  GLY  54           HA2      GLY  54  12.084  -5.015 -12.340
  384    HA3  GLY  54           HA1      GLY  54  12.642  -3.353 -12.449
  385    H    SER  55           HN       SER  55  10.417  -3.391 -10.037
  386    HA   SER  55           HA       SER  55  12.515  -3.627  -8.004
  387    HG   SER  55           HG       SER  55  11.251  -1.088  -9.078
  388    HB2  SER  55           HB2      SER  55   9.798  -2.300  -7.873
  389    HB3  SER  55           HB1      SER  55  10.967  -2.345  -6.553
  390    H    ALA  56           HN       ALA  56  11.594  -4.345  -5.780
  391    HA   ALA  56           HA       ALA  56  10.898  -7.044  -5.970
  392    HB1  ALA  56           HB3      ALA  56  12.056  -6.075  -4.045
  393    HB2  ALA  56           HB1      ALA  56  10.626  -6.985  -3.555
  394    HB3  ALA  56           HB2      ALA  56  10.582  -5.222  -3.591
  395    H    ALA  57           HN       ALA  57   8.875  -4.294  -4.937
  396    HA   ALA  57           HA       ALA  57   6.520  -5.562  -4.385
  397    HB1  ALA  57           HB3      ALA  57   6.769  -2.934  -5.837
  398    HB2  ALA  57           HB1      ALA  57   6.918  -3.155  -4.094
  399    HB3  ALA  57           HB2      ALA  57   5.384  -3.490  -4.897
  400    H    ALA  58           HN       ALA  58   7.730  -4.665  -7.594
  401    HA   ALA  58           HA       ALA  58   5.343  -5.574  -8.927
  402    HB1  ALA  58           HB3      ALA  58   8.015  -4.824 -10.103
  403    HB2  ALA  58           HB1      ALA  58   6.678  -3.712  -9.809
  404    HB3  ALA  58           HB2      ALA  58   6.497  -5.017 -10.981
  405    H    LEU  59           HN       LEU  59   8.603  -6.830  -8.398
  406    HA   LEU  59           HA       LEU  59   8.553  -8.985 -10.153
  407    HG   LEU  59           HG       LEU  59  10.782  -7.289  -9.501
  408    HB2  LEU  59           HB2      LEU  59   9.939  -8.565  -7.522
  409    HB3  LEU  59           HB1      LEU  59  10.147 -10.043  -8.441
  410   HD11  LEU  59          HD11      LEU  59  13.127  -7.906  -9.178
  411   HD12  LEU  59          HD12      LEU  59  12.624  -9.399  -8.388
  412   HD13  LEU  59          HD13      LEU  59  12.255  -7.842  -7.646
  413   HD21  LEU  59          HD23      LEU  59  10.242  -8.911 -11.235
  414   HD22  LEU  59          HD21      LEU  59  11.408 -10.045 -10.553
  415   HD23  LEU  59          HD22      LEU  59  11.963  -8.525 -11.254
  416    H    ASP  60           HN       ASP  60   7.751  -9.034  -6.672
  417    HA   ASP  60           HA       ASP  60   6.933 -11.690  -6.543
  418    HB2  ASP  60           HB2      ASP  60   5.983  -9.311  -4.936
  419    HB3  ASP  60           HB1      ASP  60   5.638 -10.989  -4.526
  420    H    GLY  61           HN       GLY  61   5.185  -8.827  -7.577
  421    HA2  GLY  61           HA2      GLY  61   3.286  -8.702  -8.895
  422    HA3  GLY  61           HA1      GLY  61   3.209 -10.457  -8.887
  423    H    ARG  62           HN       ARG  62   3.442 -10.017  -5.780
  424    HA   ARG  62           HA       ARG  62   0.754 -10.508  -5.188
  425    HE   ARG  62           HE       ARG  62   1.001 -12.090  -2.037
  426    HB2  ARG  62           HB2      ARG  62   2.868  -9.412  -3.325
  427    HB3  ARG  62           HB1      ARG  62   1.387 -10.233  -2.852
  428    HG2  ARG  62           HG2      ARG  62   3.586 -11.504  -4.470
  429    HG3  ARG  62           HG1      ARG  62   3.423 -11.646  -2.719
  430    HD2  ARG  62           HD2      ARG  62   1.360 -12.515  -4.743
  431    HD3  ARG  62           HD1      ARG  62   2.491 -13.586  -3.918
  432   HH11  ARG  62          HH11      ARG  62   0.709 -14.752  -4.268
  433   HH12  ARG  62          HH12      ARG  62  -0.547 -15.534  -3.369
  434   HH21  ARG  62          HH21      ARG  62  -0.652 -13.114  -0.848
  435   HH22  ARG  62          HH22      ARG  62  -1.323 -14.601  -1.427
  436    H    ILE  63           HN       ILE  63   2.539  -7.534  -5.484
  437    HA   ILE  63           HA       ILE  63   0.343  -5.969  -4.370
  438    HB   ILE  63           HB       ILE  63   3.038  -5.094  -5.424
  439   HG12  ILE  63          HG12      ILE  63   3.286  -4.475  -2.922
  440   HG13  ILE  63          HG11      ILE  63   1.941  -5.580  -2.664
  441   HG21  ILE  63          HG21      ILE  63   2.493  -2.903  -4.445
  442   HG22  ILE  63          HG22      ILE  63   0.867  -3.483  -4.088
  443   HG23  ILE  63          HG23      ILE  63   1.406  -3.339  -5.762
  444   HD11  ILE  63          HD13      ILE  63   3.213  -7.410  -3.559
  445   HD12  ILE  63          HD11      ILE  63   4.146  -6.609  -2.296
  446   HD13  ILE  63          HD12      ILE  63   4.534  -6.325  -3.993
  447    H    GLU  64           HN       GLU  64  -1.284  -5.432  -5.662
  448    HA   GLU  64           HA       GLU  64  -0.726  -4.980  -8.519
  449    HB2  GLU  64           HB2      GLU  64  -2.958  -5.677  -9.018
  450    HB3  GLU  64           HB1      GLU  64  -2.264  -6.885  -7.947
  451    HG2  GLU  64           HG2      GLU  64  -3.439  -5.844  -6.052
  452    HG3  GLU  64           HG1      GLU  64  -4.180  -4.699  -7.170
  453    HA   PRO  65           HA       PRO  65  -1.950  -0.752  -8.272
  454    HB2  PRO  65           HB2      PRO  65  -3.695  -0.515 -10.390
  455    HB3  PRO  65           HB1      PRO  65  -1.935  -0.504 -10.542
  456    HG2  PRO  65           HG2      PRO  65  -3.858  -2.760 -10.952
  457    HG3  PRO  65           HG1      PRO  65  -2.439  -2.308 -11.916
  458    HD2  PRO  65           HD2      PRO  65  -2.345  -4.340 -10.179
  459    HD3  PRO  65           HD1      PRO  65  -0.956  -3.256 -10.400
  460    H    ASN  66           HN       ASN  66  -3.926   0.706  -8.190
  461    HA   ASN  66           HA       ASN  66  -5.829   1.286  -7.085
  462    HB2  ASN  66           HB2      ASN  66  -6.826   0.190  -9.067
  463    HB3  ASN  66           HB1      ASN  66  -6.832  -1.344  -8.200
  464   HD21  ASN  66          HD21      ASN  66  -7.518   1.703  -6.651
  465   HD22  ASN  66          HD22      ASN  66  -9.200   1.411  -6.382
  466    H    ASP  67           HN       ASP  67  -4.188   0.579  -5.259
  467    HA   ASP  67           HA       ASP  67  -5.745  -1.096  -3.418
  468    HB2  ASP  67           HB2      ASP  67  -3.941  -2.512  -4.257
  469    HB3  ASP  67           HB1      ASP  67  -2.753  -1.278  -3.845
  470    H    LYS  68           HN       LYS  68  -5.389  -0.615  -1.166
  471    HA   LYS  68           HA       LYS  68  -4.354   2.115  -0.774
  472    HB2  LYS  68           HB2      LYS  68  -6.535   0.594   0.641
  473    HB3  LYS  68           HB1      LYS  68  -5.831   2.064   1.302
  474    HG2  LYS  68           HG2      LYS  68  -6.476   3.232  -0.802
  475    HG3  LYS  68           HG1      LYS  68  -7.332   1.766  -1.287
  476    HD2  LYS  68           HD2      LYS  68  -8.955   3.192  -0.311
  477    HD3  LYS  68           HD1      LYS  68  -8.608   1.943   0.888
  478    HE2  LYS  68           HE2      LYS  68  -7.114   3.467   2.063
  479    HE3  LYS  68           HE1      LYS  68  -7.410   4.712   0.850
  480    HZ1  LYS  68           HZ3      LYS  68  -8.746   5.077   2.819
  481    HZ2  LYS  68           HZ1      LYS  68  -9.447   3.544   2.668
  482    HZ3  LYS  68           HZ2      LYS  68  -9.740   4.730   1.497
  483    H    ILE  69           HN       ILE  69  -2.855   2.538   0.733
  484    HA   ILE  69           HA       ILE  69  -1.643   0.241   2.091
  485    HB   ILE  69           HB       ILE  69  -0.567   3.048   1.767
  486   HG12  ILE  69          HG12      ILE  69  -0.768   1.870  -0.388
  487   HG13  ILE  69          HG11      ILE  69   0.916   2.104   0.067
  488   HG21  ILE  69          HG21      ILE  69   0.334   1.937   3.724
  489   HG22  ILE  69          HG22      ILE  69   1.571   2.060   2.473
  490   HG23  ILE  69          HG23      ILE  69   0.753   0.523   2.757
  491   HD11  ILE  69          HD13      ILE  69   0.543  -0.102  -0.882
  492   HD12  ILE  69          HD11      ILE  69  -0.649  -0.449   0.370
  493   HD13  ILE  69          HD12      ILE  69   1.043  -0.214   0.805
  494    H    LEU  70           HN       LEU  70  -2.070  -0.098   4.171
  495    HA   LEU  70           HA       LEU  70  -3.314   2.032   5.729
  496    HG   LEU  70           HG       LEU  70  -4.465  -0.691   4.539
  497    HB2  LEU  70           HB2      LEU  70  -2.905  -0.875   6.431
  498    HB3  LEU  70           HB1      LEU  70  -3.864   0.282   7.334
  499   HD11  LEU  70          HD11      LEU  70  -5.767  -1.302   7.187
  500   HD12  LEU  70          HD12      LEU  70  -4.846  -2.421   6.183
  501   HD13  LEU  70          HD13      LEU  70  -6.389  -1.788   5.611
  502   HD21  LEU  70          HD23      LEU  70  -6.573   0.515   4.792
  503   HD22  LEU  70          HD21      LEU  70  -5.198   1.615   4.894
  504   HD23  LEU  70          HD22      LEU  70  -6.044   1.124   6.361
  505    H    ARG  71           HN       ARG  71  -0.840  -0.460   6.420
  506    HA   ARG  71           HA       ARG  71   0.761   1.595   7.749
  507    HE   ARG  71           HE       ARG  71   0.934   0.637  11.600
  508    HB2  ARG  71           HB2      ARG  71  -0.084  -0.995   9.057
  509    HB3  ARG  71           HB1      ARG  71   1.119   0.112   9.707
  510    HG2  ARG  71           HG2      ARG  71  -0.596   1.862   9.858
  511    HG3  ARG  71           HG1      ARG  71  -1.796   0.719   9.253
  512    HD2  ARG  71           HD2      ARG  71  -1.900   0.893  11.682
  513    HD3  ARG  71           HD1      ARG  71  -1.404  -0.723  11.182
  514   HH11  ARG  71          HH11      ARG  71  -1.886  -0.093  13.511
  515   HH12  ARG  71          HH12      ARG  71  -1.021  -0.127  15.011
  516   HH21  ARG  71          HH21      ARG  71   2.083   0.594  13.569
  517   HH22  ARG  71          HH22      ARG  71   1.237   0.265  15.044
  518    H    VAL  72           HN       VAL  72   2.930   1.270   7.703
  519    HA   VAL  72           HA       VAL  72   3.883  -0.960   6.051
  520    HB   VAL  72           HB       VAL  72   5.499   1.450   6.873
  521   HG11  VAL  72          HG11      VAL  72   5.685  -0.482   4.565
  522   HG12  VAL  72          HG12      VAL  72   6.801  -0.330   5.924
  523   HG13  VAL  72          HG13      VAL  72   6.676   0.967   4.736
  524   HG21  VAL  72          HG23      VAL  72   3.451   2.284   5.850
  525   HG22  VAL  72          HG21      VAL  72   3.697   1.222   4.464
  526   HG23  VAL  72          HG22      VAL  72   4.832   2.534   4.782
  527    H    ASP  73           HN       ASP  73   6.241  -1.638   6.695
  528    HA   ASP  73           HA       ASP  73   6.221  -2.998   9.078
  529    HB2  ASP  73           HB2      ASP  73   7.836  -3.322   7.189
  530    HB3  ASP  73           HB1      ASP  73   8.709  -1.905   7.758
  531    H    ASP  74           HN       ASP  74   5.937  -2.183  11.054
  532    HA   ASP  74           HA       ASP  74   6.146  -0.904  12.924
  533    HB2  ASP  74           HB2      ASP  74   8.508  -1.761  12.631
  534    HB3  ASP  74           HB1      ASP  74   8.896  -0.218  11.877
  535    H    VAL  75           HN       VAL  75   5.185   0.342  10.411
  536    HA   VAL  75           HA       VAL  75   5.365   3.118  11.298
  537    HB   VAL  75           HB       VAL  75   5.902   2.267   8.443
  538   HG11  VAL  75          HG11      VAL  75   5.657   5.026   9.639
  539   HG12  VAL  75          HG12      VAL  75   4.572   4.284   8.463
  540   HG13  VAL  75          HG13      VAL  75   6.230   4.674   8.008
  541   HG21  VAL  75          HG23      VAL  75   7.829   1.974   9.916
  542   HG22  VAL  75          HG21      VAL  75   7.685   3.649  10.445
  543   HG23  VAL  75          HG22      VAL  75   8.097   3.287   8.770
  544    H    ASN  76           HN       ASN  76   3.602   4.435  10.551
  545    HA   ASN  76           HA       ASN  76   1.370   2.932   9.363
  546    HB2  ASN  76           HB2      ASN  76  -0.186   4.100  10.881
  547    HB3  ASN  76           HB1      ASN  76   0.961   3.097  11.762
  548   HD21  ASN  76          HD21      ASN  76  -0.063   6.321  11.035
  549   HD22  ASN  76          HD22      ASN  76   0.878   7.116  12.246
  550    H    VAL  77           HN       VAL  77   0.497   3.887   7.643
  551    HA   VAL  77           HA       VAL  77   1.206   6.692   7.119
  552    HB   VAL  77           HB       VAL  77   0.728   6.238   4.763
  553   HG11  VAL  77          HG11      VAL  77   2.575   4.655   4.325
  554   HG12  VAL  77          HG12      VAL  77   2.596   4.245   6.040
  555   HG13  VAL  77          HG13      VAL  77   2.989   5.884   5.519
  556   HG21  VAL  77          HG23      VAL  77   0.245   3.976   3.986
  557   HG22  VAL  77          HG21      VAL  77  -1.022   4.553   5.069
  558   HG23  VAL  77          HG22      VAL  77   0.184   3.407   5.654
  559    H    GLN  78           HN       GLN  78  -1.031   5.692   8.821
  560    HA   GLN  78           HA       GLN  78  -3.405   6.436   7.314
  561    HB2  GLN  78           HB2      GLN  78  -3.019   5.508  10.163
  562    HB3  GLN  78           HB1      GLN  78  -4.581   5.926   9.475
  563    HG2  GLN  78           HG2      GLN  78  -2.776   3.776   8.397
  564    HG3  GLN  78           HG1      GLN  78  -4.104   3.495   9.522
  565   HE21  GLN  78          HE21      GLN  78  -3.225   4.338   6.272
  566   HE22  GLN  78          HE22      GLN  78  -4.791   4.128   5.574
  567    H    GLY  79           HN       GLY  79  -1.255   8.402   7.947
  568    HA2  GLY  79           HA2      GLY  79  -2.837  10.637   8.451
  569    HA3  GLY  79           HA1      GLY  79  -2.148  10.145   9.991
  570    H    MET  80           HN       MET  80  -0.523   9.815   6.879
  571    HA   MET  80           HA       MET  80   1.306  11.981   7.683
  572    HB2  MET  80           HB2      MET  80   2.102   9.369   6.383
  573    HB3  MET  80           HB1      MET  80   3.187  10.686   6.806
  574    HG2  MET  80           HG2      MET  80   2.438  10.356   9.198
  575    HG3  MET  80           HG1      MET  80   1.674   8.866   8.650
  576    HE1  MET  80           HE3      MET  80   3.838   8.032   6.354
  577    HE2  MET  80           HE1      MET  80   3.059   6.887   7.446
  578    HE3  MET  80           HE2      MET  80   4.815   6.894   7.282
  579    H    ALA  81           HN       ALA  81   2.211  13.216   6.032
  580    HA   ALA  81           HA       ALA  81   0.584  13.690   3.799
  581    HB1  ALA  81           HB3      ALA  81   2.029  15.396   4.796
  582    HB2  ALA  81           HB1      ALA  81   2.320  15.229   3.064
  583    HB3  ALA  81           HB2      ALA  81   3.451  14.526   4.220
  584    H    GLN  82           HN       GLN  82   1.102  13.500   1.536
  585    HA   GLN  82           HA       GLN  82   1.697  10.944   0.694
  586    HB2  GLN  82           HB2      GLN  82   0.541  12.627  -0.683
  587    HB3  GLN  82           HB1      GLN  82   2.054  13.504  -0.875
  588    HG2  GLN  82           HG2      GLN  82   3.016  11.580  -2.039
  589    HG3  GLN  82           HG1      GLN  82   1.491  10.716  -1.860
  590   HE21  GLN  82          HE21      GLN  82   1.203  10.518  -4.070
  591   HE22  GLN  82          HE22      GLN  82   0.773  11.857  -5.073
  592    H    SER  83           HN       SER  83   3.849  13.774   0.385
  593    HA   SER  83           HA       SER  83   6.092  12.424  -0.545
  594    HG   SER  83           HG       SER  83   8.046  13.661  -0.243
  595    HB2  SER  83           HB2      SER  83   5.919  14.860  -0.589
  596    HB3  SER  83           HB1      SER  83   5.971  14.914   1.173
  597    H    ASP  84           HN       ASP  84   4.966  12.930   2.754
  598    HA   ASP  84           HA       ASP  84   7.265  12.092   4.115
  599    HB2  ASP  84           HB2      ASP  84   5.341  13.210   5.200
  600    HB3  ASP  84           HB1      ASP  84   4.384  11.749   4.971
  601    H    VAL  85           HN       VAL  85   4.447  10.242   3.000
  602    HA   VAL  85           HA       VAL  85   5.198   7.751   4.028
  603    HB   VAL  85           HB       VAL  85   3.629   8.314   1.506
  604   HG11  VAL  85          HG11      VAL  85   2.650   6.081   1.907
  605   HG12  VAL  85          HG12      VAL  85   3.808   5.836   3.215
  606   HG13  VAL  85          HG13      VAL  85   4.378   6.019   1.556
  607   HG21  VAL  85          HG23      VAL  85   1.651   8.076   2.919
  608   HG22  VAL  85          HG21      VAL  85   2.669   9.407   3.469
  609   HG23  VAL  85          HG22      VAL  85   2.681   7.873   4.336
  610    H    VAL  86           HN       VAL  86   6.038   9.367   1.009
  611    HA   VAL  86           HA       VAL  86   7.322   7.186  -0.230
  612    HB   VAL  86           HB       VAL  86   7.900  10.129  -0.601
  613   HG11  VAL  86          HG11      VAL  86   8.734   9.466  -2.803
  614   HG12  VAL  86          HG12      VAL  86   8.447   7.772  -2.403
  615   HG13  VAL  86          HG13      VAL  86   9.653   8.698  -1.510
  616   HG21  VAL  86          HG23      VAL  86   5.538   9.606  -0.945
  617   HG22  VAL  86          HG21      VAL  86   5.981   8.328  -2.076
  618   HG23  VAL  86          HG22      VAL  86   6.329  10.012  -2.467
  619    H    GLU  87           HN       GLU  87   8.529   9.749   1.902
  620    HA   GLU  87           HA       GLU  87  11.256   9.186   1.727
  621    HB2  GLU  87           HB2      GLU  87   9.673  10.226   4.084
  622    HB3  GLU  87           HB1      GLU  87  11.427  10.252   3.968
  623    HG2  GLU  87           HG2      GLU  87  11.277  11.706   2.012
  624    HG3  GLU  87           HG1      GLU  87   9.518  11.683   2.134
  625    H    VAL  88           HN       VAL  88   8.779   7.861   3.882
  626    HA   VAL  88           HA       VAL  88  10.391   6.275   5.498
  627    HB   VAL  88           HB       VAL  88   7.555   5.829   4.565
  628   HG11  VAL  88          HG11      VAL  88   8.470   3.679   5.183
  629   HG12  VAL  88          HG12      VAL  88   7.358   4.232   6.437
  630   HG13  VAL  88          HG13      VAL  88   9.101   4.348   6.689
  631   HG21  VAL  88          HG23      VAL  88   8.699   6.882   7.150
  632   HG22  VAL  88          HG21      VAL  88   6.988   6.606   6.826
  633   HG23  VAL  88          HG22      VAL  88   7.873   7.825   5.910
  634    H    LEU  89           HN       LEU  89   8.625   5.298   2.559
  635    HA   LEU  89           HA       LEU  89   9.579   2.688   2.431
  636    HG   LEU  89           HG       LEU  89   6.974   4.264   1.775
  637    HB2  LEU  89           HB2      LEU  89   8.822   4.493   0.132
  638    HB3  LEU  89           HB1      LEU  89   8.943   2.746   0.061
  639   HD11  LEU  89          HD11      LEU  89   6.480   4.560  -0.584
  640   HD12  LEU  89          HD12      LEU  89   5.296   3.489   0.166
  641   HD13  LEU  89          HD13      LEU  89   6.579   2.818  -0.841
  642   HD21  LEU  89          HD23      LEU  89   7.570   2.090   2.699
  643   HD22  LEU  89          HD21      LEU  89   7.223   1.322   1.150
  644   HD23  LEU  89          HD22      LEU  89   5.922   2.073   2.074
  645    H    ARG  90           HN       ARG  90  11.080   5.688   1.466
  646    HA   ARG  90           HA       ARG  90  13.176   4.384  -0.038
  647    HE   ARG  90           HE       ARG  90  11.471   9.027  -0.295
  648    HB2  ARG  90           HB2      ARG  90  12.788   7.254   0.817
  649    HB3  ARG  90           HB1      ARG  90  14.145   6.694  -0.153
  650    HG2  ARG  90           HG2      ARG  90  12.537   5.913  -1.867
  651    HG3  ARG  90           HG1      ARG  90  11.233   6.618  -0.912
  652    HD2  ARG  90           HD2      ARG  90  13.578   8.106  -2.087
  653    HD3  ARG  90           HD1      ARG  90  11.928   8.117  -2.709
  654   HH11  ARG  90          HH11      ARG  90  14.149   9.780  -2.392
  655   HH12  ARG  90          HH12      ARG  90  14.345  11.387  -1.778
  656   HH21  ARG  90          HH21      ARG  90  11.716  11.143   0.515
  657   HH22  ARG  90          HH22      ARG  90  12.961  12.163  -0.125
  658    H    ASN  91           HN       ASN  91  12.599   5.283   3.221
  659    HA   ASN  91           HA       ASN  91  15.403   5.313   3.957
  660    HB2  ASN  91           HB2      ASN  91  12.873   5.516   5.602
  661    HB3  ASN  91           HB1      ASN  91  14.496   5.581   6.284
  662   HD21  ASN  91          HD21      ASN  91  12.368   7.579   6.278
  663   HD22  ASN  91          HD22      ASN  91  13.042   8.989   5.542
  664    H    ALA  92           HN       ALA  92  12.888   3.024   3.635
  665    HA   ALA  92           HA       ALA  92  13.599   1.154   5.608
  666    HB1  ALA  92           HB3      ALA  92  12.347   0.631   2.913
  667    HB2  ALA  92           HB1      ALA  92  11.478   1.079   4.382
  668    HB3  ALA  92           HB2      ALA  92  12.336  -0.461   4.300
  669    H    GLY  93           HN       GLY  93  13.977   0.289   2.206
  670    HA2  GLY  93           HA2      GLY  93  15.686  -0.749   1.079
  671    HA3  GLY  93           HA1      GLY  93  16.777   0.158   2.114
  672    H    ASN  94           HN       ASN  94  14.480  -1.968   3.573
  673    HA   ASN  94           HA       ASN  94  16.389  -4.160   3.779
  674    HB2  ASN  94           HB2      ASN  94  15.599  -2.347   6.020
  675    HB3  ASN  94           HB1      ASN  94  15.824  -4.056   6.376
  676   HD21  ASN  94          HD21      ASN  94  17.869  -4.410   4.349
  677   HD22  ASN  94          HD22      ASN  94  19.296  -3.661   4.963
  678    HA   PRO  95           HA       PRO  95  12.887  -6.893   4.083
  679    HB2  PRO  95           HB2      PRO  95  13.537  -7.621   6.894
  680    HB3  PRO  95           HB1      PRO  95  13.291  -8.666   5.490
  681    HG2  PRO  95           HG2      PRO  95  15.738  -8.228   6.435
  682    HG3  PRO  95           HG1      PRO  95  15.442  -8.316   4.688
  683    HD2  PRO  95           HD2      PRO  95  15.897  -5.922   6.417
  684    HD3  PRO  95           HD1      PRO  95  16.454  -6.241   4.761
  685    H    VAL  96           HN       VAL  96  11.117  -5.567   4.075
  686    HA   VAL  96           HA       VAL  96  10.081  -4.751   6.711
  687    HB   VAL  96           HB       VAL  96   8.996  -2.826   5.588
  688   HG11  VAL  96          HG11      VAL  96  11.094  -2.525   6.779
  689   HG12  VAL  96          HG12      VAL  96  11.028  -1.473   5.365
  690   HG13  VAL  96          HG13      VAL  96  11.998  -2.945   5.324
  691   HG21  VAL  96          HG23      VAL  96   9.767  -2.154   3.360
  692   HG22  VAL  96          HG21      VAL  96   8.926  -3.704   3.317
  693   HG23  VAL  96          HG22      VAL  96  10.688  -3.653   3.230
  694    H    ARG  97           HN       ARG  97   7.859  -4.827   7.034
  695    HA   ARG  97           HA       ARG  97   6.449  -6.724   5.329
  696    HE   ARG  97           HE       ARG  97   4.165  -5.686   9.312
  697    HB2  ARG  97           HB2      ARG  97   6.532  -7.115   7.776
  698    HB3  ARG  97           HB1      ARG  97   5.686  -5.595   8.032
  699    HG2  ARG  97           HG2      ARG  97   3.751  -6.464   6.822
  700    HG3  ARG  97           HG1      ARG  97   4.600  -7.990   6.564
  701    HD2  ARG  97           HD2      ARG  97   3.062  -8.181   8.431
  702    HD3  ARG  97           HD1      ARG  97   4.730  -8.319   8.988
  703   HH11  ARG  97          HH11      ARG  97   2.611  -8.632  10.339
  704   HH12  ARG  97          HH12      ARG  97   1.959  -7.936  11.785
  705   HH21  ARG  97          HH21      ARG  97   3.313  -4.762  11.215
  706   HH22  ARG  97          HH22      ARG  97   2.360  -5.737  12.284
  707    H    LEU  98           HN       LEU  98   4.515  -6.265   4.331
  708    HA   LEU  98           HA       LEU  98   3.765  -3.417   4.254
  709    HG   LEU  98           HG       LEU  98   5.870  -4.666   2.425
  710    HB2  LEU  98           HB2      LEU  98   3.514  -5.492   2.082
  711    HB3  LEU  98           HB1      LEU  98   3.014  -3.818   1.953
  712   HD11  LEU  98          HD11      LEU  98   5.112  -5.544   0.287
  713   HD12  LEU  98          HD12      LEU  98   6.233  -4.204   0.050
  714   HD13  LEU  98          HD13      LEU  98   4.500  -3.954  -0.164
  715   HD21  LEU  98          HD23      LEU  98   4.609  -2.055   1.600
  716   HD22  LEU  98          HD21      LEU  98   6.342  -2.374   1.634
  717   HD23  LEU  98          HD22      LEU  98   5.411  -2.405   3.132
  718    H    LEU  99           HN       LEU  99   1.885  -3.051   5.243
  719    HA   LEU  99           HA       LEU  99  -0.177  -5.152   5.174
  720    HG   LEU  99           HG       LEU  99  -2.228  -3.513   6.883
  721    HB2  LEU  99           HB2      LEU  99   0.573  -4.509   7.425
  722    HB3  LEU  99           HB1      LEU  99   0.142  -2.843   7.096
  723   HD11  LEU  99          HD11      LEU  99  -1.930  -5.811   6.176
  724   HD12  LEU  99          HD12      LEU  99  -2.903  -5.746   7.646
  725   HD13  LEU  99          HD13      LEU  99  -1.205  -6.218   7.733
  726   HD21  LEU  99          HD23      LEU  99  -1.375  -2.697   9.015
  727   HD22  LEU  99          HD21      LEU  99  -0.907  -4.336   9.466
  728   HD23  LEU  99          HD22      LEU  99  -2.611  -3.931   9.262
  729    H    LEU 100           HN       LEU 100  -1.426  -4.767   3.448
  730    HA   LEU 100           HA       LEU 100  -2.640  -2.100   3.231
  731    HG   LEU 100           HG       LEU 100  -0.046  -3.974   1.641
  732    HB2  LEU 100           HB2      LEU 100  -2.628  -2.749   0.657
  733    HB3  LEU 100           HB1      LEU 100  -1.313  -1.870   1.410
  734   HD11  LEU 100          HD11      LEU 100  -1.897  -5.539   1.785
  735   HD12  LEU 100          HD12      LEU 100  -0.813  -5.982   0.465
  736   HD13  LEU 100          HD13      LEU 100  -2.349  -5.186   0.117
  737   HD21  LEU 100          HD23      LEU 100   0.495  -4.244  -0.714
  738   HD22  LEU 100          HD21      LEU 100   0.259  -2.541  -0.323
  739   HD23  LEU 100          HD22      LEU 100  -1.005  -3.434  -1.167
  740    H    ILE 101           HN       ILE 101  -4.635  -2.128   1.853
  741    HA   ILE 101           HA       ILE 101  -6.081  -4.673   2.200
  742    HB   ILE 101           HB       ILE 101  -6.833  -2.903   3.775
  743   HG12  ILE 101          HG12      ILE 101  -8.905  -3.601   1.683
  744   HG13  ILE 101          HG11      ILE 101  -8.349  -4.704   2.938
  745   HG21  ILE 101          HG21      ILE 101  -6.403  -0.957   2.382
  746   HG22  ILE 101          HG22      ILE 101  -8.087  -0.984   2.905
  747   HG23  ILE 101          HG23      ILE 101  -7.665  -1.462   1.260
  748   HD11  ILE 101          HD13      ILE 101 -10.465  -3.707   3.545
  749   HD12  ILE 101          HD11      ILE 101  -9.778  -2.092   3.375
  750   HD13  ILE 101          HD12      ILE 101  -9.197  -3.169   4.644
  751    H    ARG 102           HN       ARG 102  -7.343  -5.389   0.543
  752    HA   ARG 102           HA       ARG 102  -7.516  -3.711  -1.868
  753    HE   ARG 102           HE       ARG 102  -6.321  -4.520  -6.077
  754    HB2  ARG 102           HB2      ARG 102  -5.837  -5.861  -1.685
  755    HB3  ARG 102           HB1      ARG 102  -7.287  -6.611  -2.334
  756    HG2  ARG 102           HG2      ARG 102  -5.766  -4.307  -3.535
  757    HG3  ARG 102           HG1      ARG 102  -5.824  -5.966  -4.132
  758    HD2  ARG 102           HD2      ARG 102  -8.256  -5.713  -4.489
  759    HD3  ARG 102           HD1      ARG 102  -8.132  -4.030  -3.975
  760   HH11  ARG 102          HH11      ARG 102  -9.737  -4.180  -5.475
  761   HH12  ARG 102          HH12      ARG 102 -10.091  -3.611  -7.071
  762   HH21  ARG 102          HH21      ARG 102  -6.779  -3.769  -8.178
  763   HH22  ARG 102          HH22      ARG 102  -8.412  -3.377  -8.608
  764    H    ARG 103           HN       ARG 103  -9.531  -3.522  -2.615
  765    HA   ARG 103           HA       ARG 103 -11.646  -5.057  -1.384
  766    HE   ARG 103           HE       ARG 103 -14.066  -2.591  -4.533
  767    HB2  ARG 103           HB2      ARG 103 -13.146  -3.588  -2.715
  768    HB3  ARG 103           HB1      ARG 103 -12.022  -2.699  -1.697
  769    HG2  ARG 103           HG2      ARG 103 -10.607  -2.246  -3.617
  770    HG3  ARG 103           HG1      ARG 103 -11.686  -3.184  -4.651
  771    HD2  ARG 103           HD2      ARG 103 -12.477  -0.715  -3.111
  772    HD3  ARG 103           HD1      ARG 103 -12.051  -0.742  -4.822
  773   HH11  ARG 103          HH11      ARG 103 -13.682   0.822  -3.927
  774   HH12  ARG 103          HH12      ARG 103 -15.347   1.192  -4.224
  775   HH21  ARG 103          HH21      ARG 103 -16.259  -2.110  -4.923
  776   HH22  ARG 103          HH22      ARG 103 -16.812  -0.474  -4.792
  777    H    LEU 104           HN       LEU 104 -12.930  -6.571  -2.316
  778    HA   LEU 104           HA       LEU 104 -12.033  -7.616  -4.907
  779    HG   LEU 104           HG       LEU 104 -11.423  -8.537  -2.041
  780    HB2  LEU 104           HB2      LEU 104 -13.807  -8.944  -2.856
  781    HB3  LEU 104           HB1      LEU 104 -13.087  -9.697  -4.265
  782   HD11  LEU 104          HD11      LEU 104 -12.859 -10.218  -1.056
  783   HD12  LEU 104          HD12      LEU 104 -11.210 -10.831  -1.187
  784   HD13  LEU 104          HD13      LEU 104 -12.440 -11.359  -2.334
  785   HD21  LEU 104          HD23      LEU 104 -10.837 -10.576  -4.184
  786   HD22  LEU 104          HD21      LEU 104  -9.710 -10.016  -2.948
  787   HD23  LEU 104          HD22      LEU 104 -10.297  -8.897  -4.179
  788    HA   PRO 105           HA       PRO 105 -15.868  -6.297  -6.717
  789    HB2  PRO 105           HB2      PRO 105 -15.801  -7.648  -9.023
  790    HB3  PRO 105           HB1      PRO 105 -14.636  -6.365  -8.678
  791    HG2  PRO 105           HG2      PRO 105 -14.296  -9.331  -8.503
  792    HG3  PRO 105           HG1      PRO 105 -13.173  -8.111  -9.128
  793    HD2  PRO 105           HD2      PRO 105 -13.029  -9.222  -6.609
  794    HD3  PRO 105           HD1      PRO 105 -12.347  -7.645  -7.049
  795    H    LEU 106           HN       LEU 106 -17.941  -7.078  -7.463
  796    HA   LEU 106           HA       LEU 106 -18.574  -9.853  -6.762
  797    HG   LEU 106           HG       LEU 106 -18.046  -8.166  -4.385
  798    HB2  LEU 106           HB2      LEU 106 -20.026  -7.407  -5.751
  799    HB3  LEU 106           HB1      LEU 106 -20.654  -9.040  -5.627
  800   HD11  LEU 106          HD11      LEU 106 -19.852  -6.899  -3.382
  801   HD12  LEU 106          HD12      LEU 106 -19.271  -8.127  -2.258
  802   HD13  LEU 106          HD13      LEU 106 -20.781  -8.378  -3.134
  803   HD21  LEU 106          HD23      LEU 106 -18.282 -10.218  -3.092
  804   HD22  LEU 106          HD21      LEU 106 -18.250 -10.563  -4.821
  805   HD23  LEU 106          HD22      LEU 106 -19.780 -10.595  -3.944
  806    H    LEU 107           HN       LEU 107 -19.302 -10.682  -8.610
  807    HA   LEU 107           HA       LEU 107 -20.550  -9.100 -10.639
  808    HG   LEU 107           HG       LEU 107 -18.672 -11.846 -12.308
  809    HB2  LEU 107           HB2      LEU 107 -20.058 -12.050 -10.317
  810    HB3  LEU 107           HB1      LEU 107 -20.980 -11.416 -11.666
  811   HD11  LEU 107          HD11      LEU 107 -18.208  -9.739 -13.352
  812   HD12  LEU 107          HD12      LEU 107 -19.206  -8.887 -12.173
  813   HD13  LEU 107          HD13      LEU 107 -19.954  -9.993 -13.327
  814   HD21  LEU 107          HD23      LEU 107 -17.635 -11.507 -10.105
  815   HD22  LEU 107          HD21      LEU 107 -17.923  -9.774 -10.249
  816   HD23  LEU 107          HD22      LEU 107 -16.829 -10.583 -11.371
  817    H    GLU 108           HN       GLU 108 -22.682  -9.171 -11.369
  818    HA   GLU 108           HA       GLU 108 -24.619 -10.390  -9.515
  819    HB2  GLU 108           HB2      GLU 108 -24.521  -7.953  -9.186
  820    HB3  GLU 108           HB1      GLU 108 -24.865  -7.709 -10.893
  821    HG2  GLU 108           HG2      GLU 108 -27.046  -8.775 -10.605
  822    HG3  GLU 108           HG1      GLU 108 -26.700  -9.010  -8.892
  Start of MODEL   15
    1    H1   GLY   1           HT1      GLY   1 -10.934  -3.599  16.262
    2    H2   GLY   1           HT2      GLY   1 -12.447  -2.883  16.508
    3    H3   GLY   1           HT3      GLY   1 -11.412  -3.145  17.821
    4    HA2  GLY   1           HA1      GLY   1 -11.410  -0.814  17.177
    5    HA3  GLY   1           HA2      GLY   1  -9.830  -1.556  16.969
    6    H    SER   2           HN       SER   2  -9.051  -1.964  14.879
    7    HA   SER   2           HA       SER   2 -10.468  -0.472  12.772
    8    HG   SER   2           HG       SER   2  -8.411   0.586  14.472
    9    HB2  SER   2           HB2      SER   2  -7.506  -1.041  13.048
   10    HB3  SER   2           HB1      SER   2  -8.257  -0.137  11.732
   11    H    HIS   3           HN       HIS   3  -8.867  -3.467  13.598
   12    HA   HIS   3           HA       HIS   3  -9.168  -4.537  10.914
   13    HD1  HIS   3           HD1      HIS   3  -6.486  -6.362  10.193
   14    HD2  HIS   3           HD2      HIS   3  -9.332  -8.337  12.490
   15    HE1  HIS   3           HE1      HIS   3  -6.646  -8.677   9.223
   16    HE2  HIS   3           HE2      HIS   3  -8.331  -9.872  10.667
   17    HB2  HIS   3           HB2      HIS   3  -7.155  -5.070  12.258
   18    HB3  HIS   3           HB1      HIS   3  -8.176  -5.886  13.436
   19    H    GLY   4           HN       GLY   4 -11.344  -4.742  10.528
   20    HA2  GLY   4           HA2      GLY   4 -12.662  -6.920  11.954
   21    HA3  GLY   4           HA1      GLY   4 -13.464  -5.357  11.998
   22    H    TYR   5           HN       TYR   5 -11.802  -7.255   9.481
   23    HA   TYR   5           HA       TYR   5 -14.275  -7.248   7.914
   24    HD1  TYR   5           HD2      TYR   5 -12.057  -4.150   8.360
   25    HD2  TYR   5           HD1      TYR   5 -14.813  -5.496   5.412
   26    HE1  TYR   5           HE2      TYR   5 -13.178  -1.963   8.419
   27    HE2  TYR   5           HE1      TYR   5 -15.940  -3.312   5.460
   28    HH   TYR   5           HH       TYR   5 -16.206  -1.411   7.047
   29    HB2  TYR   5           HB2      TYR   5 -11.612  -6.158   7.032
   30    HB3  TYR   5           HB1      TYR   5 -12.794  -6.744   5.866
   31    H    SER   6           HN       SER   6 -14.310  -8.827   6.205
   32    HA   SER   6           HA       SER   6 -12.237 -10.882   6.281
   33    HG   SER   6           HG       SER   6 -15.760 -10.616   6.884
   34    HB2  SER   6           HB2      SER   6 -13.830 -12.686   6.659
   35    HB3  SER   6           HB1      SER   6 -13.936 -11.530   7.985
   36    H    ASP   7           HN       ASP   7 -13.463 -12.801   4.731
   37    HA   ASP   7           HA       ASP   7 -13.142 -11.846   2.146
   38    HB2  ASP   7           HB2      ASP   7 -14.752 -14.243   3.051
   39    HB3  ASP   7           HB1      ASP   7 -14.174 -13.960   1.412
   40    H    ALA   8           HN       ALA   8 -14.305 -10.067   1.582
   41    HA   ALA   8           HA       ALA   8 -17.204 -10.447   1.293
   42    HB1  ALA   8           HB3      ALA   8 -17.613  -8.138   1.966
   43    HB2  ALA   8           HB1      ALA   8 -15.894  -7.918   2.287
   44    HB3  ALA   8           HB2      ALA   8 -16.835  -9.044   3.264
   45    H    SER   9           HN       SER   9 -17.240 -10.713  -0.879
   46    HA   SER   9           HA       SER   9 -17.103 -10.236  -3.097
   47    HG   SER   9           HG       SER   9 -16.819  -6.970  -4.162
   48    HB2  SER   9           HB2      SER   9 -18.409  -8.261  -2.396
   49    HB3  SER   9           HB1      SER   9 -16.908  -7.378  -2.112
   50    H    GLY  10           HN       GLY  10 -14.609 -10.572  -1.439
   51    HA2  GLY  10           HA2      GLY  10 -12.464 -10.956  -2.425
   52    HA3  GLY  10           HA1      GLY  10 -12.757  -9.600  -3.504
   53    H    PHE  11           HN       PHE  11 -13.656  -7.783  -1.463
   54    HA   PHE  11           HA       PHE  11 -11.249  -6.589  -0.750
   55    HD1  PHE  11           HD2      PHE  11 -11.382  -3.754  -0.107
   56    HD2  PHE  11           HD1      PHE  11 -14.758  -5.511  -2.010
   57    HE1  PHE  11           HE2      PHE  11 -11.363  -1.958  -1.790
   58    HE2  PHE  11           HE1      PHE  11 -14.744  -3.720  -3.697
   59    HZ   PHE  11           HZ       PHE  11 -13.045  -1.939  -3.587
   60    HB2  PHE  11           HB2      PHE  11 -14.079  -6.239   0.146
   61    HB3  PHE  11           HB1      PHE  11 -12.798  -5.416   1.032
   62    H    SER  12           HN       SER  12  -9.758  -7.171   0.656
   63    HA   SER  12           HA       SER  12 -10.490  -8.120   3.284
   64    HG   SER  12           HG       SER  12  -9.120  -9.774   4.156
   65    HB2  SER  12           HB2      SER  12 -10.494 -10.214   2.015
   66    HB3  SER  12           HB1      SER  12  -8.870  -9.872   1.420
   67    H    LEU  13           HN       LEU  13  -8.656  -8.284   4.729
   68    HA   LEU  13           HA       LEU  13  -6.589  -6.334   4.042
   69    HG   LEU  13           HG       LEU  13  -9.145  -6.279   5.827
   70    HB2  LEU  13           HB2      LEU  13  -7.146  -7.586   6.730
   71    HB3  LEU  13           HB1      LEU  13  -6.191  -6.153   6.403
   72   HD11  LEU  13          HD11      LEU  13  -7.788  -5.294   8.334
   73   HD12  LEU  13          HD12      LEU  13  -8.793  -6.737   8.203
   74   HD13  LEU  13          HD13      LEU  13  -9.502  -5.142   7.952
   75   HD21  LEU  13          HD23      LEU  13  -7.207  -4.000   6.210
   76   HD22  LEU  13          HD21      LEU  13  -8.942  -3.835   5.941
   77   HD23  LEU  13          HD22      LEU  13  -7.916  -4.527   4.684
   78    H    TYR  14           HN       TYR  14  -4.859  -7.240   3.084
   79    HA   TYR  14           HA       TYR  14  -3.705  -9.628   4.361
   80    HD1  TYR  14           HD1      TYR  14  -5.722  -8.146   1.094
   81    HD2  TYR  14           HD2      TYR  14  -1.710  -9.472   0.561
   82    HE1  TYR  14           HE1      TYR  14  -5.549  -6.796  -0.948
   83    HE2  TYR  14           HE2      TYR  14  -1.529  -8.119  -1.485
   84    HH   TYR  14           HH       TYR  14  -3.769  -5.735  -2.315
   85    HB2  TYR  14           HB2      TYR  14  -3.051 -10.495   2.189
   86    HB3  TYR  14           HB1      TYR  14  -4.791 -10.235   2.223
   87    H    SER  15           HN       SER  15  -1.435  -9.804   4.317
   88    HA   SER  15           HA       SER  15  -0.029  -7.308   3.627
   89    HG   SER  15           HG       SER  15   0.389  -9.258   7.143
   90    HB2  SER  15           HB2      SER  15   1.438  -7.689   5.580
   91    HB3  SER  15           HB1      SER  15  -0.248  -7.492   6.057
   92    H    VAL  16           HN       VAL  16   1.814  -7.479   2.494
   93    HA   VAL  16           HA       VAL  16   2.759 -10.192   1.847
   94    HB   VAL  16           HB       VAL  16   3.114  -7.662   0.230
   95   HG11  VAL  16          HG11      VAL  16   3.753 -10.541  -0.405
   96   HG12  VAL  16          HG12      VAL  16   4.914  -9.241  -0.132
   97   HG13  VAL  16          HG13      VAL  16   3.859  -9.200  -1.545
   98   HG21  VAL  16          HG23      VAL  16   1.234  -9.984  -0.197
   99   HG22  VAL  16          HG21      VAL  16   1.480  -8.642  -1.316
  100   HG23  VAL  16          HG22      VAL  16   0.778  -8.347   0.275
  101    H    GLU  17           HN       GLU  17   4.968 -10.645   1.916
  102    HA   GLU  17           HA       GLU  17   6.502  -8.898   3.645
  103    HB2  GLU  17           HB2      GLU  17   6.483 -11.249   4.187
  104    HB3  GLU  17           HB1      GLU  17   7.026 -11.670   2.569
  105    HG2  GLU  17           HG2      GLU  17   9.148 -10.581   2.980
  106    HG3  GLU  17           HG1      GLU  17   8.608 -10.105   4.587
  107    H    LEU  18           HN       LEU  18   7.912  -7.473   2.922
  108    HA   LEU  18           HA       LEU  18   9.193  -7.922   0.311
  109    HG   LEU  18           HG       LEU  18   7.483  -5.060  -1.132
  110    HB2  LEU  18           HB2      LEU  18   7.565  -5.681   1.215
  111    HB3  LEU  18           HB1      LEU  18   9.146  -5.170   0.654
  112   HD11  LEU  18          HD11      LEU  18   9.810  -5.515  -1.707
  113   HD12  LEU  18          HD12      LEU  18   8.705  -6.310  -2.827
  114   HD13  LEU  18          HD13      LEU  18   9.511  -7.247  -1.569
  115   HD21  LEU  18          HD23      LEU  18   6.004  -6.848  -0.349
  116   HD22  LEU  18          HD21      LEU  18   7.231  -8.044  -0.767
  117   HD23  LEU  18          HD22      LEU  18   6.469  -7.082  -2.034
  118    H    PHE  19           HN       PHE  19  11.209  -6.581   0.050
  119    HA   PHE  19           HA       PHE  19  12.533  -5.803   2.502
  120    HD1  PHE  19           HD2      PHE  19  11.687  -9.250   0.621
  121    HD2  PHE  19           HD1      PHE  19  15.647  -7.759   0.164
  122    HE1  PHE  19           HE2      PHE  19  11.964 -10.619  -1.405
  123    HE2  PHE  19           HE1      PHE  19  15.932  -9.125  -1.862
  124    HZ   PHE  19           HZ       PHE  19  14.090 -10.558  -2.648
  125    HB2  PHE  19           HB2      PHE  19  14.466  -7.316   2.126
  126    HB3  PHE  19           HB1      PHE  19  12.984  -8.183   2.514
  127    H    ARG  20           HN       ARG  20  13.875  -4.141   2.155
  128    HA   ARG  20           HA       ARG  20  14.559  -3.528  -0.644
  129    HE   ARG  20           HE       ARG  20  15.812   0.330   1.281
  130    HB2  ARG  20           HB2      ARG  20  13.166  -1.931   0.925
  131    HB3  ARG  20           HB1      ARG  20  14.755  -1.494   1.540
  132    HG2  ARG  20           HG2      ARG  20  14.068  -1.399  -1.382
  133    HG3  ARG  20           HG1      ARG  20  13.805  -0.037  -0.292
  134    HD2  ARG  20           HD2      ARG  20  16.469  -1.393  -0.678
  135    HD3  ARG  20           HD1      ARG  20  15.954   0.029  -1.581
  136   HH11  ARG  20          HH11      ARG  20  17.805   0.648  -1.559
  137   HH12  ARG  20          HH12      ARG  20  18.867   1.813  -0.842
  138   HH21  ARG  20          HH21      ARG  20  17.206   1.865   2.233
  139   HH22  ARG  20          HH22      ARG  20  18.529   2.502   1.315
  140    H    GLU  21           HN       GLU  21  16.547  -4.258  -1.082
  141    HA   GLU  21           HA       GLU  21  18.710  -3.501   0.754
  142    HB2  GLU  21           HB2      GLU  21  18.195  -5.892   1.069
  143    HB3  GLU  21           HB1      GLU  21  18.470  -6.167  -0.645
  144    HG2  GLU  21           HG2      GLU  21  20.803  -5.461  -0.370
  145    HG3  GLU  21           HG1      GLU  21  20.516  -5.235   1.355
  146    H    LYS  22           HN       LYS  22  17.613  -4.086  -2.482
  147    HA   LYS  22           HA       LYS  22  20.069  -3.836  -3.837
  148    HB2  LYS  22           HB2      LYS  22  17.290  -3.148  -4.806
  149    HB3  LYS  22           HB1      LYS  22  18.702  -3.372  -5.828
  150    HG2  LYS  22           HG2      LYS  22  17.466  -5.487  -4.076
  151    HG3  LYS  22           HG1      LYS  22  17.237  -5.334  -5.819
  152    HD2  LYS  22           HD2      LYS  22  19.641  -5.660  -6.160
  153    HD3  LYS  22           HD1      LYS  22  19.866  -5.813  -4.416
  154    HE2  LYS  22           HE2      LYS  22  18.233  -7.637  -6.177
  155    HE3  LYS  22           HE1      LYS  22  19.804  -8.003  -5.467
  156    HZ1  LYS  22           HZ3      LYS  22  17.295  -7.487  -3.966
  157    HZ2  LYS  22           HZ1      LYS  22  18.805  -7.797  -3.267
  158    HZ3  LYS  22           HZ2      LYS  22  18.033  -8.993  -4.180
  159    H    ASP  23           HN       ASP  23  20.715  -2.032  -5.234
  160    HA   ASP  23           HA       ASP  23  20.662   0.444  -3.744
  161    HB2  ASP  23           HB2      ASP  23  22.061  -0.235  -6.339
  162    HB3  ASP  23           HB1      ASP  23  22.339   1.203  -5.361
  163    H    THR  24           HN       THR  24  18.148  -0.279  -4.833
  164    HA   THR  24           HA       THR  24  17.733   1.404  -7.165
  165    HB   THR  24           HB       THR  24  15.385   0.663  -7.036
  166    HG1  THR  24           HG1      THR  24  14.726  -0.700  -5.404
  167   HG21  THR  24          HG23      THR  24  17.373  -1.598  -6.789
  168   HG22  THR  24          HG21      THR  24  16.999  -0.707  -8.264
  169   HG23  THR  24          HG22      THR  24  15.766  -1.713  -7.504
  170    H    SER  25           HN       SER  25  17.653   1.683  -3.784
  171    HA   SER  25           HA       SER  25  17.008   3.312  -2.338
  172    HG   SER  25           HG       SER  25  19.087   4.742  -4.664
  173    HB2  SER  25           HB2      SER  25  17.020   5.007  -4.848
  174    HB3  SER  25           HB1      SER  25  16.987   5.629  -3.198
  175    H    SER  26           HN       SER  26  14.961   1.746  -3.946
  176    HA   SER  26           HA       SER  26  12.658   3.111  -2.897
  177    HG   SER  26           HG       SER  26  12.419   1.783  -6.328
  178    HB2  SER  26           HB2      SER  26  11.447   3.267  -5.031
  179    HB3  SER  26           HB1      SER  26  12.906   4.256  -5.060
  180    H    LEU  27           HN       LEU  27  10.607   1.814  -3.911
  181    HA   LEU  27           HA       LEU  27  11.264  -1.051  -3.786
  182    HG   LEU  27           HG       LEU  27  11.366   0.071  -1.156
  183    HB2  LEU  27           HB2      LEU  27   9.131   0.445  -2.277
  184    HB3  LEU  27           HB1      LEU  27   9.052  -1.288  -2.530
  185   HD11  LEU  27          HD11      LEU  27   8.939  -1.242   0.063
  186   HD12  LEU  27          HD12      LEU  27   9.337   0.474   0.124
  187   HD13  LEU  27          HD13      LEU  27  10.367  -0.699   0.943
  188   HD21  LEU  27          HD23      LEU  27  10.469  -2.802  -1.340
  189   HD22  LEU  27          HD21      LEU  27  11.782  -2.216  -0.320
  190   HD23  LEU  27          HD22      LEU  27  11.908  -2.095  -2.074
  191    H    GLY  28           HN       GLY  28  10.022   1.360  -5.596
  192    HA2  GLY  28           HA2      GLY  28   8.977   1.213  -7.663
  193    HA3  GLY  28           HA1      GLY  28   8.668  -0.488  -7.353
  194    H    ILE  29           HN       ILE  29   7.750   1.935  -5.037
  195    HA   ILE  29           HA       ILE  29   4.935   1.296  -5.558
  196    HB   ILE  29           HB       ILE  29   6.219   2.575  -3.140
  197   HG12  ILE  29          HG12      ILE  29   4.996  -0.173  -3.465
  198   HG13  ILE  29          HG11      ILE  29   6.725   0.153  -3.496
  199   HG21  ILE  29          HG21      ILE  29   3.955   3.385  -3.441
  200   HG22  ILE  29          HG22      ILE  29   4.021   2.273  -2.075
  201   HG23  ILE  29          HG23      ILE  29   3.363   1.734  -3.620
  202   HD11  ILE  29          HD13      ILE  29   6.004  -0.688  -1.331
  203   HD12  ILE  29          HD11      ILE  29   4.882   0.663  -1.173
  204   HD13  ILE  29          HD12      ILE  29   6.620   0.960  -1.204
  205    H    SER  30           HN       SER  30   3.857   2.696  -6.773
  206    HA   SER  30           HA       SER  30   4.601   5.541  -6.661
  207    HG   SER  30           HG       SER  30   5.555   5.241  -9.353
  208    HB2  SER  30           HB2      SER  30   3.129   4.041  -8.842
  209    HB3  SER  30           HB1      SER  30   3.559   5.750  -8.880
  210    H    ILE  31           HN       ILE  31   3.361   6.181  -4.928
  211    HA   ILE  31           HA       ILE  31   0.508   5.606  -4.911
  212    HB   ILE  31           HB       ILE  31   0.483   6.777  -2.749
  213   HG12  ILE  31          HG12      ILE  31   3.466   7.085  -3.165
  214   HG13  ILE  31          HG11      ILE  31   2.297   8.395  -3.289
  215   HG21  ILE  31          HG21      ILE  31   2.673   4.715  -2.984
  216   HG22  ILE  31          HG22      ILE  31   0.947   4.383  -2.827
  217   HG23  ILE  31          HG23      ILE  31   1.820   5.153  -1.503
  218   HD11  ILE  31          HD13      ILE  31   2.891   6.786  -0.816
  219   HD12  ILE  31          HD11      ILE  31   1.716   8.095  -0.938
  220   HD13  ILE  31          HD12      ILE  31   3.435   8.430  -1.150
  221    H    SER  32           HN       SER  32  -1.011   7.424  -4.452
  222    HA   SER  32           HA       SER  32  -0.202  10.006  -5.544
  223    HG   SER  32           HG       SER  32  -3.118  10.472  -6.721
  224    HB2  SER  32           HB2      SER  32  -0.984   8.798  -7.512
  225    HB3  SER  32           HB1      SER  32  -2.475   8.358  -6.681
  226    H    GLY  33           HN       GLY  33  -1.202  11.682  -4.561
  227    HA2  GLY  33           HA2      GLY  33  -2.753  11.219  -2.236
  228    HA3  GLY  33           HA1      GLY  33  -2.451  12.784  -2.978
  229    H    MET  34           HN       MET  34  -4.880  11.103  -1.905
  230    HA   MET  34           HA       MET  34  -6.690  10.774  -4.018
  231    HB2  MET  34           HB2      MET  34  -7.022   9.825  -1.770
  232    HB3  MET  34           HB1      MET  34  -7.279  11.442  -1.128
  233    HG2  MET  34           HG2      MET  34  -9.271  11.689  -2.495
  234    HG3  MET  34           HG1      MET  34  -9.004  10.093  -3.194
  235    HE1  MET  34           HE3      MET  34  -8.043   8.395  -0.679
  236    HE2  MET  34           HE1      MET  34  -9.227   7.830  -1.858
  237    HE3  MET  34           HE2      MET  34  -9.584   7.735  -0.134
  238    H    ARG  35           HN       ARG  35  -8.327  12.071  -4.841
  239    HA   ARG  35           HA       ARG  35  -8.063  14.947  -4.254
  240    HE   ARG  35           HE       ARG  35  -4.204  14.773  -6.678
  241    HB2  ARG  35           HB2      ARG  35  -8.775  13.648  -6.889
  242    HB3  ARG  35           HB1      ARG  35  -8.690  15.379  -6.592
  243    HG2  ARG  35           HG2      ARG  35  -6.391  13.440  -6.438
  244    HG3  ARG  35           HG1      ARG  35  -6.703  14.590  -7.738
  245    HD2  ARG  35           HD2      ARG  35  -6.530  16.424  -6.052
  246    HD3  ARG  35           HD1      ARG  35  -6.030  15.216  -4.868
  247   HH11  ARG  35          HH11      ARG  35  -5.517  17.848  -5.698
  248   HH12  ARG  35          HH12      ARG  35  -4.066  18.727  -6.053
  249   HH21  ARG  35          HH21      ARG  35  -2.290  15.920  -7.147
  250   HH22  ARG  35          HH22      ARG  35  -2.232  17.631  -6.876
  251    H    ASP  36           HN       ASP  36  -9.842  16.009  -3.657
  252    HA   ASP  36           HA       ASP  36 -12.466  14.803  -4.195
  253    HB2  ASP  36           HB2      ASP  36 -11.790  14.211  -1.891
  254    HB3  ASP  36           HB1      ASP  36 -11.600  15.922  -1.519
  255    H    GLN  37           HN       GLN  37 -14.238  16.297  -4.141
  256    HA   GLN  37           HA       GLN  37 -13.389  19.068  -4.653
  257    HB2  GLN  37           HB2      GLN  37 -15.400  19.285  -6.045
  258    HB3  GLN  37           HB1      GLN  37 -14.360  17.988  -6.612
  259    HG2  GLN  37           HG2      GLN  37 -16.771  17.545  -4.871
  260    HG3  GLN  37           HG1      GLN  37 -16.811  17.494  -6.632
  261   HE21  GLN  37          HE21      GLN  37 -17.387  15.399  -4.687
  262   HE22  GLN  37          HE22      GLN  37 -16.317  14.095  -5.057
  263    H    SER  38           HN       SER  38 -14.253  20.707  -3.514
  264    HA   SER  38           HA       SER  38 -15.286  21.775  -1.790
  265    HG   SER  38           HG       SER  38 -18.050  22.303  -3.442
  266    HB2  SER  38           HB2      SER  38 -17.569  19.943  -2.568
  267    HB3  SER  38           HB1      SER  38 -17.715  21.389  -1.570
  268    H    THR  39           HN       THR  39 -13.684  20.571  -0.435
  269    HA   THR  39           HA       THR  39 -14.663  18.340   1.107
  270    HB   THR  39           HB       THR  39 -12.529  18.458   2.297
  271    HG1  THR  39           HG1      THR  39 -12.024  20.767   0.701
  272   HG21  THR  39          HG23      THR  39 -11.022  18.086   0.390
  273   HG22  THR  39          HG21      THR  39 -12.224  18.793  -0.690
  274   HG23  THR  39          HG22      THR  39 -12.576  17.287   0.158
  275    H    THR  40           HN       THR  40 -15.118  18.320   3.311
  276    HA   THR  40           HA       THR  40 -15.975  20.906   4.390
  277    HB   THR  40           HB       THR  40 -17.280  19.571   6.019
  278    HG1  THR  40           HG1      THR  40 -16.034  17.441   4.630
  279   HG21  THR  40          HG23      THR  40 -17.732  18.831   3.125
  280   HG22  THR  40          HG21      THR  40 -18.337  20.273   3.940
  281   HG23  THR  40          HG22      THR  40 -18.924  18.679   4.417
  282    H    GLY  41           HN       GLY  41 -13.232  19.316   4.435
  283    HA2  GLY  41           HA2      GLY  41 -11.946  20.515   6.462
  284    HA3  GLY  41           HA1      GLY  41 -12.741  19.185   7.292
  285    H    GLU  42           HN       GLU  42 -12.211  17.010   6.658
  286    HA   GLU  42           HA       GLU  42  -9.604  16.793   5.301
  287    HB2  GLU  42           HB2      GLU  42 -10.544  15.274   7.741
  288    HB3  GLU  42           HB1      GLU  42  -9.053  14.947   6.867
  289    HG2  GLU  42           HG2      GLU  42  -9.708  17.563   8.199
  290    HG3  GLU  42           HG1      GLU  42  -8.740  16.281   8.926
  291    H    ALA  43           HN       ALA  43  -9.433  15.271   3.757
  292    HA   ALA  43           HA       ALA  43 -11.048  12.922   3.669
  293    HB1  ALA  43           HB3      ALA  43 -11.679  15.071   1.649
  294    HB2  ALA  43           HB1      ALA  43 -12.738  14.535   2.953
  295    HB3  ALA  43           HB2      ALA  43 -12.317  13.426   1.648
  296    H    THR  44           HN       THR  44  -8.441  12.897   3.665
  297    HA   THR  44           HA       THR  44  -7.637  12.528   0.851
  298    HB   THR  44           HB       THR  44  -5.324  12.948   1.517
  299    HG1  THR  44           HG1      THR  44  -5.098  12.443   3.608
  300   HG21  THR  44          HG23      THR  44  -6.683  14.854   0.799
  301   HG22  THR  44          HG21      THR  44  -5.505  15.340   2.018
  302   HG23  THR  44          HG22      THR  44  -7.196  15.123   2.465
  303    H    GLY  45           HN       GLY  45  -6.268  10.736   0.370
  304    HA2  GLY  45           HA2      GLY  45  -5.864   8.732   2.446
  305    HA3  GLY  45           HA1      GLY  45  -6.956   8.284   1.145
  306    H    ILE  46           HN       ILE  46  -4.244   7.297   2.023
  307    HA   ILE  46           HA       ILE  46  -2.636   7.867  -0.352
  308    HB   ILE  46           HB       ILE  46  -1.917   6.146   2.025
  309   HG12  ILE  46          HG12      ILE  46  -2.340   8.461   2.729
  310   HG13  ILE  46          HG11      ILE  46  -0.627   8.072   2.835
  311   HG21  ILE  46          HG21      ILE  46  -0.618   5.644   0.043
  312   HG22  ILE  46          HG22      ILE  46   0.388   6.473   1.231
  313   HG23  ILE  46          HG23      ILE  46  -0.232   7.352  -0.166
  314   HD11  ILE  46          HD13      ILE  46  -1.946   9.651   0.638
  315   HD12  ILE  46          HD11      ILE  46  -0.229   9.263   0.743
  316   HD13  ILE  46          HD12      ILE  46  -0.973  10.305   1.955
  317    H    TYR  47           HN       TYR  47  -2.572   6.533  -2.046
  318    HA   TYR  47           HA       TYR  47  -3.050   3.686  -1.700
  319    HD1  TYR  47           HD1      TYR  47  -5.557   6.957  -2.127
  320    HD2  TYR  47           HD2      TYR  47  -4.420   4.757  -5.586
  321    HE1  TYR  47           HE1      TYR  47  -6.097   8.900  -3.534
  322    HE2  TYR  47           HE2      TYR  47  -4.955   6.693  -7.002
  323    HH   TYR  47           HH       TYR  47  -6.334   8.707  -6.927
  324    HB2  TYR  47           HB2      TYR  47  -4.776   3.634  -3.477
  325    HB3  TYR  47           HB1      TYR  47  -5.301   4.523  -2.050
  326    H    VAL  48           HN       VAL  48  -2.169   2.413  -3.302
  327    HA   VAL  48           HA       VAL  48  -0.173   3.692  -4.960
  328    HB   VAL  48           HB       VAL  48  -0.872   0.773  -4.601
  329   HG11  VAL  48          HG11      VAL  48   1.260   0.307  -5.725
  330   HG12  VAL  48          HG12      VAL  48   1.454   2.029  -6.055
  331   HG13  VAL  48          HG13      VAL  48   0.123   1.134  -6.789
  332   HG21  VAL  48          HG23      VAL  48   1.185   0.679  -3.285
  333   HG22  VAL  48          HG21      VAL  48   0.034   1.823  -2.595
  334   HG23  VAL  48          HG22      VAL  48   1.416   2.411  -3.520
  335    H    LYS  49           HN       LYS  49  -0.649   4.441  -6.909
  336    HA   LYS  49           HA       LYS  49  -2.971   3.441  -8.342
  337    HB2  LYS  49           HB2      LYS  49  -2.570   5.873  -8.147
  338    HB3  LYS  49           HB1      LYS  49  -1.073   5.683  -9.048
  339    HG2  LYS  49           HG2      LYS  49  -2.364   4.867 -10.979
  340    HG3  LYS  49           HG1      LYS  49  -3.852   5.139 -10.070
  341    HD2  LYS  49           HD2      LYS  49  -3.497   7.012 -11.527
  342    HD3  LYS  49           HD1      LYS  49  -3.215   7.537  -9.865
  343    HE2  LYS  49           HE2      LYS  49  -1.521   8.420 -11.403
  344    HE3  LYS  49           HE1      LYS  49  -0.813   7.352 -10.191
  345    HZ1  LYS  49           HZ3      LYS  49  -0.758   5.580 -11.820
  346    HZ2  LYS  49           HZ1      LYS  49   0.075   6.932 -12.406
  347    HZ3  LYS  49           HZ2      LYS  49  -1.475   6.578 -12.982
  348    H    SER  50           HN       SER  50   0.528   3.370  -8.565
  349    HA   SER  50           HA       SER  50   0.325   1.333 -10.631
  350    HG   SER  50           HG       SER  50   1.572   2.024 -13.101
  351    HB2  SER  50           HB2      SER  50   0.441   3.394 -11.945
  352    HB3  SER  50           HB1      SER  50   1.898   3.881 -11.078
  353    H    LEU  51           HN       LEU  51   2.535   0.449 -11.185
  354    HA   LEU  51           HA       LEU  51   4.321   0.552  -8.842
  355    HG   LEU  51           HG       LEU  51   1.838  -1.303  -8.840
  356    HB2  LEU  51           HB2      LEU  51   3.605  -1.875 -10.495
  357    HB3  LEU  51           HB1      LEU  51   4.786  -1.844  -9.200
  358   HD11  LEU  51          HD11      LEU  51   2.233  -3.617  -9.485
  359   HD12  LEU  51          HD12      LEU  51   1.767  -3.511  -7.787
  360   HD13  LEU  51          HD13      LEU  51   3.456  -3.772  -8.224
  361   HD21  LEU  51          HD23      LEU  51   2.343  -1.520  -6.457
  362   HD22  LEU  51          HD21      LEU  51   3.237  -0.186  -7.185
  363   HD23  LEU  51          HD22      LEU  51   4.054  -1.708  -6.835
  364    H    ILE  52           HN       ILE  52   6.536  -0.396  -9.407
  365    HA   ILE  52           HA       ILE  52   7.347   0.680 -12.023
  366    HB   ILE  52           HB       ILE  52   9.004   0.303  -9.525
  367   HG12  ILE  52          HG12      ILE  52   7.396   2.135  -9.311
  368   HG13  ILE  52          HG11      ILE  52   9.033   2.765  -9.446
  369   HG21  ILE  52          HG21      ILE  52   9.729   1.499 -12.197
  370   HG22  ILE  52          HG22      ILE  52  10.364   0.008 -11.500
  371   HG23  ILE  52          HG23      ILE  52  10.736   1.560 -10.750
  372   HD11  ILE  52          HD13      ILE  52   6.972   2.675 -11.639
  373   HD12  ILE  52          HD11      ILE  52   8.624   3.270 -11.813
  374   HD13  ILE  52          HD12      ILE  52   7.496   4.102 -10.742
  375    HA   PRO  53           HA       PRO  53   7.786  -3.792 -12.913
  376    HB2  PRO  53           HB2      PRO  53   8.761  -2.531 -15.433
  377    HB3  PRO  53           HB1      PRO  53   7.634  -3.874 -15.210
  378    HG2  PRO  53           HG2      PRO  53   6.739  -1.460 -15.873
  379    HG3  PRO  53           HG1      PRO  53   5.853  -2.470 -14.715
  380    HD2  PRO  53           HD2      PRO  53   7.580  -0.088 -14.220
  381    HD3  PRO  53           HD1      PRO  53   6.102  -0.606 -13.385
  382    H    GLY  54           HN       GLY  54   9.513  -4.713 -11.999
  383    HA2  GLY  54           HA2      GLY  54  11.786  -5.482 -12.422
  384    HA3  GLY  54           HA1      GLY  54  12.184  -3.840 -12.907
  385    H    SER  55           HN       SER  55  10.161  -3.650 -10.297
  386    HA   SER  55           HA       SER  55  12.430  -3.196  -8.499
  387    HG   SER  55           HG       SER  55  11.807  -1.208  -9.408
  388    HB2  SER  55           HB2      SER  55   9.547  -2.304  -8.277
  389    HB3  SER  55           HB1      SER  55  10.827  -1.904  -7.132
  390    H    ALA  56           HN       ALA  56  11.790  -3.577  -6.086
  391    HA   ALA  56           HA       ALA  56  11.578  -6.334  -5.686
  392    HB1  ALA  56           HB3      ALA  56  11.048  -4.142  -3.684
  393    HB2  ALA  56           HB1      ALA  56  12.634  -4.801  -4.090
  394    HB3  ALA  56           HB2      ALA  56  11.425  -5.826  -3.317
  395    H    ALA  57           HN       ALA  57   9.166  -3.818  -4.917
  396    HA   ALA  57           HA       ALA  57   7.109  -5.484  -4.094
  397    HB1  ALA  57           HB3      ALA  57   7.109  -3.038  -3.838
  398    HB2  ALA  57           HB1      ALA  57   5.607  -3.639  -4.541
  399    HB3  ALA  57           HB2      ALA  57   6.816  -2.872  -5.570
  400    H    ALA  58           HN       ALA  58   8.130  -4.631  -7.339
  401    HA   ALA  58           HA       ALA  58   5.811  -5.772  -8.608
  402    HB1  ALA  58           HB3      ALA  58   8.438  -4.893  -9.799
  403    HB2  ALA  58           HB1      ALA  58   6.991  -3.899  -9.633
  404    HB3  ALA  58           HB2      ALA  58   6.977  -5.303 -10.700
  405    H    LEU  59           HN       LEU  59   8.941  -6.892  -7.611
  406    HA   LEU  59           HA       LEU  59   9.084  -9.154  -9.332
  407    HG   LEU  59           HG       LEU  59  11.296  -7.392  -8.968
  408    HB2  LEU  59           HB2      LEU  59  10.495  -8.345  -6.816
  409    HB3  LEU  59           HB1      LEU  59  10.719  -9.952  -7.475
  410   HD11  LEU  59          HD11      LEU  59  13.165  -9.319  -7.600
  411   HD12  LEU  59          HD12      LEU  59  12.835  -7.656  -7.117
  412   HD13  LEU  59          HD13      LEU  59  13.657  -7.984  -8.642
  413   HD21  LEU  59          HD23      LEU  59  10.715  -9.233 -10.443
  414   HD22  LEU  59          HD21      LEU  59  11.885 -10.274  -9.633
  415   HD23  LEU  59          HD22      LEU  59  12.438  -8.876 -10.554
  416    H    ASP  60           HN       ASP  60   7.799  -8.618  -6.094
  417    HA   ASP  60           HA       ASP  60   7.362 -11.305  -5.403
  418    HB2  ASP  60           HB2      ASP  60   5.937  -8.784  -4.540
  419    HB3  ASP  60           HB1      ASP  60   5.633 -10.365  -3.827
  420    H    GLY  61           HN       GLY  61   5.350  -8.979  -7.143
  421    HA2  GLY  61           HA2      GLY  61   3.695  -9.408  -8.707
  422    HA3  GLY  61           HA1      GLY  61   3.920 -11.127  -8.424
  423    H    ARG  62           HN       ARG  62   3.580 -10.276  -5.424
  424    HA   ARG  62           HA       ARG  62   0.811 -10.989  -5.306
  425    HE   ARG  62           HE       ARG  62   1.101 -11.902  -1.331
  426    HB2  ARG  62           HB2      ARG  62   2.780 -10.168  -3.167
  427    HB3  ARG  62           HB1      ARG  62   1.129 -10.672  -2.832
  428    HG2  ARG  62           HG2      ARG  62   1.573 -12.861  -3.759
  429    HG3  ARG  62           HG1      ARG  62   3.205 -12.364  -4.207
  430    HD2  ARG  62           HD2      ARG  62   3.140 -13.693  -2.127
  431    HD3  ARG  62           HD1      ARG  62   3.803 -12.076  -1.889
  432   HH11  ARG  62          HH11      ARG  62   3.861 -13.636  -0.100
  433   HH12  ARG  62          HH12      ARG  62   3.253 -13.715   1.520
  434   HH21  ARG  62          HH21      ARG  62   0.291 -12.000   0.800
  435   HH22  ARG  62          HH22      ARG  62   1.223 -12.785   2.031
  436    H    ILE  63           HN       ILE  63   2.577  -8.032  -5.355
  437    HA   ILE  63           HA       ILE  63   0.437  -6.460  -4.203
  438    HB   ILE  63           HB       ILE  63   3.024  -5.623  -5.522
  439   HG12  ILE  63          HG12      ILE  63   3.467  -4.854  -3.099
  440   HG13  ILE  63          HG11      ILE  63   2.125  -5.905  -2.661
  441   HG21  ILE  63          HG21      ILE  63   0.918  -3.946  -4.167
  442   HG22  ILE  63          HG22      ILE  63   1.400  -3.881  -5.863
  443   HG23  ILE  63          HG23      ILE  63   2.528  -3.375  -4.605
  444   HD11  ILE  63          HD13      ILE  63   4.296  -6.984  -2.360
  445   HD12  ILE  63          HD11      ILE  63   4.630  -6.780  -4.079
  446   HD13  ILE  63          HD12      ILE  63   3.306  -7.821  -3.555
  447    H    GLU  64           HN       GLU  64  -1.281  -5.842  -5.309
  448    HA   GLU  64           HA       GLU  64  -1.123  -5.726  -8.241
  449    HB2  GLU  64           HB2      GLU  64  -2.773  -7.302  -7.334
  450    HB3  GLU  64           HB1      GLU  64  -3.532  -5.999  -6.433
  451    HG2  GLU  64           HG2      GLU  64  -4.161  -4.903  -8.507
  452    HG3  GLU  64           HG1      GLU  64  -3.356  -6.170  -9.433
  453    HA   PRO  65           HA       PRO  65  -1.345  -1.294  -8.120
  454    HB2  PRO  65           HB2      PRO  65  -2.778  -0.949 -10.475
  455    HB3  PRO  65           HB1      PRO  65  -1.024  -1.111 -10.363
  456    HG2  PRO  65           HG2      PRO  65  -3.080  -3.169 -11.033
  457    HG3  PRO  65           HG1      PRO  65  -1.461  -2.931 -11.719
  458    HD2  PRO  65           HD2      PRO  65  -1.948  -4.875  -9.945
  459    HD3  PRO  65           HD1      PRO  65  -0.414  -3.978  -9.931
  460    H    ASN  66           HN       ASN  66  -2.913   0.447  -8.047
  461    HA   ASN  66           HA       ASN  66  -4.828   1.419  -7.319
  462    HB2  ASN  66           HB2      ASN  66  -6.136  -1.019  -8.544
  463    HB3  ASN  66           HB1      ASN  66  -6.981   0.440  -8.035
  464   HD21  ASN  66          HD21      ASN  66  -4.859  -0.978 -10.381
  465   HD22  ASN  66          HD22      ASN  66  -4.948   0.299 -11.540
  466    H    ASP  67           HN       ASP  67  -3.409   0.107  -5.407
  467    HA   ASP  67           HA       ASP  67  -5.453  -1.244  -3.770
  468    HB2  ASP  67           HB2      ASP  67  -3.566  -2.157  -2.457
  469    HB3  ASP  67           HB1      ASP  67  -3.480  -2.627  -4.152
  470    H    LYS  68           HN       LYS  68  -5.249  -0.824  -1.380
  471    HA   LYS  68           HA       LYS  68  -4.663   2.026  -0.936
  472    HB2  LYS  68           HB2      LYS  68  -7.052   1.417  -0.779
  473    HB3  LYS  68           HB1      LYS  68  -6.663   0.272   0.495
  474    HG2  LYS  68           HG2      LYS  68  -5.911   2.083   1.926
  475    HG3  LYS  68           HG1      LYS  68  -6.236   3.248   0.640
  476    HD2  LYS  68           HD2      LYS  68  -8.614   2.603   0.692
  477    HD3  LYS  68           HD1      LYS  68  -8.268   1.496   2.023
  478    HE2  LYS  68           HE2      LYS  68  -7.526   3.370   3.395
  479    HE3  LYS  68           HE1      LYS  68  -7.835   4.480   2.062
  480    HZ1  LYS  68           HZ3      LYS  68  -9.877   2.836   3.461
  481    HZ2  LYS  68           HZ1      LYS  68 -10.181   3.882   2.166
  482    HZ3  LYS  68           HZ2      LYS  68  -9.648   4.502   3.647
  483    H    ILE  69           HN       ILE  69  -2.746   2.181   0.048
  484    HA   ILE  69           HA       ILE  69  -1.614   0.189   1.711
  485    HB   ILE  69           HB       ILE  69  -0.894   3.122   1.585
  486   HG12  ILE  69          HG12      ILE  69  -0.826   2.067  -0.638
  487   HG13  ILE  69          HG11      ILE  69   0.790   2.468  -0.069
  488   HG21  ILE  69          HG21      ILE  69   1.299   2.394   2.383
  489   HG22  ILE  69          HG22      ILE  69   0.710   0.735   2.492
  490   HG23  ILE  69          HG23      ILE  69   0.025   1.984   3.533
  491   HD11  ILE  69          HD13      ILE  69  -0.465  -0.266   0.013
  492   HD12  ILE  69          HD11      ILE  69   1.170   0.146   0.529
  493   HD13  ILE  69          HD12      ILE  69   0.718   0.294  -1.168
  494    H    LEU  70           HN       LEU  70  -1.632  -0.085   3.895
  495    HA   LEU  70           HA       LEU  70  -3.327   1.770   5.430
  496    HG   LEU  70           HG       LEU  70  -4.483  -0.737   4.091
  497    HB2  LEU  70           HB2      LEU  70  -2.813  -1.171   5.867
  498    HB3  LEU  70           HB1      LEU  70  -3.731  -0.151   6.958
  499   HD11  LEU  70          HD11      LEU  70  -6.271  -2.093   5.055
  500   HD12  LEU  70          HD12      LEU  70  -5.629  -1.797   6.671
  501   HD13  LEU  70          HD13      LEU  70  -4.682  -2.714   5.501
  502   HD21  LEU  70          HD23      LEU  70  -5.957   0.722   6.282
  503   HD22  LEU  70          HD21      LEU  70  -6.622   0.305   4.702
  504   HD23  LEU  70          HD22      LEU  70  -5.276   1.438   4.821
  505    H    ARG  71           HN       ARG  71  -0.913  -0.704   6.328
  506    HA   ARG  71           HA       ARG  71   0.591   1.383   7.745
  507    HE   ARG  71           HE       ARG  71   0.048   0.498  11.760
  508    HB2  ARG  71           HB2      ARG  71  -0.098  -1.303   8.946
  509    HB3  ARG  71           HB1      ARG  71   0.815  -0.013   9.716
  510    HG2  ARG  71           HG2      ARG  71  -1.131   1.396   9.784
  511    HG3  ARG  71           HG1      ARG  71  -2.064   0.211   8.866
  512    HD2  ARG  71           HD2      ARG  71  -2.618   0.049  11.213
  513    HD3  ARG  71           HD1      ARG  71  -1.762  -1.406  10.701
  514   HH11  ARG  71          HH11      ARG  71  -2.394  -1.801  12.710
  515   HH12  ARG  71          HH12      ARG  71  -1.710  -2.072  14.278
  516   HH21  ARG  71          HH21      ARG  71   0.954   0.145  13.819
  517   HH22  ARG  71          HH22      ARG  71   0.194  -0.967  14.908
  518    H    VAL  72           HN       VAL  72   2.756   1.193   7.674
  519    HA   VAL  72           HA       VAL  72   3.858  -1.041   6.130
  520    HB   VAL  72           HB       VAL  72   5.318   1.476   6.931
  521   HG11  VAL  72          HG11      VAL  72   6.669   0.955   4.922
  522   HG12  VAL  72          HG12      VAL  72   5.756  -0.542   4.735
  523   HG13  VAL  72          HG13      VAL  72   6.759  -0.294   6.164
  524   HG21  VAL  72          HG23      VAL  72   3.298   2.134   5.743
  525   HG22  VAL  72          HG21      VAL  72   3.688   1.017   4.436
  526   HG23  VAL  72          HG22      VAL  72   4.727   2.408   4.747
  527    H    ASP  73           HN       ASP  73   6.120  -1.735   6.846
  528    HA   ASP  73           HA       ASP  73   6.069  -3.003   9.262
  529    HB2  ASP  73           HB2      ASP  73   7.714  -3.337   7.376
  530    HB3  ASP  73           HB1      ASP  73   8.609  -1.962   8.011
  531    H    ASP  74           HN       ASP  74   5.689  -2.105  11.178
  532    HA   ASP  74           HA       ASP  74   5.915  -0.856  13.058
  533    HB2  ASP  74           HB2      ASP  74   8.228  -1.746  12.892
  534    HB3  ASP  74           HB1      ASP  74   8.692  -0.295  12.008
  535    H    VAL  75           HN       VAL  75   5.562   0.534  10.174
  536    HA   VAL  75           HA       VAL  75   5.389   3.210  11.361
  537    HB   VAL  75           HB       VAL  75   6.572   2.731   8.623
  538   HG11  VAL  75          HG11      VAL  75   7.088   5.124   8.696
  539   HG12  VAL  75          HG12      VAL  75   6.271   5.249  10.254
  540   HG13  VAL  75          HG13      VAL  75   5.353   4.829   8.808
  541   HG21  VAL  75          HG23      VAL  75   8.134   1.997  10.330
  542   HG22  VAL  75          HG21      VAL  75   7.937   3.522  11.195
  543   HG23  VAL  75          HG22      VAL  75   8.693   3.503   9.601
  544    H    ASN  76           HN       ASN  76   3.197   3.360  11.362
  545    HA   ASN  76           HA       ASN  76   1.567   2.433   9.202
  546    HB2  ASN  76           HB2      ASN  76  -0.281   3.525  10.426
  547    HB3  ASN  76           HB1      ASN  76   0.690   2.504  11.483
  548   HD21  ASN  76          HD21      ASN  76   2.035   3.461  13.017
  549   HD22  ASN  76          HD22      ASN  76   1.837   5.106  13.503
  550    H    VAL  77           HN       VAL  77   0.256   3.753   7.801
  551    HA   VAL  77           HA       VAL  77   1.353   6.456   7.365
  552    HB   VAL  77           HB       VAL  77   1.075   6.150   4.947
  553   HG11  VAL  77          HG11      VAL  77   2.799   4.061   6.271
  554   HG12  VAL  77          HG12      VAL  77   3.252   5.727   5.912
  555   HG13  VAL  77          HG13      VAL  77   2.953   4.592   4.596
  556   HG21  VAL  77          HG23      VAL  77  -0.708   4.467   5.024
  557   HG22  VAL  77          HG21      VAL  77   0.451   3.278   5.623
  558   HG23  VAL  77          HG22      VAL  77   0.636   3.953   4.004
  559    H    GLN  78           HN       GLN  78  -1.063   5.565   8.805
  560    HA   GLN  78           HA       GLN  78  -3.224   6.491   7.072
  561    HB2  GLN  78           HB2      GLN  78  -3.291   5.407   9.894
  562    HB3  GLN  78           HB1      GLN  78  -4.703   5.821   8.932
  563    HG2  GLN  78           HG2      GLN  78  -2.688   3.674   8.309
  564    HG3  GLN  78           HG1      GLN  78  -4.323   3.431   8.920
  565   HE21  GLN  78          HE21      GLN  78  -6.076   3.749   7.544
  566   HE22  GLN  78          HE22      GLN  78  -5.894   3.822   5.827
  567    H    GLY  79           HN       GLY  79  -1.350   8.461   7.652
  568    HA2  GLY  79           HA2      GLY  79  -2.863  10.625   8.380
  569    HA3  GLY  79           HA1      GLY  79  -2.191  10.044   9.894
  570    H    MET  80           HN       MET  80  -0.523   9.881   6.800
  571    HA   MET  80           HA       MET  80   1.246  12.059   7.681
  572    HB2  MET  80           HB2      MET  80   2.159   9.432   6.497
  573    HB3  MET  80           HB1      MET  80   3.198  10.789   6.911
  574    HG2  MET  80           HG2      MET  80   2.378  10.533   9.283
  575    HG3  MET  80           HG1      MET  80   1.653   9.010   8.770
  576    HE1  MET  80           HE3      MET  80   3.946   8.156   6.567
  577    HE2  MET  80           HE1      MET  80   3.104   7.042   7.641
  578    HE3  MET  80           HE2      MET  80   4.865   7.040   7.576
  579    H    ALA  81           HN       ALA  81   2.347  13.177   6.013
  580    HA   ALA  81           HA       ALA  81   0.800  13.626   3.698
  581    HB1  ALA  81           HB3      ALA  81   2.617  15.113   3.005
  582    HB2  ALA  81           HB1      ALA  81   3.638  14.461   4.284
  583    HB3  ALA  81           HB2      ALA  81   2.181  15.365   4.695
  584    H    GLN  82           HN       GLN  82   1.348  13.294   1.484
  585    HA   GLN  82           HA       GLN  82   2.062  10.712   0.805
  586    HB2  GLN  82           HB2      GLN  82   0.842  12.314  -0.660
  587    HB3  GLN  82           HB1      GLN  82   2.362  13.147  -0.957
  588    HG2  GLN  82           HG2      GLN  82   3.280  11.147  -1.984
  589    HG3  GLN  82           HG1      GLN  82   1.785  10.277  -1.650
  590   HE21  GLN  82          HE21      GLN  82   3.092  10.806  -4.192
  591   HE22  GLN  82          HE22      GLN  82   1.940  11.652  -5.160
  592    H    SER  83           HN       SER  83   4.077  13.629   0.428
  593    HA   SER  83           HA       SER  83   6.383  12.412  -0.495
  594    HG   SER  83           HG       SER  83   8.269  13.778  -0.228
  595    HB2  SER  83           HB2      SER  83   6.089  14.837  -0.476
  596    HB3  SER  83           HB1      SER  83   6.144  14.846   1.287
  597    H    ASP  84           HN       ASP  84   5.291  12.859   2.835
  598    HA   ASP  84           HA       ASP  84   7.642  12.010   4.120
  599    HB2  ASP  84           HB2      ASP  84   5.798  13.184   5.270
  600    HB3  ASP  84           HB1      ASP  84   4.787  11.755   5.086
  601    H    VAL  85           HN       VAL  85   4.745  10.206   3.137
  602    HA   VAL  85           HA       VAL  85   5.445   7.718   4.183
  603    HB   VAL  85           HB       VAL  85   3.854   8.290   1.677
  604   HG11  VAL  85          HG11      VAL  85   4.560   5.977   1.734
  605   HG12  VAL  85          HG12      VAL  85   2.837   6.081   2.095
  606   HG13  VAL  85          HG13      VAL  85   3.998   5.817   3.398
  607   HG21  VAL  85          HG23      VAL  85   2.979   9.405   3.688
  608   HG22  VAL  85          HG21      VAL  85   2.916   7.847   4.511
  609   HG23  VAL  85          HG22      VAL  85   1.895   8.143   3.102
  610    H    VAL  86           HN       VAL  86   6.351   9.268   1.155
  611    HA   VAL  86           HA       VAL  86   7.531   7.008  -0.066
  612    HB   VAL  86           HB       VAL  86   8.162   9.934  -0.496
  613   HG11  VAL  86          HG11      VAL  86   9.926   8.520  -1.371
  614   HG12  VAL  86          HG12      VAL  86   8.984   9.200  -2.699
  615   HG13  VAL  86          HG13      VAL  86   8.740   7.522  -2.213
  616   HG21  VAL  86          HG23      VAL  86   5.806   9.437  -0.860
  617   HG22  VAL  86          HG21      VAL  86   6.238   8.106  -1.932
  618   HG23  VAL  86          HG22      VAL  86   6.616   9.765  -2.392
  619    H    GLU  87           HN       GLU  87   8.859   9.600   1.958
  620    HA   GLU  87           HA       GLU  87  11.557   8.925   1.777
  621    HB2  GLU  87           HB2      GLU  87  10.061  10.104   4.128
  622    HB3  GLU  87           HB1      GLU  87  11.811  10.089   3.950
  623    HG2  GLU  87           HG2      GLU  87  11.647  11.485   1.974
  624    HG3  GLU  87           HG1      GLU  87   9.888  11.464   2.086
  625    H    VAL  88           HN       VAL  88   9.017   7.675   3.880
  626    HA   VAL  88           HA       VAL  88  10.630   6.113   5.568
  627    HB   VAL  88           HB       VAL  88   7.754   5.761   4.723
  628   HG11  VAL  88          HG11      VAL  88   9.290   4.292   6.865
  629   HG12  VAL  88          HG12      VAL  88   8.607   3.597   5.392
  630   HG13  VAL  88          HG13      VAL  88   7.540   4.232   6.647
  631   HG21  VAL  88          HG23      VAL  88   8.996   6.834   7.254
  632   HG22  VAL  88          HG21      VAL  88   7.269   6.658   6.948
  633   HG23  VAL  88          HG22      VAL  88   8.224   7.791   5.991
  634    H    LEU  89           HN       LEU  89   8.778   5.163   2.677
  635    HA   LEU  89           HA       LEU  89   9.492   2.498   2.576
  636    HG   LEU  89           HG       LEU  89   7.113   4.333   1.793
  637    HB2  LEU  89           HB2      LEU  89   9.055   4.358   0.237
  638    HB3  LEU  89           HB1      LEU  89   8.988   2.608   0.175
  639   HD11  LEU  89          HD11      LEU  89   6.776   4.697  -0.585
  640   HD12  LEU  89          HD12      LEU  89   5.444   3.763   0.094
  641   HD13  LEU  89          HD13      LEU  89   6.692   2.957  -0.856
  642   HD21  LEU  89          HD23      LEU  89   7.402   2.112   2.730
  643   HD22  LEU  89          HD21      LEU  89   7.088   1.386   1.154
  644   HD23  LEU  89          HD22      LEU  89   5.808   2.262   1.991
  645    H    ARG  90           HN       ARG  90  11.331   5.318   1.665
  646    HA   ARG  90           HA       ARG  90  13.382   3.751   0.339
  647    HE   ARG  90           HE       ARG  90  12.122   8.447  -0.293
  648    HB2  ARG  90           HB2      ARG  90  13.199   6.703   0.956
  649    HB3  ARG  90           HB1      ARG  90  14.509   5.954   0.053
  650    HG2  ARG  90           HG2      ARG  90  12.829   5.166  -1.604
  651    HG3  ARG  90           HG1      ARG  90  11.610   6.102  -0.738
  652    HD2  ARG  90           HD2      ARG  90  14.127   7.231  -1.957
  653    HD3  ARG  90           HD1      ARG  90  12.528   7.293  -2.696
  654   HH11  ARG  90          HH11      ARG  90  14.477   8.972  -2.806
  655   HH12  ARG  90          HH12      ARG  90  14.651  10.662  -2.469
  656   HH21  ARG  90          HH21      ARG  90  12.342  10.671   0.159
  657   HH22  ARG  90          HH22      ARG  90  13.438  11.628  -0.782
  658    H    ASN  91           HN       ASN  91  12.774   5.146   3.461
  659    HA   ASN  91           HA       ASN  91  15.507   5.032   4.342
  660    HB2  ASN  91           HB2      ASN  91  12.907   5.450   5.820
  661    HB3  ASN  91           HB1      ASN  91  14.480   5.445   6.613
  662   HD21  ASN  91          HD21      ASN  91  12.510   7.581   6.376
  663   HD22  ASN  91          HD22      ASN  91  13.326   8.901   5.618
  664    H    ALA  92           HN       ALA  92  13.070   2.745   3.903
  665    HA   ALA  92           HA       ALA  92  13.271   0.985   6.001
  666    HB1  ALA  92           HB3      ALA  92  13.068   0.273   3.076
  667    HB2  ALA  92           HB1      ALA  92  11.722   0.686   4.139
  668    HB3  ALA  92           HB2      ALA  92  12.656  -0.782   4.428
  669    H    GLY  93           HN       GLY  93  14.949   0.135   2.986
  670    HA2  GLY  93           HA2      GLY  93  17.045  -0.738   2.613
  671    HA3  GLY  93           HA1      GLY  93  17.552   0.056   4.097
  672    H    ASN  94           HN       ASN  94  14.912  -1.965   4.594
  673    HA   ASN  94           HA       ASN  94  16.496  -4.353   5.120
  674    HB2  ASN  94           HB2      ASN  94  15.371  -4.401   7.469
  675    HB3  ASN  94           HB1      ASN  94  16.795  -3.394   7.231
  676   HD21  ASN  94          HD21      ASN  94  13.593  -2.618   6.035
  677   HD22  ASN  94          HD22      ASN  94  13.334  -1.257   7.064
  678    HA   PRO  95           HA       PRO  95  12.803  -6.587   4.100
  679    HB2  PRO  95           HB2      PRO  95  12.418  -8.306   6.221
  680    HB3  PRO  95           HB1      PRO  95  13.558  -8.589   4.902
  681    HG2  PRO  95           HG2      PRO  95  14.059  -7.489   7.638
  682    HG3  PRO  95           HG1      PRO  95  15.028  -8.641   6.698
  683    HD2  PRO  95           HD2      PRO  95  15.732  -6.066   6.896
  684    HD3  PRO  95           HD1      PRO  95  15.965  -6.970   5.386
  685    H    VAL  96           HN       VAL  96  11.163  -5.103   4.148
  686    HA   VAL  96           HA       VAL  96   9.870  -4.576   6.737
  687    HB   VAL  96           HB       VAL  96   8.816  -2.632   5.618
  688   HG11  VAL  96          HG11      VAL  96  10.848  -2.324   6.906
  689   HG12  VAL  96          HG12      VAL  96  10.850  -1.253   5.504
  690   HG13  VAL  96          HG13      VAL  96  11.828  -2.721   5.495
  691   HG21  VAL  96          HG23      VAL  96   9.684  -1.893   3.441
  692   HG22  VAL  96          HG21      VAL  96   8.854  -3.444   3.323
  693   HG23  VAL  96          HG22      VAL  96  10.616  -3.384   3.315
  694    H    ARG  97           HN       ARG  97   7.664  -4.780   6.986
  695    HA   ARG  97           HA       ARG  97   6.364  -6.596   5.121
  696    HE   ARG  97           HE       ARG  97   5.209  -8.289   8.948
  697    HB2  ARG  97           HB2      ARG  97   6.298  -7.130   7.525
  698    HB3  ARG  97           HB1      ARG  97   5.484  -5.603   7.842
  699    HG2  ARG  97           HG2      ARG  97   3.668  -6.446   6.252
  700    HG3  ARG  97           HG1      ARG  97   4.429  -8.028   6.432
  701    HD2  ARG  97           HD2      ARG  97   3.383  -6.316   8.683
  702    HD3  ARG  97           HD1      ARG  97   2.564  -7.717   7.996
  703   HH11  ARG  97          HH11      ARG  97   1.855  -7.996   9.843
  704   HH12  ARG  97          HH12      ARG  97   1.994  -9.050  11.210
  705   HH21  ARG  97          HH21      ARG  97   5.403  -9.679  10.746
  706   HH22  ARG  97          HH22      ARG  97   4.012 -10.004  11.726
  707    H    LEU  98           HN       LEU  98   4.481  -6.123   4.042
  708    HA   LEU  98           HA       LEU  98   3.681  -3.288   4.064
  709    HG   LEU  98           HG       LEU  98   5.875  -4.572   2.186
  710    HB2  LEU  98           HB2      LEU  98   3.529  -5.247   1.778
  711    HB3  LEU  98           HB1      LEU  98   3.069  -3.559   1.719
  712   HD11  LEU  98          HD11      LEU  98   5.108  -5.050  -0.075
  713   HD12  LEU  98          HD12      LEU  98   6.321  -3.771  -0.077
  714   HD13  LEU  98          HD13      LEU  98   4.616  -3.367  -0.273
  715   HD21  LEU  98          HD23      LEU  98   5.499  -2.419   3.238
  716   HD22  LEU  98          HD21      LEU  98   4.807  -1.787   1.744
  717   HD23  LEU  98          HD22      LEU  98   6.512  -2.229   1.806
  718    H    LEU  99           HN       LEU  99   1.894  -3.225   5.305
  719    HA   LEU  99           HA       LEU  99  -0.164  -5.277   4.936
  720    HG   LEU  99           HG       LEU  99  -2.234  -3.636   6.744
  721    HB2  LEU  99           HB2      LEU  99   0.492  -4.852   7.233
  722    HB3  LEU  99           HB1      LEU  99   0.168  -3.141   7.043
  723   HD11  LEU  99          HD11      LEU  99  -3.079  -5.871   7.249
  724   HD12  LEU  99          HD12      LEU  99  -1.425  -6.472   7.375
  725   HD13  LEU  99          HD13      LEU  99  -2.035  -5.885   5.827
  726   HD21  LEU  99          HD23      LEU  99  -1.034  -4.799   9.256
  727   HD22  LEU  99          HD21      LEU  99  -2.693  -4.231   9.064
  728   HD23  LEU  99          HD22      LEU  99  -1.353  -3.090   8.958
  729    H    LEU 100           HN       LEU 100  -1.675  -4.862   3.480
  730    HA   LEU 100           HA       LEU 100  -2.916  -2.230   3.408
  731    HG   LEU 100           HG       LEU 100  -0.251  -3.874   1.691
  732    HB2  LEU 100           HB2      LEU 100  -2.787  -2.500   0.788
  733    HB3  LEU 100           HB1      LEU 100  -1.508  -1.712   1.694
  734   HD11  LEU 100          HD11      LEU 100  -2.376  -4.718  -0.272
  735   HD12  LEU 100          HD12      LEU 100  -2.148  -5.376   1.348
  736   HD13  LEU 100          HD13      LEU 100  -0.906  -5.608   0.119
  737   HD21  LEU 100          HD23      LEU 100   0.429  -3.718  -0.672
  738   HD22  LEU 100          HD21      LEU 100   0.310  -2.143   0.109
  739   HD23  LEU 100          HD22      LEU 100  -0.965  -2.683  -0.983
  740    H    ILE 101           HN       ILE 101  -4.836  -2.221   1.914
  741    HA   ILE 101           HA       ILE 101  -6.175  -4.846   1.998
  742    HB   ILE 101           HB       ILE 101  -7.195  -3.282   3.560
  743   HG12  ILE 101          HG12      ILE 101  -8.908  -3.668   1.092
  744   HG13  ILE 101          HG11      ILE 101  -8.652  -4.869   2.352
  745   HG21  ILE 101          HG21      ILE 101  -7.614  -1.496   1.170
  746   HG22  ILE 101          HG22      ILE 101  -6.481  -1.209   2.490
  747   HG23  ILE 101          HG23      ILE 101  -8.217  -1.201   2.800
  748   HD11  ILE 101          HD13      ILE 101 -10.794  -3.793   2.624
  749   HD12  ILE 101          HD11      ILE 101 -10.019  -2.209   2.678
  750   HD13  ILE 101          HD12      ILE 101  -9.732  -3.377   3.968
  751    H    ARG 102           HN       ARG 102  -7.223  -5.560   0.201
  752    HA   ARG 102           HA       ARG 102  -7.895  -3.874  -1.999
  753    HE   ARG 102           HE       ARG 102  -6.674  -4.559  -6.598
  754    HB2  ARG 102           HB2      ARG 102  -5.522  -3.918  -2.442
  755    HB3  ARG 102           HB1      ARG 102  -5.477  -5.665  -2.275
  756    HG2  ARG 102           HG2      ARG 102  -5.366  -5.102  -4.595
  757    HG3  ARG 102           HG1      ARG 102  -6.927  -5.857  -4.268
  758    HD2  ARG 102           HD2      ARG 102  -7.989  -3.666  -4.209
  759    HD3  ARG 102           HD1      ARG 102  -6.429  -2.889  -4.480
  760   HH11  ARG 102          HH11      ARG 102  -8.735  -2.104  -5.228
  761   HH12  ARG 102          HH12      ARG 102  -9.458  -1.684  -6.744
  762   HH21  ARG 102          HH21      ARG 102  -7.615  -4.010  -8.596
  763   HH22  ARG 102          HH22      ARG 102  -8.820  -2.767  -8.662
  764    H    ARG 103           HN       ARG 103  -9.348  -4.837  -3.325
  765    HA   ARG 103           HA       ARG 103 -10.620  -7.181  -2.450
  766    HE   ARG 103           HE       ARG 103 -12.576  -6.777  -6.608
  767    HB2  ARG 103           HB2      ARG 103 -11.908  -7.002  -4.586
  768    HB3  ARG 103           HB1      ARG 103 -11.881  -5.522  -3.638
  769    HG2  ARG 103           HG2      ARG 103 -10.108  -4.642  -5.095
  770    HG3  ARG 103           HG1      ARG 103 -10.201  -6.111  -6.068
  771    HD2  ARG 103           HD2      ARG 103 -12.445  -4.145  -5.615
  772    HD3  ARG 103           HD1      ARG 103 -11.468  -4.273  -7.077
  773   HH11  ARG 103          HH11      ARG 103 -13.672  -3.551  -7.344
  774   HH12  ARG 103          HH12      ARG 103 -15.086  -4.085  -8.188
  775   HH21  ARG 103          HH21      ARG 103 -14.438  -7.489  -7.716
  776   HH22  ARG 103          HH22      ARG 103 -15.523  -6.323  -8.398
  777    H    LEU 104           HN       LEU 104 -10.718  -9.238  -3.276
  778    HA   LEU 104           HA       LEU 104  -8.412 -10.043  -4.909
  779    HG   LEU 104           HG       LEU 104  -8.655  -9.898  -2.019
  780    HB2  LEU 104           HB2      LEU 104 -10.143 -11.807  -3.184
  781    HB3  LEU 104           HB1      LEU 104  -8.585 -12.199  -3.886
  782   HD11  LEU 104          HD11      LEU 104  -8.490 -11.415  -0.074
  783   HD12  LEU 104          HD12      LEU 104  -8.962 -12.757  -1.118
  784   HD13  LEU 104          HD13      LEU 104 -10.083 -11.425  -0.831
  785   HD21  LEU 104          HD23      LEU 104  -6.773 -12.217  -2.449
  786   HD22  LEU 104          HD21      LEU 104  -6.503 -10.871  -1.342
  787   HD23  LEU 104          HD22      LEU 104  -6.581 -10.581  -3.080
  788    HA   PRO 105           HA       PRO 105 -10.996 -11.322  -8.260
  789    HB2  PRO 105           HB2      PRO 105  -9.771 -13.619  -9.075
  790    HB3  PRO 105           HB1      PRO 105  -9.133 -12.005  -9.410
  791    HG2  PRO 105           HG2      PRO 105  -8.365 -13.933  -7.249
  792    HG3  PRO 105           HG1      PRO 105  -7.320 -12.947  -8.291
  793    HD2  PRO 105           HD2      PRO 105  -7.873 -12.220  -5.767
  794    HD3  PRO 105           HD1      PRO 105  -7.705 -11.021  -7.065
  795    H    LEU 106           HN       LEU 106 -12.271 -13.199  -9.100
  796    HA   LEU 106           HA       LEU 106 -12.932 -15.227  -7.110
  797    HG   LEU 106           HG       LEU 106 -13.776 -12.585  -6.070
  798    HB2  LEU 106           HB2      LEU 106 -14.897 -13.221  -8.207
  799    HB3  LEU 106           HB1      LEU 106 -15.389 -14.728  -7.458
  800   HD11  LEU 106          HD11      LEU 106 -15.854 -12.092  -4.859
  801   HD12  LEU 106          HD12      LEU 106 -16.720 -13.215  -5.906
  802   HD13  LEU 106          HD13      LEU 106 -15.996 -11.757  -6.584
  803   HD21  LEU 106          HD23      LEU 106 -15.154 -15.055  -5.021
  804   HD22  LEU 106          HD21      LEU 106 -14.339 -13.836  -4.043
  805   HD23  LEU 106          HD22      LEU 106 -13.412 -14.822  -5.173
  806    H    LEU 107           HN       LEU 107 -13.221 -17.143  -8.048
  807    HA   LEU 107           HA       LEU 107 -13.427 -17.259 -10.957
  808    HG   LEU 107           HG       LEU 107 -10.668 -19.610 -10.026
  809    HB2  LEU 107           HB2      LEU 107 -12.809 -19.349  -8.870
  810    HB3  LEU 107           HB1      LEU 107 -13.025 -19.729 -10.566
  811   HD11  LEU 107          HD11      LEU 107 -11.413 -17.180 -11.634
  812   HD12  LEU 107          HD12      LEU 107 -11.526 -18.834 -12.237
  813   HD13  LEU 107          HD13      LEU 107  -9.958 -18.169 -11.776
  814   HD21  LEU 107          HD23      LEU 107 -11.190 -16.753  -9.214
  815   HD22  LEU 107          HD21      LEU 107  -9.615 -17.541  -9.299
  816   HD23  LEU 107          HD22      LEU 107 -10.808 -18.082  -8.119
  817    H    GLU 108           HN       GLU 108 -14.842 -19.002 -11.890
  818    HA   GLU 108           HA       GLU 108 -17.324 -19.339 -10.346
  819    HB2  GLU 108           HB2      GLU 108 -17.609 -17.498 -11.963
  820    HB3  GLU 108           HB1      GLU 108 -17.154 -18.581 -13.270
  821    HG2  GLU 108           HG2      GLU 108 -19.550 -18.310 -13.198
  822    HG3  GLU 108           HG1      GLU 108 -19.114 -19.970 -12.794
  Start of MODEL   16
    1    H1   GLY   1           HT1      GLY   1 -12.379   0.138  19.166
    2    H2   GLY   1           HT2      GLY   1 -11.553  -0.925  18.144
    3    H3   GLY   1           HT3      GLY   1 -12.334  -1.515  19.523
    4    HA2  GLY   1           HA1      GLY   1 -14.485  -0.873  18.608
    5    HA3  GLY   1           HA2      GLY   1 -13.664  -0.291  17.167
    6    H    SER   2           HN       SER   2 -12.226  -1.980  16.091
    7    HA   SER   2           HA       SER   2 -13.053  -4.725  16.456
    8    HG   SER   2           HG       SER   2 -14.697  -5.779  14.252
    9    HB2  SER   2           HB2      SER   2 -14.869  -3.845  15.052
   10    HB3  SER   2           HB1      SER   2 -13.687  -3.271  13.876
   11    H    HIS   3           HN       HIS   3 -11.774  -2.911  13.675
   12    HA   HIS   3           HA       HIS   3  -9.864  -3.136  12.461
   13    HD1  HIS   3           HD1      HIS   3  -9.647  -2.092  16.639
   14    HD2  HIS   3           HD2      HIS   3  -8.168  -0.553  13.073
   15    HE1  HIS   3           HE1      HIS   3  -9.700   0.407  16.913
   16    HE2  HIS   3           HE2      HIS   3  -8.734   1.316  14.770
   17    HB2  HIS   3           HB2      HIS   3  -8.660  -3.864  15.141
   18    HB3  HIS   3           HB1      HIS   3  -7.774  -3.325  13.718
   19    H    GLY   4           HN       GLY   4 -10.719  -4.957  11.321
   20    HA2  GLY   4           HA2      GLY   4  -9.152  -7.035  10.788
   21    HA3  GLY   4           HA1      GLY   4  -9.941  -7.609  12.251
   22    H    TYR   5           HN       TYR   5 -10.368  -6.768   8.891
   23    HA   TYR   5           HA       TYR   5 -13.090  -7.880   8.959
   24    HD1  TYR   5           HD2      TYR   5 -11.214  -4.343   8.420
   25    HD2  TYR   5           HD1      TYR   5 -15.179  -5.858   8.112
   26    HE1  TYR   5           HE2      TYR   5 -12.056  -2.370   9.625
   27    HE2  TYR   5           HE1      TYR   5 -16.030  -3.890   9.316
   28    HH   TYR   5           HH       TYR   5 -15.216  -2.186  10.870
   29    HB2  TYR   5           HB2      TYR   5 -11.747  -6.145   6.878
   30    HB3  TYR   5           HB1      TYR   5 -13.385  -6.778   6.756
   31    H    SER   6           HN       SER   6 -12.657 -10.060   8.849
   32    HA   SER   6           HA       SER   6 -10.915 -11.073   6.752
   33    HG   SER   6           HG       SER   6 -10.390 -13.501   7.253
   34    HB2  SER   6           HB2      SER   6 -10.812 -12.118   8.972
   35    HB3  SER   6           HB1      SER   6 -12.520 -12.544   8.861
   36    H    ASP   7           HN       ASP   7 -11.874 -10.849   4.799
   37    HA   ASP   7           HA       ASP   7 -13.319 -11.172   3.072
   38    HB2  ASP   7           HB2      ASP   7 -12.863 -13.534   3.570
   39    HB3  ASP   7           HB1      ASP   7 -14.171 -13.546   4.749
   40    H    ALA   8           HN       ALA   8 -14.437  -9.208   3.612
   41    HA   ALA   8           HA       ALA   8 -17.228  -9.712   4.312
   42    HB1  ALA   8           HB3      ALA   8 -16.159  -9.040   6.407
   43    HB2  ALA   8           HB1      ALA   8 -17.317  -7.830   5.855
   44    HB3  ALA   8           HB2      ALA   8 -15.588  -7.557   5.640
   45    H    SER   9           HN       SER   9 -18.284  -9.055   2.568
   46    HA   SER   9           HA       SER   9 -18.994  -7.819   0.801
   47    HG   SER   9           HG       SER   9 -20.355  -5.416   2.739
   48    HB2  SER   9           HB2      SER   9 -17.900  -5.555   2.484
   49    HB3  SER   9           HB1      SER   9 -18.963  -5.356   1.091
   50    H    GLY  10           HN       GLY  10 -16.187  -8.836   0.836
   51    HA2  GLY  10           HA2      GLY  10 -14.773  -8.858  -1.079
   52    HA3  GLY  10           HA1      GLY  10 -15.254  -7.202  -1.417
   53    H    PHE  11           HN       PHE  11 -14.742  -5.846   0.832
   54    HA   PHE  11           HA       PHE  11 -12.039  -5.316   0.764
   55    HD1  PHE  11           HD1      PHE  11 -15.622  -3.989   1.283
   56    HD2  PHE  11           HD2      PHE  11 -11.717  -2.364   1.761
   57    HE1  PHE  11           HE1      PHE  11 -16.304  -1.988   0.023
   58    HE2  PHE  11           HE2      PHE  11 -12.393  -0.361   0.504
   59    HZ   PHE  11           HZ       PHE  11 -14.688  -0.170  -0.367
   60    HB2  PHE  11           HB2      PHE  11 -14.057  -4.858   2.963
   61    HB3  PHE  11           HB1      PHE  11 -12.408  -4.251   3.046
   62    H    SER  12           HN       SER  12 -10.539  -6.845   1.022
   63    HA   SER  12           HA       SER  12 -10.571  -8.384   3.533
   64    HG   SER  12           HG       SER  12  -8.810  -9.878   0.295
   65    HB2  SER  12           HB2      SER  12  -9.368 -10.188   2.286
   66    HB3  SER  12           HB1      SER  12 -11.009  -9.908   1.707
   67    H    LEU  13           HN       LEU  13  -8.655  -8.588   4.642
   68    HA   LEU  13           HA       LEU  13  -6.698  -6.546   4.147
   69    HG   LEU  13           HG       LEU  13  -8.625  -7.062   6.443
   70    HB2  LEU  13           HB2      LEU  13  -6.767  -8.735   6.224
   71    HB3  LEU  13           HB1      LEU  13  -5.636  -7.395   6.203
   72   HD11  LEU  13          HD11      LEU  13  -8.215  -6.617   8.809
   73   HD12  LEU  13          HD12      LEU  13  -6.513  -7.026   8.595
   74   HD13  LEU  13          HD13      LEU  13  -7.752  -8.263   8.377
   75   HD21  LEU  13          HD23      LEU  13  -7.979  -4.797   7.215
   76   HD22  LEU  13          HD21      LEU  13  -7.543  -5.114   5.535
   77   HD23  LEU  13          HD22      LEU  13  -6.307  -5.169   6.792
   78    H    TYR  14           HN       TYR  14  -4.817  -6.714   3.131
   79    HA   TYR  14           HA       TYR  14  -3.845  -9.404   2.423
   80    HD1  TYR  14           HD1      TYR  14  -6.264  -7.244   0.630
   81    HD2  TYR  14           HD2      TYR  14  -3.303  -9.996  -0.705
   82    HE1  TYR  14           HE1      TYR  14  -7.930  -8.336  -0.809
   83    HE2  TYR  14           HE2      TYR  14  -4.963 -11.094  -2.145
   84    HH   TYR  14           HH       TYR  14  -8.023  -9.727  -2.796
   85    HB2  TYR  14           HB2      TYR  14  -3.812  -6.808   0.908
   86    HB3  TYR  14           HB1      TYR  14  -2.658  -8.083   0.533
   87    H    SER  15           HN       SER  15  -1.837  -9.974   2.992
   88    HA   SER  15           HA       SER  15  -0.054  -7.886   4.056
   89    HG   SER  15           HG       SER  15  -1.070 -11.174   4.387
   90    HB2  SER  15           HB2      SER  15   0.741  -9.508   5.731
   91    HB3  SER  15           HB1      SER  15  -0.990  -9.214   5.897
   92    H    VAL  16           HN       VAL  16   1.910  -7.808   3.182
   93    HA   VAL  16           HA       VAL  16   2.957 -10.196   1.814
   94    HB   VAL  16           HB       VAL  16   3.181  -7.396   0.706
   95   HG11  VAL  16          HG11      VAL  16   5.025  -8.856   0.092
   96   HG12  VAL  16          HG12      VAL  16   3.999  -8.536  -1.306
   97   HG13  VAL  16          HG13      VAL  16   3.888 -10.083  -0.467
   98   HG21  VAL  16          HG23      VAL  16   1.363  -9.643  -0.159
   99   HG22  VAL  16          HG21      VAL  16   1.590  -8.121  -1.020
  100   HG23  VAL  16          HG22      VAL  16   0.867  -8.125   0.588
  101    H    GLU  17           HN       GLU  17   5.233 -10.377   1.766
  102    HA   GLU  17           HA       GLU  17   6.607  -8.603   3.673
  103    HB2  GLU  17           HB2      GLU  17   7.238 -11.466   2.938
  104    HB3  GLU  17           HB1      GLU  17   8.157 -10.482   4.068
  105    HG2  GLU  17           HG2      GLU  17   6.224 -10.328   5.534
  106    HG3  GLU  17           HG1      GLU  17   5.273 -11.279   4.392
  107    H    LEU  18           HN       LEU  18   8.060  -7.274   2.854
  108    HA   LEU  18           HA       LEU  18   9.418  -8.021   0.349
  109    HG   LEU  18           HG       LEU  18   7.791  -5.180  -1.249
  110    HB2  LEU  18           HB2      LEU  18   8.018  -5.561   1.138
  111    HB3  LEU  18           HB1      LEU  18   9.589  -5.298   0.407
  112   HD11  LEU  18          HD11      LEU  18   9.553  -7.602  -1.589
  113   HD12  LEU  18          HD12      LEU  18  10.003  -5.935  -1.945
  114   HD13  LEU  18          HD13      LEU  18   8.734  -6.726  -2.882
  115   HD21  LEU  18          HD23      LEU  18   6.509  -7.161  -1.848
  116   HD22  LEU  18          HD21      LEU  18   6.218  -6.715  -0.166
  117   HD23  LEU  18          HD22      LEU  18   7.281  -8.070  -0.549
  118    H    PHE  19           HN       PHE  19  11.514  -6.840   0.033
  119    HA   PHE  19           HA       PHE  19  12.875  -6.074   2.487
  120    HD1  PHE  19           HD2      PHE  19  11.904  -9.639   0.829
  121    HD2  PHE  19           HD1      PHE  19  15.711  -8.003  -0.144
  122    HE1  PHE  19           HE2      PHE  19  11.984 -11.039  -1.191
  123    HE2  PHE  19           HE1      PHE  19  15.797  -9.400  -2.168
  124    HZ   PHE  19           HZ       PHE  19  13.932 -10.921  -2.695
  125    HB2  PHE  19           HB2      PHE  19  14.764  -7.649   2.007
  126    HB3  PHE  19           HB1      PHE  19  13.274  -8.445   2.497
  127    H    ARG  20           HN       ARG  20  14.230  -4.415   2.131
  128    HA   ARG  20           HA       ARG  20  14.934  -3.851  -0.677
  129    HE   ARG  20           HE       ARG  20  15.756   0.473   1.133
  130    HB2  ARG  20           HB2      ARG  20  13.548  -2.203   0.806
  131    HB3  ARG  20           HB1      ARG  20  15.115  -1.797   1.496
  132    HG2  ARG  20           HG2      ARG  20  14.711  -1.759  -1.466
  133    HG3  ARG  20           HG1      ARG  20  14.190  -0.400  -0.469
  134    HD2  ARG  20           HD2      ARG  20  16.977  -1.518  -0.337
  135    HD3  ARG  20           HD1      ARG  20  16.518  -0.266  -1.490
  136   HH11  ARG  20          HH11      ARG  20  18.548   0.175  -0.931
  137   HH12  ARG  20          HH12      ARG  20  19.447   1.404  -0.106
  138   HH21  ARG  20          HH21      ARG  20  16.932   2.089   2.224
  139   HH22  ARG  20          HH22      ARG  20  18.530   2.491   1.689
  140    H    GLU  21           HN       GLU  21  16.939  -4.340  -1.212
  141    HA   GLU  21           HA       GLU  21  19.137  -3.537   0.502
  142    HB2  GLU  21           HB2      GLU  21  20.216  -5.753   0.431
  143    HB3  GLU  21           HB1      GLU  21  18.700  -5.783   1.320
  144    HG2  GLU  21           HG2      GLU  21  17.578  -6.758  -0.610
  145    HG3  GLU  21           HG1      GLU  21  19.087  -6.708  -1.519
  146    H    LYS  22           HN       LYS  22  17.844  -3.264  -2.320
  147    HA   LYS  22           HA       LYS  22  20.259  -3.775  -3.913
  148    HB2  LYS  22           HB2      LYS  22  17.477  -3.057  -4.858
  149    HB3  LYS  22           HB1      LYS  22  18.836  -3.512  -5.875
  150    HG2  LYS  22           HG2      LYS  22  17.532  -5.301  -3.834
  151    HG3  LYS  22           HG1      LYS  22  17.215  -5.333  -5.570
  152    HD2  LYS  22           HD2      LYS  22  19.602  -5.842  -5.960
  153    HD3  LYS  22           HD1      LYS  22  19.854  -5.892  -4.214
  154    HE2  LYS  22           HE2      LYS  22  18.049  -7.692  -5.824
  155    HE3  LYS  22           HE1      LYS  22  19.589  -8.138  -5.091
  156    HZ1  LYS  22           HZ3      LYS  22  17.146  -7.297  -3.626
  157    HZ2  LYS  22           HZ1      LYS  22  18.625  -7.705  -2.913
  158    HZ3  LYS  22           HZ2      LYS  22  17.736  -8.878  -3.743
  159    H    ASP  23           HN       ASP  23  20.894  -2.115  -5.485
  160    HA   ASP  23           HA       ASP  23  20.787   0.523  -4.261
  161    HB2  ASP  23           HB2      ASP  23  22.426  -0.523  -6.580
  162    HB3  ASP  23           HB1      ASP  23  22.575   1.086  -5.880
  163    H    THR  24           HN       THR  24  18.357   0.222  -5.071
  164    HA   THR  24           HA       THR  24  18.174   1.562  -7.692
  165    HB   THR  24           HB       THR  24  15.999   0.577  -8.029
  166    HG1  THR  24           HG1      THR  24  14.928   0.088  -6.272
  167   HG21  THR  24          HG23      THR  24  17.928  -0.780  -8.698
  168   HG22  THR  24          HG21      THR  24  16.585  -1.796  -8.176
  169   HG23  THR  24          HG22      THR  24  17.957  -1.530  -7.102
  170    H    SER  25           HN       SER  25  17.732   1.868  -4.388
  171    HA   SER  25           HA       SER  25  16.672   3.336  -3.015
  172    HG   SER  25           HG       SER  25  16.322   6.078  -5.724
  173    HB2  SER  25           HB2      SER  25  16.739   5.665  -3.719
  174    HB3  SER  25           HB1      SER  25  18.211   4.847  -4.237
  175    H    SER  26           HN       SER  26  14.962   1.674  -4.776
  176    HA   SER  26           HA       SER  26  12.486   3.098  -4.280
  177    HG   SER  26           HG       SER  26  13.861   4.132  -7.260
  178    HB2  SER  26           HB2      SER  26  13.215   2.152  -7.063
  179    HB3  SER  26           HB1      SER  26  11.633   2.758  -6.575
  180    H    LEU  27           HN       LEU  27  10.828   1.754  -3.784
  181    HA   LEU  27           HA       LEU  27  11.435  -1.094  -3.668
  182    HG   LEU  27           HG       LEU  27  11.438   0.632  -1.283
  183    HB2  LEU  27           HB2      LEU  27   9.234   0.581  -2.471
  184    HB3  LEU  27           HB1      LEU  27   9.266  -1.167  -2.356
  185   HD11  LEU  27          HD11      LEU  27  10.501   0.303   0.891
  186   HD12  LEU  27          HD12      LEU  27   9.274  -0.791   0.255
  187   HD13  LEU  27          HD13      LEU  27   9.226   0.922  -0.159
  188   HD21  LEU  27          HD23      LEU  27  12.197  -1.614  -1.831
  189   HD22  LEU  27          HD21      LEU  27  10.866  -2.306  -0.903
  190   HD23  LEU  27          HD22      LEU  27  12.131  -1.390  -0.083
  191    H    GLY  28           HN       GLY  28   9.207   1.138  -5.207
  192    HA2  GLY  28           HA2      GLY  28   8.539   0.315  -7.493
  193    HA3  GLY  28           HA1      GLY  28   8.011  -1.140  -6.661
  194    H    ILE  29           HN       ILE  29   7.037   0.501  -4.361
  195    HA   ILE  29           HA       ILE  29   4.354   0.758  -5.180
  196    HB   ILE  29           HB       ILE  29   5.676   1.957  -2.739
  197   HG12  ILE  29          HG12      ILE  29   4.214  -0.677  -3.033
  198   HG13  ILE  29          HG11      ILE  29   5.966  -0.514  -2.987
  199   HG21  ILE  29          HG21      ILE  29   2.778   1.349  -3.313
  200   HG22  ILE  29          HG22      ILE  29   3.504   2.952  -3.214
  201   HG23  ILE  29          HG23      ILE  29   3.422   1.931  -1.777
  202   HD11  ILE  29          HD13      ILE  29   5.119  -1.198  -0.834
  203   HD12  ILE  29          HD11      ILE  29   4.050   0.204  -0.779
  204   HD13  ILE  29          HD12      ILE  29   5.799   0.426  -0.728
  205    H    SER  30           HN       SER  30   3.573   2.260  -6.501
  206    HA   SER  30           HA       SER  30   4.692   4.983  -6.355
  207    HG   SER  30           HG       SER  30   3.130   5.961  -8.510
  208    HB2  SER  30           HB2      SER  30   5.091   3.919  -8.523
  209    HB3  SER  30           HB1      SER  30   3.367   3.597  -8.698
  210    H    ILE  31           HN       ILE  31   3.358   5.989  -4.945
  211    HA   ILE  31           HA       ILE  31   0.462   5.728  -5.270
  212    HB   ILE  31           HB       ILE  31   0.349   7.071  -3.164
  213   HG12  ILE  31          HG12      ILE  31   3.338   6.618  -3.055
  214   HG13  ILE  31          HG11      ILE  31   2.599   8.153  -3.498
  215   HG21  ILE  31          HG21      ILE  31   1.982   4.537  -3.054
  216   HG22  ILE  31          HG22      ILE  31   0.223   4.644  -3.120
  217   HG23  ILE  31          HG23      ILE  31   1.090   5.243  -1.706
  218   HD11  ILE  31          HD13      ILE  31   3.326   8.096  -1.163
  219   HD12  ILE  31          HD11      ILE  31   2.232   6.745  -0.863
  220   HD13  ILE  31          HD12      ILE  31   1.583   8.324  -1.309
  221    H    SER  32           HN       SER  32  -0.881   7.668  -5.248
  222    HA   SER  32           HA       SER  32   0.434   9.922  -6.617
  223    HG   SER  32           HG       SER  32  -2.775  10.664  -8.052
  224    HB2  SER  32           HB2      SER  32  -1.114   8.718  -8.085
  225    HB3  SER  32           HB1      SER  32  -2.410   8.925  -6.908
  226    H    GLY  33           HN       GLY  33  -0.145  12.024  -6.066
  227    HA2  GLY  33           HA2      GLY  33  -0.749  12.503  -3.365
  228    HA3  GLY  33           HA1      GLY  33  -0.731  13.718  -4.635
  229    H    MET  34           HN       MET  34  -2.538  13.662  -2.444
  230    HA   MET  34           HA       MET  34  -5.079  13.126  -3.840
  231    HB2  MET  34           HB2      MET  34  -4.771  11.680  -1.885
  232    HB3  MET  34           HB1      MET  34  -4.521  13.092  -0.869
  233    HG2  MET  34           HG2      MET  34  -6.755  12.228  -0.583
  234    HG3  MET  34           HG1      MET  34  -6.805  13.826  -1.325
  235    HE1  MET  34           HE3      MET  34  -9.356  13.439  -2.094
  236    HE2  MET  34           HE1      MET  34  -9.276  11.889  -1.256
  237    HE3  MET  34           HE2      MET  34  -9.886  11.967  -2.909
  238    H    ARG  35           HN       ARG  35  -6.693  14.666  -3.757
  239    HA   ARG  35           HA       ARG  35  -6.004  17.240  -2.516
  240    HE   ARG  35           HE       ARG  35  -4.845  17.317  -6.581
  241    HB2  ARG  35           HB2      ARG  35  -7.123  18.328  -4.526
  242    HB3  ARG  35           HB1      ARG  35  -5.533  17.630  -4.797
  243    HG2  ARG  35           HG2      ARG  35  -7.956  15.989  -5.359
  244    HG3  ARG  35           HG1      ARG  35  -7.469  17.242  -6.502
  245    HD2  ARG  35           HD2      ARG  35  -5.763  14.948  -5.535
  246    HD3  ARG  35           HD1      ARG  35  -6.520  15.086  -7.122
  247   HH11  ARG  35          HH11      ARG  35  -4.770  13.960  -7.523
  248   HH12  ARG  35          HH12      ARG  35  -3.266  14.101  -8.370
  249   HH21  ARG  35          HH21      ARG  35  -2.869  17.508  -7.696
  250   HH22  ARG  35          HH22      ARG  35  -2.186  16.116  -8.468
  251    H    ASP  36           HN       ASP  36  -7.421  16.260  -0.850
  252    HA   ASP  36           HA       ASP  36 -10.273  16.327  -1.522
  253    HB2  ASP  36           HB2      ASP  36  -9.502  14.334  -0.346
  254    HB3  ASP  36           HB1      ASP  36  -8.838  15.325   0.948
  255    H    GLN  37           HN       GLN  37 -11.759  17.519  -0.250
  256    HA   GLN  37           HA       GLN  37 -10.624  20.005   0.783
  257    HB2  GLN  37           HB2      GLN  37 -13.487  19.251   0.161
  258    HB3  GLN  37           HB1      GLN  37 -12.946  20.843   0.675
  259    HG2  GLN  37           HG2      GLN  37 -11.546  20.977  -1.356
  260    HG3  GLN  37           HG1      GLN  37 -12.211  19.432  -1.880
  261   HE21  GLN  37          HE21      GLN  37 -14.371  19.318  -2.520
  262   HE22  GLN  37          HE22      GLN  37 -15.273  20.730  -2.944
  263    H    SER  38           HN       SER  38 -11.114  20.838   2.820
  264    HA   SER  38           HA       SER  38 -11.207  19.006   4.934
  265    HG   SER  38           HG       SER  38  -9.589  21.863   5.885
  266    HB2  SER  38           HB2      SER  38 -11.845  21.965   4.962
  267    HB3  SER  38           HB1      SER  38 -11.515  20.980   6.386
  268    H    THR  39           HN       THR  39 -12.899  17.668   5.148
  269    HA   THR  39           HA       THR  39 -15.555  18.895   5.488
  270    HB   THR  39           HB       THR  39 -16.587  16.882   4.512
  271    HG1  THR  39           HG1      THR  39 -15.395  15.184   4.112
  272   HG21  THR  39          HG23      THR  39 -16.004  17.321   2.166
  273   HG22  THR  39          HG21      THR  39 -14.581  18.220   2.692
  274   HG23  THR  39          HG22      THR  39 -16.194  18.819   3.078
  275    H    THR  40           HN       THR  40 -17.048  17.540   6.771
  276    HA   THR  40           HA       THR  40 -15.775  16.678   9.179
  277    HB   THR  40           HB       THR  40 -17.920  17.817   9.285
  278    HG1  THR  40           HG1      THR  40 -19.041  16.147  10.565
  279   HG21  THR  40          HG23      THR  40 -19.982  16.709   8.531
  280   HG22  THR  40          HG21      THR  40 -19.018  15.404   7.838
  281   HG23  THR  40          HG22      THR  40 -18.887  17.038   7.186
  282    H    GLY  41           HN       GLY  41 -16.065  15.137   6.317
  283    HA2  GLY  41           HA2      GLY  41 -16.324  12.490   7.607
  284    HA3  GLY  41           HA1      GLY  41 -16.875  12.819   5.972
  285    H    GLU  42           HN       GLU  42 -14.285  11.818   7.923
  286    HA   GLU  42           HA       GLU  42 -12.176  11.096   7.492
  287    HB2  GLU  42           HB2      GLU  42 -13.194  10.997   4.649
  288    HB3  GLU  42           HB1      GLU  42 -11.719  10.234   5.226
  289    HG2  GLU  42           HG2      GLU  42 -14.521   9.579   6.108
  290    HG3  GLU  42           HG1      GLU  42 -13.514   8.619   5.024
  291    H    ALA  43           HN       ALA  43 -10.237  11.507   5.801
  292    HA   ALA  43           HA       ALA  43 -10.129  14.149   4.706
  293    HB1  ALA  43           HB3      ALA  43  -8.520  13.631   7.203
  294    HB2  ALA  43           HB1      ALA  43  -9.934  14.679   7.097
  295    HB3  ALA  43           HB2      ALA  43  -8.467  15.084   6.206
  296    H    THR  44           HN       THR  44  -8.957  13.865   2.947
  297    HA   THR  44           HA       THR  44  -7.454  13.041   1.450
  298    HB   THR  44           HB       THR  44  -5.107  12.982   2.186
  299    HG1  THR  44           HG1      THR  44  -5.432  13.867   4.704
  300   HG21  THR  44          HG23      THR  44  -4.954  15.312   2.956
  301   HG22  THR  44          HG21      THR  44  -6.683  15.305   3.302
  302   HG23  THR  44          HG22      THR  44  -6.116  15.132   1.641
  303    H    GLY  45           HN       GLY  45  -5.331  11.305   1.592
  304    HA2  GLY  45           HA2      GLY  45  -5.423   8.972   2.958
  305    HA3  GLY  45           HA1      GLY  45  -6.718   8.775   1.786
  306    H    ILE  46           HN       ILE  46  -3.975   7.513   2.197
  307    HA   ILE  46           HA       ILE  46  -2.761   8.129  -0.400
  308    HB   ILE  46           HB       ILE  46  -1.710   6.544   1.944
  309   HG12  ILE  46          HG12      ILE  46  -1.726   8.975   2.278
  310   HG13  ILE  46          HG11      ILE  46  -0.080   8.369   2.132
  311   HG21  ILE  46          HG21      ILE  46  -0.887   5.528  -0.075
  312   HG22  ILE  46          HG22      ILE  46   0.417   6.450   0.676
  313   HG23  ILE  46          HG23      ILE  46  -0.430   7.103  -0.727
  314   HD11  ILE  46          HD13      ILE  46  -1.653   9.748  -0.034
  315   HD12  ILE  46          HD11      ILE  46  -0.002   9.144  -0.183
  316   HD13  ILE  46          HD12      ILE  46  -0.363  10.461   0.934
  317    H    TYR  47           HN       TYR  47  -2.630   6.672  -2.032
  318    HA   TYR  47           HA       TYR  47  -3.369   3.898  -1.602
  319    HD1  TYR  47           HD2      TYR  47  -4.614   5.072  -5.483
  320    HD2  TYR  47           HD1      TYR  47  -5.708   7.313  -2.037
  321    HE1  TYR  47           HE2      TYR  47  -5.019   7.039  -6.900
  322    HE2  TYR  47           HE1      TYR  47  -6.120   9.286  -3.444
  323    HH   TYR  47           HH       TYR  47  -6.346   9.131  -6.811
  324    HB2  TYR  47           HB2      TYR  47  -5.117   3.962  -3.374
  325    HB3  TYR  47           HB1      TYR  47  -5.549   4.893  -1.945
  326    H    VAL  48           HN       VAL  48  -2.576   2.515  -3.156
  327    HA   VAL  48           HA       VAL  48  -0.476   3.538  -4.822
  328    HB   VAL  48           HB       VAL  48  -1.592   0.744  -4.540
  329   HG11  VAL  48          HG11      VAL  48  -0.590   0.970  -6.728
  330   HG12  VAL  48          HG12      VAL  48   0.472   0.018  -5.692
  331   HG13  VAL  48          HG13      VAL  48   0.850   1.708  -6.026
  332   HG21  VAL  48          HG23      VAL  48   0.449   0.318  -3.263
  333   HG22  VAL  48          HG21      VAL  48  -0.515   1.598  -2.525
  334   HG23  VAL  48          HG22      VAL  48   0.924   2.005  -3.459
  335    H    LYS  49           HN       LYS  49  -0.468   3.877  -6.970
  336    HA   LYS  49           HA       LYS  49  -2.979   3.366  -8.422
  337    HB2  LYS  49           HB2      LYS  49  -2.473   5.751  -8.125
  338    HB3  LYS  49           HB1      LYS  49  -0.911   5.518  -8.900
  339    HG2  LYS  49           HG2      LYS  49  -1.984   4.957 -10.988
  340    HG3  LYS  49           HG1      LYS  49  -3.573   5.053 -10.227
  341    HD2  LYS  49           HD2      LYS  49  -3.176   7.086 -11.447
  342    HD3  LYS  49           HD1      LYS  49  -3.125   7.444  -9.721
  343    HE2  LYS  49           HE2      LYS  49  -0.674   7.368  -9.788
  344    HE3  LYS  49           HE1      LYS  49  -0.736   7.029 -11.517
  345    HZ1  LYS  49           HZ3      LYS  49  -1.740   9.492 -10.197
  346    HZ2  LYS  49           HZ1      LYS  49  -1.817   9.166 -11.855
  347    HZ3  LYS  49           HZ2      LYS  49  -0.317   9.365 -11.101
  348    H    SER  50           HN       SER  50   0.514   3.092  -8.503
  349    HA   SER  50           HA       SER  50   0.301   1.115 -10.607
  350    HG   SER  50           HG       SER  50   2.268   3.820  -9.981
  351    HB2  SER  50           HB2      SER  50   1.973   2.209 -12.063
  352    HB3  SER  50           HB1      SER  50   0.503   3.171 -11.912
  353    H    LEU  51           HN       LEU  51   2.661   0.392 -11.212
  354    HA   LEU  51           HA       LEU  51   4.334   0.353  -8.797
  355    HG   LEU  51           HG       LEU  51   1.886  -1.396  -8.641
  356    HB2  LEU  51           HB2      LEU  51   3.493  -2.036 -10.440
  357    HB3  LEU  51           HB1      LEU  51   4.767  -2.073  -9.235
  358   HD11  LEU  51          HD11      LEU  51   3.400  -3.969  -8.222
  359   HD12  LEU  51          HD12      LEU  51   2.089  -3.706  -9.373
  360   HD13  LEU  51          HD13      LEU  51   1.771  -3.626  -7.640
  361   HD21  LEU  51          HD23      LEU  51   3.459  -0.406  -7.070
  362   HD22  LEU  51          HD21      LEU  51   4.230  -1.975  -6.833
  363   HD23  LEU  51          HD22      LEU  51   2.566  -1.722  -6.309
  364    H    ILE  52           HN       ILE  52   6.559   0.032  -9.159
  365    HA   ILE  52           HA       ILE  52   7.464   0.967 -11.729
  366    HB   ILE  52           HB       ILE  52   9.064   0.169  -9.300
  367   HG12  ILE  52          HG12      ILE  52   8.156   2.878 -10.302
  368   HG13  ILE  52          HG11      ILE  52   7.558   2.052  -8.866
  369   HG21  ILE  52          HG21      ILE  52   9.879   1.681 -11.782
  370   HG22  ILE  52          HG22      ILE  52  10.382   0.049 -11.346
  371   HG23  ILE  52          HG23      ILE  52  10.891   1.420 -10.362
  372   HD11  ILE  52          HD13      ILE  52   9.125   3.796  -8.277
  373   HD12  ILE  52          HD11      ILE  52  10.358   3.057  -9.297
  374   HD13  ILE  52          HD12      ILE  52   9.778   2.212  -7.863
  375    HA   PRO  53           HA       PRO  53   8.058  -3.227 -13.245
  376    HB2  PRO  53           HB2      PRO  53   9.127  -2.566 -15.646
  377    HB3  PRO  53           HB1      PRO  53   7.398  -2.434 -15.304
  378    HG2  PRO  53           HG2      PRO  53   9.501  -0.299 -15.265
  379    HG3  PRO  53           HG1      PRO  53   7.871  -0.247 -15.963
  380    HD2  PRO  53           HD2      PRO  53   8.442   0.845 -13.562
  381    HD3  PRO  53           HD1      PRO  53   6.868   0.102 -13.912
  382    H    GLY  54           HN       GLY  54   9.673  -4.332 -12.302
  383    HA2  GLY  54           HA2      GLY  54  11.898  -5.211 -12.590
  384    HA3  GLY  54           HA1      GLY  54  12.431  -3.598 -13.037
  385    H    SER  55           HN       SER  55  10.287  -3.725 -10.380
  386    HA   SER  55           HA       SER  55  12.547  -3.255  -8.558
  387    HG   SER  55           HG       SER  55   9.127  -3.309  -8.491
  388    HB2  SER  55           HB2      SER  55  10.921  -2.045  -7.135
  389    HB3  SER  55           HB1      SER  55  11.036  -1.346  -8.749
  390    H    ALA  56           HN       ALA  56  11.808  -3.742  -6.165
  391    HA   ALA  56           HA       ALA  56  11.572  -6.539  -5.956
  392    HB1  ALA  56           HB3      ALA  56  11.470  -6.176  -3.551
  393    HB2  ALA  56           HB1      ALA  56  11.158  -4.460  -3.810
  394    HB3  ALA  56           HB2      ALA  56  12.709  -5.156  -4.282
  395    H    ALA  57           HN       ALA  57   9.272  -4.006  -4.950
  396    HA   ALA  57           HA       ALA  57   7.160  -5.597  -4.182
  397    HB1  ALA  57           HB3      ALA  57   7.229  -3.180  -3.845
  398    HB2  ALA  57           HB1      ALA  57   5.721  -3.675  -4.613
  399    HB3  ALA  57           HB2      ALA  57   6.996  -2.928  -5.575
  400    H    ALA  58           HN       ALA  58   8.224  -4.810  -7.410
  401    HA   ALA  58           HA       ALA  58   5.822  -5.698  -8.710
  402    HB1  ALA  58           HB3      ALA  58   7.087  -5.411 -10.781
  403    HB2  ALA  58           HB1      ALA  58   8.563  -5.166  -9.849
  404    HB3  ALA  58           HB2      ALA  58   7.243  -4.002  -9.732
  405    H    LEU  59           HN       LEU  59   9.018  -7.078  -8.074
  406    HA   LEU  59           HA       LEU  59   8.730  -9.416  -9.601
  407    HG   LEU  59           HG       LEU  59  11.049  -7.614  -9.202
  408    HB2  LEU  59           HB2      LEU  59  10.367  -8.846  -7.135
  409    HB3  LEU  59           HB1      LEU  59  10.482 -10.344  -8.041
  410   HD11  LEU  59          HD11      LEU  59  12.952  -9.734  -8.212
  411   HD12  LEU  59          HD12      LEU  59  12.679  -8.152  -7.482
  412   HD13  LEU  59          HD13      LEU  59  13.408  -8.270  -9.083
  413   HD21  LEU  59          HD23      LEU  59  10.343  -9.249 -10.858
  414   HD22  LEU  59          HD21      LEU  59  11.537 -10.397 -10.257
  415   HD23  LEU  59          HD22      LEU  59  12.063  -8.901 -11.027
  416    H    ASP  60           HN       ASP  60   7.737  -8.633  -6.319
  417    HA   ASP  60           HA       ASP  60   7.116 -11.229  -5.451
  418    HB2  ASP  60           HB2      ASP  60   6.023  -8.531  -4.652
  419    HB3  ASP  60           HB1      ASP  60   5.552 -10.027  -3.850
  420    H    GLY  61           HN       GLY  61   5.081  -8.757  -6.998
  421    HA2  GLY  61           HA2      GLY  61   3.286  -9.090  -8.436
  422    HA3  GLY  61           HA1      GLY  61   3.436 -10.821  -8.178
  423    H    ARG  62           HN       ARG  62   3.413 -10.201  -5.181
  424    HA   ARG  62           HA       ARG  62   0.698 -10.761  -4.730
  425    HE   ARG  62           HE       ARG  62   0.462 -12.087  -1.834
  426    HB2  ARG  62           HB2      ARG  62   2.706  -9.632  -2.774
  427    HB3  ARG  62           HB1      ARG  62   1.203 -10.443  -2.363
  428    HG2  ARG  62           HG2      ARG  62   3.466 -11.746  -3.857
  429    HG3  ARG  62           HG1      ARG  62   3.232 -11.852  -2.112
  430    HD2  ARG  62           HD2      ARG  62   1.297 -12.788  -4.228
  431    HD3  ARG  62           HD1      ARG  62   2.334 -13.818  -3.242
  432   HH11  ARG  62          HH11      ARG  62   1.247 -15.271  -3.017
  433   HH12  ARG  62          HH12      ARG  62   0.111 -16.075  -1.986
  434   HH21  ARG  62          HH21      ARG  62  -1.033 -13.137  -0.469
  435   HH22  ARG  62          HH22      ARG  62  -1.186 -14.862  -0.537
  436    H    ILE  63           HN       ILE  63   2.376  -7.793  -5.182
  437    HA   ILE  63           HA       ILE  63   0.246  -6.200  -3.997
  438    HB   ILE  63           HB       ILE  63   2.813  -5.359  -5.352
  439   HG12  ILE  63          HG12      ILE  63   3.241  -4.540  -2.924
  440   HG13  ILE  63          HG11      ILE  63   1.962  -5.664  -2.482
  441   HG21  ILE  63          HG21      ILE  63   0.708  -3.696  -3.975
  442   HG22  ILE  63          HG22      ILE  63   1.141  -3.653  -5.685
  443   HG23  ILE  63          HG23      ILE  63   2.296  -3.108  -4.469
  444   HD11  ILE  63          HD13      ILE  63   4.494  -6.399  -3.932
  445   HD12  ILE  63          HD11      ILE  63   3.234  -7.509  -3.391
  446   HD13  ILE  63          HD12      ILE  63   4.194  -6.622  -2.208
  447    H    GLU  64           HN       GLU  64  -1.526  -5.913  -5.166
  448    HA   GLU  64           HA       GLU  64  -1.338  -5.775  -8.082
  449    HB2  GLU  64           HB2      GLU  64  -2.966  -7.353  -7.181
  450    HB3  GLU  64           HB1      GLU  64  -3.731  -6.068  -6.255
  451    HG2  GLU  64           HG2      GLU  64  -4.371  -4.957  -8.341
  452    HG3  GLU  64           HG1      GLU  64  -3.625  -6.265  -9.257
  453    HA   PRO  65           HA       PRO  65  -1.594  -1.330  -8.113
  454    HB2  PRO  65           HB2      PRO  65  -3.225  -1.794 -10.565
  455    HB3  PRO  65           HB1      PRO  65  -1.818  -0.751 -10.330
  456    HG2  PRO  65           HG2      PRO  65  -1.584  -3.060 -11.627
  457    HG3  PRO  65           HG1      PRO  65  -0.318  -2.514 -10.513
  458    HD2  PRO  65           HD2      PRO  65  -2.412  -4.607 -10.127
  459    HD3  PRO  65           HD1      PRO  65  -0.731  -4.573  -9.558
  460    H    ASN  66           HN       ASN  66  -3.161   0.370  -7.964
  461    HA   ASN  66           HA       ASN  66  -5.071   1.321  -7.189
  462    HB2  ASN  66           HB2      ASN  66  -6.386  -1.051  -8.531
  463    HB3  ASN  66           HB1      ASN  66  -7.226   0.388  -7.964
  464   HD21  ASN  66          HD21      ASN  66  -5.077  -0.927 -10.349
  465   HD22  ASN  66          HD22      ASN  66  -5.167   0.397 -11.456
  466    H    ASP  67           HN       ASP  67  -4.385   0.924  -5.031
  467    HA   ASP  67           HA       ASP  67  -6.288  -0.659  -3.544
  468    HB2  ASP  67           HB2      ASP  67  -4.597  -1.961  -2.319
  469    HB3  ASP  67           HB1      ASP  67  -4.580  -2.345  -4.038
  470    H    LYS  68           HN       LYS  68  -5.806  -0.440  -1.107
  471    HA   LYS  68           HA       LYS  68  -4.816   2.294  -0.624
  472    HB2  LYS  68           HB2      LYS  68  -7.231   2.063  -0.272
  473    HB3  LYS  68           HB1      LYS  68  -6.947   0.757   0.871
  474    HG2  LYS  68           HG2      LYS  68  -5.800   2.293   2.366
  475    HG3  LYS  68           HG1      LYS  68  -6.033   3.606   1.211
  476    HD2  LYS  68           HD2      LYS  68  -8.446   3.406   1.448
  477    HD3  LYS  68           HD1      LYS  68  -8.240   2.053   2.560
  478    HE2  LYS  68           HE2      LYS  68  -7.080   3.506   4.131
  479    HE3  LYS  68           HE1      LYS  68  -7.238   4.861   3.012
  480    HZ1  LYS  68           HZ3      LYS  68  -9.482   3.410   4.314
  481    HZ2  LYS  68           HZ1      LYS  68  -9.646   4.693   3.223
  482    HZ3  LYS  68           HZ2      LYS  68  -8.924   4.951   4.730
  483    H    ILE  69           HN       ILE  69  -3.117   2.514   0.669
  484    HA   ILE  69           HA       ILE  69  -2.028   0.194   2.017
  485    HB   ILE  69           HB       ILE  69  -0.959   3.017   1.991
  486   HG12  ILE  69          HG12      ILE  69  -1.139   2.189  -0.297
  487   HG13  ILE  69          HG11      ILE  69   0.550   2.236   0.194
  488   HG21  ILE  69          HG21      ILE  69   1.166   1.970   2.583
  489   HG22  ILE  69          HG22      ILE  69   0.383   0.389   2.610
  490   HG23  ILE  69          HG23      ILE  69  -0.076   1.621   3.786
  491   HD11  ILE  69          HD13      ILE  69   0.131   0.227  -1.041
  492   HD12  ILE  69          HD11      ILE  69  -1.209  -0.196   0.023
  493   HD13  ILE  69          HD12      ILE  69   0.441  -0.189   0.643
  494    H    LEU  70           HN       LEU  70  -1.925  -0.142   4.186
  495    HA   LEU  70           HA       LEU  70  -3.500   1.681   5.857
  496    HG   LEU  70           HG       LEU  70  -4.401  -1.053   4.640
  497    HB2  LEU  70           HB2      LEU  70  -2.639  -1.167   6.371
  498    HB3  LEU  70           HB1      LEU  70  -3.641  -0.203   7.437
  499   HD11  LEU  70          HD11      LEU  70  -4.331  -2.944   6.170
  500   HD12  LEU  70          HD12      LEU  70  -5.996  -2.533   5.761
  501   HD13  LEU  70          HD13      LEU  70  -5.332  -2.063   7.324
  502   HD21  LEU  70          HD23      LEU  70  -5.981   0.362   6.785
  503   HD22  LEU  70          HD21      LEU  70  -6.624  -0.218   5.247
  504   HD23  LEU  70          HD22      LEU  70  -5.416   1.067   5.270
  505    H    ARG  71           HN       ARG  71  -0.622  -0.404   6.265
  506    HA   ARG  71           HA       ARG  71   0.862   1.789   7.397
  507    HE   ARG  71           HE       ARG  71   1.925  -0.700  10.924
  508    HB2  ARG  71           HB2      ARG  71   1.261   0.711   9.572
  509    HB3  ARG  71           HB1      ARG  71  -0.430   1.132   9.343
  510    HG2  ARG  71           HG2      ARG  71  -0.995  -1.150   8.876
  511    HG3  ARG  71           HG1      ARG  71   0.707  -1.617   8.896
  512    HD2  ARG  71           HD2      ARG  71  -0.874  -0.545  11.230
  513    HD3  ARG  71           HD1      ARG  71  -0.392  -2.223  10.987
  514   HH11  ARG  71          HH11      ARG  71  -0.603  -1.460  13.199
  515   HH12  ARG  71          HH12      ARG  71   0.421  -1.297  14.586
  516   HH21  ARG  71          HH21      ARG  71   3.280  -0.484  12.743
  517   HH22  ARG  71          HH22      ARG  71   2.628  -0.743  14.328
  518    H    VAL  72           HN       VAL  72   3.009   1.520   7.241
  519    HA   VAL  72           HA       VAL  72   3.976  -0.847   5.870
  520    HB   VAL  72           HB       VAL  72   5.693   1.472   6.723
  521   HG11  VAL  72          HG11      VAL  72   5.771  -0.423   4.379
  522   HG12  VAL  72          HG12      VAL  72   6.870  -0.392   5.758
  523   HG13  VAL  72          HG13      VAL  72   6.866   0.941   4.605
  524   HG21  VAL  72          HG23      VAL  72   3.892   1.392   4.304
  525   HG22  VAL  72          HG21      VAL  72   5.121   2.615   4.628
  526   HG23  VAL  72          HG22      VAL  72   3.725   2.463   5.697
  527    H    ASP  73           HN       ASP  73   6.301  -1.549   6.640
  528    HA   ASP  73           HA       ASP  73   6.117  -2.934   8.995
  529    HB2  ASP  73           HB2      ASP  73   7.844  -3.209   7.177
  530    HB3  ASP  73           HB1      ASP  73   8.714  -1.857   7.893
  531    H    ASP  74           HN       ASP  74   5.704  -2.149  10.955
  532    HA   ASP  74           HA       ASP  74   5.871  -0.992  12.899
  533    HB2  ASP  74           HB2      ASP  74   8.237  -1.748  12.718
  534    HB3  ASP  74           HB1      ASP  74   8.628  -0.229  11.920
  535    H    VAL  75           HN       VAL  75   5.378   0.438  10.121
  536    HA   VAL  75           HA       VAL  75   5.293   3.133  11.305
  537    HB   VAL  75           HB       VAL  75   5.890   2.497   8.409
  538   HG11  VAL  75          HG11      VAL  75   6.256   4.922   8.194
  539   HG12  VAL  75          HG12      VAL  75   5.696   5.139   9.853
  540   HG13  VAL  75          HG13      VAL  75   4.591   4.531   8.620
  541   HG21  VAL  75          HG23      VAL  75   7.784   2.027   9.891
  542   HG22  VAL  75          HG21      VAL  75   7.672   3.660  10.549
  543   HG23  VAL  75          HG22      VAL  75   8.102   3.419   8.856
  544    H    ASN  76           HN       ASN  76   3.450   4.319  10.947
  545    HA   ASN  76           HA       ASN  76   1.242   2.881   9.633
  546    HB2  ASN  76           HB2      ASN  76   1.149   5.002  11.791
  547    HB3  ASN  76           HB1      ASN  76  -0.259   4.237  11.061
  548   HD21  ASN  76          HD21      ASN  76  -0.954   3.430  13.033
  549   HD22  ASN  76          HD22      ASN  76  -0.168   2.106  13.816
  550    H    VAL  77           HN       VAL  77   0.292   3.753   7.882
  551    HA   VAL  77           HA       VAL  77   1.063   6.510   7.169
  552    HB   VAL  77           HB       VAL  77   0.679   5.897   4.826
  553   HG11  VAL  77          HG11      VAL  77   2.607   4.381   4.560
  554   HG12  VAL  77          HG12      VAL  77   2.567   4.063   6.293
  555   HG13  VAL  77          HG13      VAL  77   2.919   5.686   5.702
  556   HG21  VAL  77          HG23      VAL  77   0.261   3.091   5.846
  557   HG22  VAL  77          HG21      VAL  77   0.273   3.611   4.162
  558   HG23  VAL  77          HG22      VAL  77  -1.015   4.147   5.241
  559    H    GLN  78           HN       GLN  78  -1.226   5.616   8.833
  560    HA   GLN  78           HA       GLN  78  -3.553   6.136   7.185
  561    HB2  GLN  78           HB2      GLN  78  -3.246   5.612  10.144
  562    HB3  GLN  78           HB1      GLN  78  -4.792   5.872   9.347
  563    HG2  GLN  78           HG2      GLN  78  -2.863   3.659   8.690
  564    HG3  GLN  78           HG1      GLN  78  -4.288   3.496   9.716
  565   HE21  GLN  78          HE21      GLN  78  -3.128   3.985   6.471
  566   HE22  GLN  78          HE22      GLN  78  -4.613   3.615   5.669
  567    H    GLY  79           HN       GLY  79  -1.566   8.259   7.450
  568    HA2  GLY  79           HA2      GLY  79  -3.112  10.495   7.559
  569    HA3  GLY  79           HA1      GLY  79  -2.674  10.230   9.238
  570    H    MET  80           HN       MET  80  -0.735   9.720   6.301
  571    HA   MET  80           HA       MET  80   1.055  11.871   7.211
  572    HB2  MET  80           HB2      MET  80   1.898   9.166   6.159
  573    HB3  MET  80           HB1      MET  80   2.989  10.499   6.514
  574    HG2  MET  80           HG2      MET  80   2.044  10.402   8.885
  575    HG3  MET  80           HG1      MET  80   1.384   8.835   8.418
  576    HE1  MET  80           HE3      MET  80   4.715   6.932   7.425
  577    HE2  MET  80           HE1      MET  80   3.812   7.987   6.338
  578    HE3  MET  80           HE2      MET  80   2.952   6.875   7.403
  579    H    ALA  81           HN       ALA  81   1.867  13.187   5.657
  580    HA   ALA  81           HA       ALA  81   0.569  13.360   3.180
  581    HB1  ALA  81           HB3      ALA  81   3.218  14.590   3.925
  582    HB2  ALA  81           HB1      ALA  81   1.640  15.262   4.339
  583    HB3  ALA  81           HB2      ALA  81   2.125  15.124   2.649
  584    H    GLN  82           HN       GLN  82   1.474  13.177   1.031
  585    HA   GLN  82           HA       GLN  82   2.478  10.708   0.395
  586    HB2  GLN  82           HB2      GLN  82   1.472  12.207  -1.251
  587    HB3  GLN  82           HB1      GLN  82   2.860  13.282  -1.143
  588    HG2  GLN  82           HG2      GLN  82   4.296  11.538  -2.049
  589    HG3  GLN  82           HG1      GLN  82   2.918  10.440  -2.135
  590   HE21  GLN  82          HE21      GLN  82   3.122  10.190  -4.353
  591   HE22  GLN  82          HE22      GLN  82   2.690  11.437  -5.468
  592    H    SER  83           HN       SER  83   4.344  13.713   0.741
  593    HA   SER  83           HA       SER  83   6.856  12.757   0.092
  594    HG   SER  83           HG       SER  83   5.143  14.545   2.506
  595    HB2  SER  83           HB2      SER  83   7.742  14.616   1.453
  596    HB3  SER  83           HB1      SER  83   6.389  15.133   0.449
  597    H    ASP  84           HN       ASP  84   5.241  12.723   3.255
  598    HA   ASP  84           HA       ASP  84   7.379  11.675   4.736
  599    HB2  ASP  84           HB2      ASP  84   4.400  11.439   5.186
  600    HB3  ASP  84           HB1      ASP  84   5.623  10.990   6.371
  601    H    VAL  85           HN       VAL  85   4.697  10.039   3.078
  602    HA   VAL  85           HA       VAL  85   5.281   7.428   3.894
  603    HB   VAL  85           HB       VAL  85   4.145   8.162   1.197
  604   HG11  VAL  85          HG11      VAL  85   4.656   5.809   1.472
  605   HG12  VAL  85          HG12      VAL  85   2.910   6.051   1.472
  606   HG13  VAL  85          HG13      VAL  85   3.761   5.768   2.990
  607   HG21  VAL  85          HG23      VAL  85   2.677   7.930   3.822
  608   HG22  VAL  85          HG21      VAL  85   1.947   8.201   2.240
  609   HG23  VAL  85          HG22      VAL  85   2.993   9.430   2.950
  610    H    VAL  86           HN       VAL  86   6.462   9.309   1.142
  611    HA   VAL  86           HA       VAL  86   7.910   7.243  -0.110
  612    HB   VAL  86           HB       VAL  86   8.407  10.224  -0.176
  613   HG11  VAL  86          HG11      VAL  86   9.581   9.767  -2.292
  614   HG12  VAL  86          HG12      VAL  86   9.397   8.037  -2.003
  615   HG13  VAL  86          HG13      VAL  86  10.376   9.015  -0.908
  616   HG21  VAL  86          HG23      VAL  86   6.166   9.609  -0.923
  617   HG22  VAL  86          HG21      VAL  86   6.854   8.443  -2.052
  618   HG23  VAL  86          HG22      VAL  86   7.151  10.167  -2.273
  619    H    GLU  87           HN       GLU  87   8.767   9.546   2.419
  620    HA   GLU  87           HA       GLU  87  11.526   9.110   2.492
  621    HB2  GLU  87           HB2      GLU  87   9.559   9.899   4.636
  622    HB3  GLU  87           HB1      GLU  87  11.287   9.790   4.943
  623    HG2  GLU  87           HG2      GLU  87  10.035  11.543   2.842
  624    HG3  GLU  87           HG1      GLU  87  10.494  12.080   4.457
  625    H    VAL  88           HN       VAL  88   8.913   7.486   4.258
  626    HA   VAL  88           HA       VAL  88  10.451   5.743   5.787
  627    HB   VAL  88           HB       VAL  88   7.697   5.360   4.612
  628   HG11  VAL  88          HG11      VAL  88   7.409   3.587   6.306
  629   HG12  VAL  88          HG12      VAL  88   9.125   3.713   6.696
  630   HG13  VAL  88          HG13      VAL  88   8.622   3.181   5.090
  631   HG21  VAL  88          HG23      VAL  88   6.923   5.952   6.842
  632   HG22  VAL  88          HG21      VAL  88   7.930   7.235   6.173
  633   HG23  VAL  88          HG22      VAL  88   8.589   6.138   7.387
  634    H    LEU  89           HN       LEU  89   8.896   5.108   2.651
  635    HA   LEU  89           HA       LEU  89   9.791   2.532   2.248
  636    HG   LEU  89           HG       LEU  89   7.337   4.300   1.535
  637    HB2  LEU  89           HB2      LEU  89   9.370   4.675   0.165
  638    HB3  LEU  89           HB1      LEU  89   9.449   2.953  -0.153
  639   HD11  LEU  89          HD11      LEU  89   7.158   4.911  -0.824
  640   HD12  LEU  89          HD12      LEU  89   5.836   3.855  -0.328
  641   HD13  LEU  89          HD13      LEU  89   7.178   3.205  -1.269
  642   HD21  LEU  89          HD23      LEU  89   7.553   1.465   0.530
  643   HD22  LEU  89          HD21      LEU  89   6.204   2.146   1.439
  644   HD23  LEU  89          HD22      LEU  89   7.788   1.988   2.198
  645    H    ARG  90           HN       ARG  90  11.487   5.566   1.638
  646    HA   ARG  90           HA       ARG  90  13.703   4.215   0.357
  647    HE   ARG  90           HE       ARG  90  12.236   8.711  -0.116
  648    HB2  ARG  90           HB2      ARG  90  13.180   7.090   1.083
  649    HB3  ARG  90           HB1      ARG  90  14.725   6.552   0.436
  650    HG2  ARG  90           HG2      ARG  90  13.540   5.686  -1.556
  651    HG3  ARG  90           HG1      ARG  90  12.043   6.363  -0.916
  652    HD2  ARG  90           HD2      ARG  90  14.526   7.974  -1.481
  653    HD3  ARG  90           HD1      ARG  90  13.188   7.795  -2.613
  654   HH11  ARG  90          HH11      ARG  90  14.017   9.781  -2.914
  655   HH12  ARG  90          HH12      ARG  90  13.534  11.435  -2.747
  656   HH21  ARG  90          HH21      ARG  90  11.598  10.888   0.111
  657   HH22  ARG  90          HH22      ARG  90  12.161  12.066  -1.027
  658    H    ASN  91           HN       ASN  91  12.806   5.057   3.550
  659    HA   ASN  91           HA       ASN  91  15.548   5.049   4.529
  660    HB2  ASN  91           HB2      ASN  91  12.893   5.403   5.926
  661    HB3  ASN  91           HB1      ASN  91  14.434   5.352   6.776
  662   HD21  ASN  91          HD21      ASN  91  12.473   7.500   6.573
  663   HD22  ASN  91          HD22      ASN  91  13.318   8.858   5.918
  664    H    ALA  92           HN       ALA  92  13.226   2.781   3.767
  665    HA   ALA  92           HA       ALA  92  13.330   0.907   5.811
  666    HB1  ALA  92           HB3      ALA  92  11.815   0.771   3.879
  667    HB2  ALA  92           HB1      ALA  92  12.682  -0.740   4.154
  668    HB3  ALA  92           HB2      ALA  92  13.182   0.340   2.852
  669    H    GLY  93           HN       GLY  93  14.993   0.131   2.778
  670    HA2  GLY  93           HA2      GLY  93  17.049  -0.815   2.373
  671    HA3  GLY  93           HA1      GLY  93  17.617   0.051   3.792
  672    H    ASN  94           HN       ASN  94  14.987  -2.001   4.388
  673    HA   ASN  94           HA       ASN  94  16.638  -4.311   5.059
  674    HB2  ASN  94           HB2      ASN  94  15.915  -4.354   7.377
  675    HB3  ASN  94           HB1      ASN  94  16.669  -2.796   7.049
  676   HD21  ASN  94          HD21      ASN  94  13.600  -4.454   7.409
  677   HD22  ASN  94          HD22      ASN  94  12.680  -3.057   7.833
  678    HA   PRO  95           HA       PRO  95  13.015  -6.702   4.104
  679    HB2  PRO  95           HB2      PRO  95  13.100  -8.054   6.736
  680    HB3  PRO  95           HB1      PRO  95  13.215  -8.746   5.115
  681    HG2  PRO  95           HG2      PRO  95  15.356  -8.585   6.706
  682    HG3  PRO  95           HG1      PRO  95  15.486  -8.332   4.954
  683    HD2  PRO  95           HD2      PRO  95  15.450  -6.316   7.167
  684    HD3  PRO  95           HD1      PRO  95  16.427  -6.346   5.684
  685    H    VAL  96           HN       VAL  96  11.424  -5.105   4.155
  686    HA   VAL  96           HA       VAL  96  10.072  -4.645   6.726
  687    HB   VAL  96           HB       VAL  96   9.002  -2.702   5.559
  688   HG11  VAL  96          HG11      VAL  96  10.984  -1.273   5.674
  689   HG12  VAL  96          HG12      VAL  96  12.016  -2.703   5.677
  690   HG13  VAL  96          HG13      VAL  96  10.923  -2.402   7.028
  691   HG21  VAL  96          HG23      VAL  96  11.025  -3.341   3.412
  692   HG22  VAL  96          HG21      VAL  96  10.006  -1.903   3.478
  693   HG23  VAL  96          HG22      VAL  96   9.274  -3.494   3.262
  694    H    ARG  97           HN       ARG  97   7.796  -4.664   6.842
  695    HA   ARG  97           HA       ARG  97   6.539  -6.471   4.911
  696    HE   ARG  97           HE       ARG  97   4.004  -5.701   8.764
  697    HB2  ARG  97           HB2      ARG  97   6.509  -7.208   7.251
  698    HB3  ARG  97           HB1      ARG  97   5.709  -5.713   7.720
  699    HG2  ARG  97           HG2      ARG  97   3.791  -6.351   6.281
  700    HG3  ARG  97           HG1      ARG  97   4.589  -7.896   5.978
  701    HD2  ARG  97           HD2      ARG  97   2.924  -8.100   7.749
  702    HD3  ARG  97           HD1      ARG  97   4.549  -8.392   8.368
  703   HH11  ARG  97          HH11      ARG  97   2.751  -8.775   9.824
  704   HH12  ARG  97          HH12      ARG  97   2.210  -8.172  11.355
  705   HH21  ARG  97          HH21      ARG  97   3.292  -4.900  10.777
  706   HH22  ARG  97          HH22      ARG  97   2.514  -5.971  11.895
  707    H    LEU  98           HN       LEU  98   4.594  -5.951   3.937
  708    HA   LEU  98           HA       LEU  98   3.778  -3.131   4.181
  709    HG   LEU  98           HG       LEU  98   5.749  -4.871   2.094
  710    HB2  LEU  98           HB2      LEU  98   3.293  -4.777   1.728
  711    HB3  LEU  98           HB1      LEU  98   3.362  -3.034   1.889
  712   HD11  LEU  98          HD11      LEU  98   6.362  -4.014  -0.104
  713   HD12  LEU  98          HD12      LEU  98   4.859  -3.093  -0.173
  714   HD13  LEU  98          HD13      LEU  98   4.813  -4.856  -0.162
  715   HD21  LEU  98          HD23      LEU  98   7.036  -2.785   1.904
  716   HD22  LEU  98          HD21      LEU  98   6.046  -2.828   3.363
  717   HD23  LEU  98          HD22      LEU  98   5.532  -1.865   1.978
  718    H    LEU  99           HN       LEU  99   1.967  -3.086   5.367
  719    HA   LEU  99           HA       LEU  99  -0.037  -5.190   4.995
  720    HG   LEU  99           HG       LEU  99  -2.154  -3.683   6.875
  721    HB2  LEU  99           HB2      LEU  99   0.652  -4.727   7.293
  722    HB3  LEU  99           HB1      LEU  99   0.198  -3.044   7.108
  723   HD11  LEU  99          HD11      LEU  99  -2.841  -6.003   7.322
  724   HD12  LEU  99          HD12      LEU  99  -1.147  -6.493   7.297
  725   HD13  LEU  99          HD13      LEU  99  -1.902  -5.853   5.837
  726   HD21  LEU  99          HD23      LEU  99  -1.302  -3.196   9.097
  727   HD22  LEU  99          HD21      LEU  99  -0.807  -4.876   9.295
  728   HD23  LEU  99          HD22      LEU  99  -2.518  -4.471   9.171
  729    H    LEU 100           HN       LEU 100  -1.253  -4.710   3.259
  730    HA   LEU 100           HA       LEU 100  -2.609  -2.099   3.253
  731    HG   LEU 100           HG       LEU 100  -0.031  -3.870   1.521
  732    HB2  LEU 100           HB2      LEU 100  -2.604  -2.547   0.650
  733    HB3  LEU 100           HB1      LEU 100  -1.281  -1.719   1.447
  734   HD11  LEU 100          HD11      LEU 100  -0.794  -5.713   0.096
  735   HD12  LEU 100          HD12      LEU 100  -2.313  -4.861  -0.180
  736   HD13  LEU 100          HD13      LEU 100  -1.896  -5.415   1.441
  737   HD21  LEU 100          HD23      LEU 100  -0.916  -2.950  -1.211
  738   HD22  LEU 100          HD21      LEU 100   0.530  -3.898  -0.862
  739   HD23  LEU 100          HD22      LEU 100   0.384  -2.253  -0.246
  740    H    ILE 101           HN       ILE 101  -4.655  -2.102   2.011
  741    HA   ILE 101           HA       ILE 101  -5.982  -4.728   2.189
  742    HB   ILE 101           HB       ILE 101  -6.818  -3.193   3.890
  743   HG12  ILE 101          HG12      ILE 101  -8.848  -3.516   1.667
  744   HG13  ILE 101          HG11      ILE 101  -8.361  -4.805   2.761
  745   HG21  ILE 101          HG21      ILE 101  -7.984  -1.129   3.269
  746   HG22  ILE 101          HG22      ILE 101  -7.529  -1.384   1.584
  747   HG23  ILE 101          HG23      ILE 101  -6.285  -1.088   2.799
  748   HD11  ILE 101          HD13      ILE 101  -9.224  -3.526   4.650
  749   HD12  ILE 101          HD11      ILE 101 -10.471  -3.826   3.440
  750   HD13  ILE 101          HD12      ILE 101  -9.714  -2.237   3.551
  751    H    ARG 102           HN       ARG 102  -7.277  -5.392   0.532
  752    HA   ARG 102           HA       ARG 102  -7.668  -3.580  -1.742
  753    HE   ARG 102           HE       ARG 102  -7.839  -5.504  -6.178
  754    HB2  ARG 102           HB2      ARG 102  -5.738  -4.825  -2.391
  755    HB3  ARG 102           HB1      ARG 102  -6.445  -6.336  -1.839
  756    HG2  ARG 102           HG2      ARG 102  -6.465  -6.228  -4.250
  757    HG3  ARG 102           HG1      ARG 102  -8.114  -6.202  -3.627
  758    HD2  ARG 102           HD2      ARG 102  -8.175  -3.768  -3.911
  759    HD3  ARG 102           HD1      ARG 102  -6.526  -3.802  -4.539
  760   HH11  ARG 102          HH11      ARG 102  -8.474  -2.235  -5.144
  761   HH12  ARG 102          HH12      ARG 102  -9.273  -1.791  -6.615
  762   HH21  ARG 102          HH21      ARG 102  -8.892  -4.925  -8.113
  763   HH22  ARG 102          HH22      ARG 102  -9.512  -3.319  -8.300
  764    H    ARG 103           HN       ARG 103  -9.665  -3.649  -2.554
  765    HA   ARG 103           HA       ARG 103 -11.608  -5.401  -1.358
  766    HE   ARG 103           HE       ARG 103 -16.235  -4.236  -2.844
  767    HB2  ARG 103           HB2      ARG 103 -12.123  -3.040  -1.853
  768    HB3  ARG 103           HB1      ARG 103 -11.930  -3.363  -3.570
  769    HG2  ARG 103           HG2      ARG 103 -13.813  -4.922  -3.485
  770    HG3  ARG 103           HG1      ARG 103 -14.010  -4.583  -1.765
  771    HD2  ARG 103           HD2      ARG 103 -14.386  -2.202  -2.321
  772    HD3  ARG 103           HD1      ARG 103 -14.291  -2.614  -4.032
  773   HH11  ARG 103          HH11      ARG 103 -15.690  -0.883  -3.612
  774   HH12  ARG 103          HH12      ARG 103 -17.374  -0.515  -3.785
  775   HH21  ARG 103          HH21      ARG 103 -18.455  -3.763  -3.072
  776   HH22  ARG 103          HH22      ARG 103 -18.946  -2.153  -3.478
  777    H    LEU 104           HN       LEU 104 -12.696  -7.074  -2.275
  778    HA   LEU 104           HA       LEU 104 -11.491  -8.275  -4.622
  779    HG   LEU 104           HG       LEU 104 -11.496  -9.015  -1.688
  780    HB2  LEU 104           HB2      LEU 104 -13.743  -9.279  -2.879
  781    HB3  LEU 104           HB1      LEU 104 -12.874 -10.210  -4.083
  782   HD11  LEU 104          HD11      LEU 104 -13.279 -10.466  -0.883
  783   HD12  LEU 104          HD12      LEU 104 -11.698 -11.201  -0.618
  784   HD13  LEU 104          HD13      LEU 104 -12.717 -11.760  -1.944
  785   HD21  LEU 104          HD23      LEU 104  -9.828 -10.727  -2.166
  786   HD22  LEU 104          HD21      LEU 104 -10.075  -9.678  -3.562
  787   HD23  LEU 104          HD22      LEU 104 -10.787 -11.292  -3.535
  788    HA   PRO 105           HA       PRO 105 -14.748  -6.793  -7.286
  789    HB2  PRO 105           HB2      PRO 105 -14.088  -8.050  -9.538
  790    HB3  PRO 105           HB1      PRO 105 -13.006  -6.831  -8.846
  791    HG2  PRO 105           HG2      PRO 105 -12.877  -9.820  -8.606
  792    HG3  PRO 105           HG1      PRO 105 -11.574  -8.685  -9.018
  793    HD2  PRO 105           HD2      PRO 105 -11.952  -9.681  -6.507
  794    HD3  PRO 105           HD1      PRO 105 -11.246  -8.082  -6.819
  795    H    LEU 106           HN       LEU 106 -15.871  -8.436  -5.593
  796    HA   LEU 106           HA       LEU 106 -16.946 -10.777  -6.936
  797    HG   LEU 106           HG       LEU 106 -15.193 -10.531  -4.371
  798    HB2  LEU 106           HB2      LEU 106 -17.500  -9.666  -4.185
  799    HB3  LEU 106           HB1      LEU 106 -18.108 -11.189  -4.801
  800   HD11  LEU 106          HD11      LEU 106 -17.069 -12.276  -2.785
  801   HD12  LEU 106          HD12      LEU 106 -16.394 -10.732  -2.267
  802   HD13  LEU 106          HD13      LEU 106 -15.333 -12.118  -2.517
  803   HD21  LEU 106          HD23      LEU 106 -15.508 -12.109  -6.188
  804   HD22  LEU 106          HD21      LEU 106 -16.557 -13.098  -5.172
  805   HD23  LEU 106          HD22      LEU 106 -14.848 -12.930  -4.772
  806    H    LEU 107           HN       LEU 107 -19.094 -11.091  -7.467
  807    HA   LEU 107           HA       LEU 107 -20.664  -8.623  -7.730
  808    HG   LEU 107           HG       LEU 107 -20.448  -9.731 -11.261
  809    HB2  LEU 107           HB2      LEU 107 -20.556 -11.165  -9.318
  810    HB3  LEU 107           HB1      LEU 107 -21.976 -10.140  -9.388
  811   HD11  LEU 107          HD11      LEU 107 -21.900  -7.947 -10.368
  812   HD12  LEU 107          HD12      LEU 107 -20.429  -7.332 -11.121
  813   HD13  LEU 107          HD13      LEU 107 -20.560  -7.395  -9.364
  814   HD21  LEU 107          HD23      LEU 107 -18.506  -8.779  -9.160
  815   HD22  LEU 107          HD21      LEU 107 -18.287  -8.686 -10.907
  816   HD23  LEU 107          HD22      LEU 107 -18.343 -10.257 -10.108
  817    H    GLU 108           HN       GLU 108 -22.742  -8.490  -6.994
  818    HA   GLU 108           HA       GLU 108 -23.500 -10.405  -4.967
  819    HB2  GLU 108           HB2      GLU 108 -24.824  -7.854  -5.902
  820    HB3  GLU 108           HB1      GLU 108 -25.378  -8.824  -4.545
  821    HG2  GLU 108           HG2      GLU 108 -22.703  -7.461  -4.757
  822    HG3  GLU 108           HG1      GLU 108 -24.082  -6.894  -3.816
  Start of MODEL   17
    1    H1   GLY   1           HT1      GLY   1  -9.399 -15.925   9.530
    2    H2   GLY   1           HT2      GLY   1 -10.856 -16.783   9.556
    3    H3   GLY   1           HT3      GLY   1  -9.543 -17.319  10.479
    4    HA2  GLY   1           HA1      GLY   1 -11.067 -14.806  10.892
    5    HA3  GLY   1           HA2      GLY   1 -11.166 -16.246  11.893
    6    H    SER   2           HN       SER   2  -8.108 -15.271  10.580
    7    HA   SER   2           HA       SER   2  -7.016 -14.971  13.225
    8    HG   SER   2           HG       SER   2  -4.220 -13.857  12.037
    9    HB2  SER   2           HB2      SER   2  -5.779 -16.043  11.318
   10    HB3  SER   2           HB1      SER   2  -5.654 -14.447  10.575
   11    H    HIS   3           HN       HIS   3  -6.793 -12.844  10.375
   12    HA   HIS   3           HA       HIS   3  -6.180 -10.549  11.914
   13    HD1  HIS   3           HD1      HIS   3  -5.336 -12.193   7.976
   14    HD2  HIS   3           HD2      HIS   3  -3.783  -9.449  10.684
   15    HE1  HIS   3           HE1      HIS   3  -2.837 -12.358   7.742
   16    HE2  HIS   3           HE2      HIS   3  -1.917 -10.685   9.387
   17    HB2  HIS   3           HB2      HIS   3  -7.113 -10.840   9.055
   18    HB3  HIS   3           HB1      HIS   3  -6.593  -9.317   9.768
   19    H    GLY   4           HN       GLY   4  -9.138 -12.056  10.977
   20    HA2  GLY   4           HA2      GLY   4 -11.195 -11.576  12.064
   21    HA3  GLY   4           HA1      GLY   4 -10.621  -9.944  12.371
   22    H    TYR   5           HN       TYR   5 -10.039  -8.812  10.122
   23    HA   TYR   5           HA       TYR   5 -12.520  -8.949   8.574
   24    HD1  TYR   5           HD2      TYR   5 -11.278  -6.999  11.319
   25    HD2  TYR   5           HD1      TYR   5 -13.731  -5.810   8.052
   26    HE1  TYR   5           HE2      TYR   5 -12.860  -5.964  12.892
   27    HE2  TYR   5           HE1      TYR   5 -15.319  -4.772   9.617
   28    HH   TYR   5           HH       TYR   5 -15.968  -4.972  11.988
   29    HB2  TYR   5           HB2      TYR   5 -10.419  -6.816   8.905
   30    HB3  TYR   5           HB1      TYR   5 -11.623  -6.737   7.625
   31    H    SER   6           HN       SER   6 -11.846 -10.877   7.434
   32    HA   SER   6           HA       SER   6 -10.059 -10.229   5.194
   33    HG   SER   6           HG       SER   6  -7.841 -11.445   6.367
   34    HB2  SER   6           HB2      SER   6 -10.205 -12.887   6.640
   35    HB3  SER   6           HB1      SER   6  -9.240 -12.558   5.200
   36    H    ASP   7           HN       ASP   7 -13.010 -10.264   5.659
   37    HA   ASP   7           HA       ASP   7 -13.842 -11.133   3.142
   38    HB2  ASP   7           HB2      ASP   7 -13.493 -13.404   4.007
   39    HB3  ASP   7           HB1      ASP   7 -14.555 -13.059   5.368
   40    H    ALA   8           HN       ALA   8 -14.850  -9.113   3.259
   41    HA   ALA   8           HA       ALA   8 -17.494  -9.160   4.390
   42    HB1  ALA   8           HB3      ALA   8 -15.545  -7.099   5.416
   43    HB2  ALA   8           HB1      ALA   8 -16.168  -8.467   6.339
   44    HB3  ALA   8           HB2      ALA   8 -17.264  -7.195   5.797
   45    H    SER   9           HN       SER   9 -18.444  -8.676   2.497
   46    HA   SER   9           HA       SER   9 -19.142  -7.493   0.690
   47    HG   SER   9           HG       SER   9 -20.328  -6.497   2.315
   48    HB2  SER   9           HB2      SER   9 -17.884  -5.194   2.206
   49    HB3  SER   9           HB1      SER   9 -18.929  -5.016   0.797
   50    H    GLY  10           HN       GLY  10 -16.346  -8.623   0.889
   51    HA2  GLY  10           HA2      GLY  10 -14.816  -8.942  -0.854
   52    HA3  GLY  10           HA1      GLY  10 -15.415  -7.478  -1.619
   53    H    PHE  11           HN       PHE  11 -14.779  -7.001   1.657
   54    HA   PHE  11           HA       PHE  11 -12.251  -5.663   0.977
   55    HD1  PHE  11           HD2      PHE  11 -12.170  -2.991   1.024
   56    HD2  PHE  11           HD1      PHE  11 -16.074  -4.312   2.082
   57    HE1  PHE  11           HE2      PHE  11 -13.146  -1.256  -0.423
   58    HE2  PHE  11           HE1      PHE  11 -17.057  -2.581   0.637
   59    HZ   PHE  11           HZ       PHE  11 -15.582  -1.045  -0.619
   60    HB2  PHE  11           HB2      PHE  11 -14.232  -5.171   3.206
   61    HB3  PHE  11           HB1      PHE  11 -12.664  -4.376   3.106
   62    H    SER  12           HN       SER  12 -10.847  -7.370   1.196
   63    HA   SER  12           HA       SER  12 -10.632  -8.549   3.883
   64    HG   SER  12           HG       SER  12  -9.000 -10.260   3.801
   65    HB2  SER  12           HB2      SER  12 -10.999 -10.235   2.173
   66    HB3  SER  12           HB1      SER  12  -9.666  -9.597   1.213
   67    H    LEU  13           HN       LEU  13  -8.686  -8.524   4.960
   68    HA   LEU  13           HA       LEU  13  -6.833  -6.462   4.129
   69    HG   LEU  13           HG       LEU  13  -8.755  -6.567   6.500
   70    HB2  LEU  13           HB2      LEU  13  -6.876  -8.209   6.592
   71    HB3  LEU  13           HB1      LEU  13  -5.761  -6.884   6.318
   72   HD11  LEU  13          HD11      LEU  13  -7.808  -7.302   8.632
   73   HD12  LEU  13          HD12      LEU  13  -8.345  -5.624   8.708
   74   HD13  LEU  13          HD13      LEU  13  -6.627  -5.995   8.559
   75   HD21  LEU  13          HD23      LEU  13  -6.482  -4.597   6.360
   76   HD22  LEU  13          HD21      LEU  13  -8.139  -4.168   6.780
   77   HD23  LEU  13          HD22      LEU  13  -7.776  -4.824   5.184
   78    H    TYR  14           HN       TYR  14  -5.070  -6.821   2.987
   79    HA   TYR  14           HA       TYR  14  -3.913  -9.529   2.986
   80    HD1  TYR  14           HD2      TYR  14  -4.026 -11.122   0.440
   81    HD2  TYR  14           HD1      TYR  14  -6.453  -7.624   0.600
   82    HE1  TYR  14           HE2      TYR  14  -5.931 -12.404  -0.438
   83    HE2  TYR  14           HE1      TYR  14  -8.360  -8.902  -0.279
   84    HH   TYR  14           HH       TYR  14  -8.389 -12.286  -0.440
   85    HB2  TYR  14           HB2      TYR  14  -4.051  -7.461   0.791
   86    HB3  TYR  14           HB1      TYR  14  -3.031  -8.893   0.702
   87    H    SER  15           HN       SER  15  -1.636  -9.734   2.948
   88    HA   SER  15           HA       SER  15  -0.048  -7.325   3.358
   89    HG   SER  15           HG       SER  15   0.646 -10.358   5.396
   90    HB2  SER  15           HB2      SER  15   0.974  -8.209   5.424
   91    HB3  SER  15           HB1      SER  15  -0.757  -7.932   5.621
   92    H    VAL  16           HN       VAL  16   2.015  -7.498   2.639
   93    HA   VAL  16           HA       VAL  16   3.052 -10.163   1.974
   94    HB   VAL  16           HB       VAL  16   3.170  -7.819   0.068
   95   HG11  VAL  16          HG11      VAL  16   4.042 -10.690  -0.245
   96   HG12  VAL  16          HG12      VAL  16   5.102  -9.290  -0.081
   97   HG13  VAL  16          HG13      VAL  16   4.081  -9.460  -1.508
   98   HG21  VAL  16          HG23      VAL  16   1.646  -9.122  -1.346
   99   HG22  VAL  16          HG21      VAL  16   0.903  -8.693   0.194
  100   HG23  VAL  16          HG22      VAL  16   1.503 -10.330  -0.069
  101    H    GLU  17           HN       GLU  17   5.219 -10.412   2.273
  102    HA   GLU  17           HA       GLU  17   6.607  -8.221   3.594
  103    HB2  GLU  17           HB2      GLU  17   7.244 -11.147   3.245
  104    HB3  GLU  17           HB1      GLU  17   8.378 -10.012   3.962
  105    HG2  GLU  17           HG2      GLU  17   7.181 -11.204   5.683
  106    HG3  GLU  17           HG1      GLU  17   6.748  -9.496   5.711
  107    H    LEU  18           HN       LEU  18   7.687  -6.828   2.386
  108    HA   LEU  18           HA       LEU  18   9.128  -7.826   0.018
  109    HG   LEU  18           HG       LEU  18   7.218  -5.450  -1.965
  110    HB2  LEU  18           HB2      LEU  18   7.426  -5.486   0.452
  111    HB3  LEU  18           HB1      LEU  18   8.965  -5.092  -0.288
  112   HD11  LEU  18          HD11      LEU  18   8.418  -7.046  -3.372
  113   HD12  LEU  18          HD12      LEU  18   9.334  -7.597  -1.968
  114   HD13  LEU  18          HD13      LEU  18   9.525  -5.943  -2.553
  115   HD21  LEU  18          HD23      LEU  18   5.835  -7.044  -0.751
  116   HD22  LEU  18          HD21      LEU  18   7.108  -8.260  -0.875
  117   HD23  LEU  18          HD22      LEU  18   6.291  -7.687  -2.329
  118    H    PHE  19           HN       PHE  19  11.236  -7.972   0.377
  119    HA   PHE  19           HA       PHE  19  12.493  -6.229   2.359
  120    HD1  PHE  19           HD2      PHE  19  11.797  -9.970   0.830
  121    HD2  PHE  19           HD1      PHE  19  15.616  -8.201   0.196
  122    HE1  PHE  19           HE2      PHE  19  12.170 -11.470  -1.082
  123    HE2  PHE  19           HE1      PHE  19  15.995  -9.698  -1.719
  124    HZ   PHE  19           HZ       PHE  19  14.272 -11.337  -2.360
  125    HB2  PHE  19           HB2      PHE  19  14.415  -7.764   2.190
  126    HB3  PHE  19           HB1      PHE  19  12.927  -8.623   2.575
  127    H    ARG  20           HN       ARG  20  13.936  -4.663   1.874
  128    HA   ARG  20           HA       ARG  20  14.585  -4.326  -0.986
  129    HE   ARG  20           HE       ARG  20  15.384  -0.233   1.062
  130    HB2  ARG  20           HB2      ARG  20  13.206  -2.551   0.271
  131    HB3  ARG  20           HB1      ARG  20  14.718  -2.129   1.064
  132    HG2  ARG  20           HG2      ARG  20  15.716  -1.763  -1.191
  133    HG3  ARG  20           HG1      ARG  20  14.112  -2.009  -1.881
  134    HD2  ARG  20           HD2      ARG  20  14.488   0.346  -1.658
  135    HD3  ARG  20           HD1      ARG  20  13.284  -0.140  -0.466
  136   HH11  ARG  20          HH11      ARG  20  14.716   2.102  -1.437
  137   HH12  ARG  20          HH12      ARG  20  15.622   3.367  -0.675
  138   HH21  ARG  20          HH21      ARG  20  16.577   1.426   2.072
  139   HH22  ARG  20          HH22      ARG  20  16.677   2.982   1.319
  140    H    GLU  21           HN       GLU  21  16.458  -5.612  -0.956
  141    HA   GLU  21           HA       GLU  21  18.809  -4.213  -0.054
  142    HB2  GLU  21           HB2      GLU  21  18.055  -5.547   1.944
  143    HB3  GLU  21           HB1      GLU  21  18.340  -7.003   1.000
  144    HG2  GLU  21           HG2      GLU  21  20.695  -6.419   0.789
  145    HG3  GLU  21           HG1      GLU  21  20.416  -4.939   1.705
  146    H    LYS  22           HN       LYS  22  18.522  -4.377  -2.532
  147    HA   LYS  22           HA       LYS  22  20.318  -6.486  -3.429
  148    HB2  LYS  22           HB2      LYS  22  17.592  -5.978  -4.596
  149    HB3  LYS  22           HB1      LYS  22  18.856  -6.819  -5.476
  150    HG2  LYS  22           HG2      LYS  22  17.694  -7.701  -2.840
  151    HG3  LYS  22           HG1      LYS  22  17.263  -8.357  -4.421
  152    HD2  LYS  22           HD2      LYS  22  19.568  -9.100  -4.746
  153    HD3  LYS  22           HD1      LYS  22  20.014  -8.424  -3.179
  154    HE2  LYS  22           HE2      LYS  22  18.438  -9.957  -2.086
  155    HE3  LYS  22           HE1      LYS  22  18.031 -10.645  -3.658
  156    HZ1  LYS  22           HZ3      LYS  22  20.715 -10.697  -2.386
  157    HZ2  LYS  22           HZ1      LYS  22  20.333 -11.350  -3.899
  158    HZ3  LYS  22           HZ2      LYS  22  19.649 -12.006  -2.498
  159    H    ASP  23           HN       ASP  23  20.637  -3.735  -2.969
  160    HA   ASP  23           HA       ASP  23  21.579  -1.873  -3.882
  161    HB2  ASP  23           HB2      ASP  23  23.082  -3.660  -4.845
  162    HB3  ASP  23           HB1      ASP  23  22.108  -3.594  -6.310
  163    H    THR  24           HN       THR  24  18.716  -2.544  -4.404
  164    HA   THR  24           HA       THR  24  18.238  -1.291  -6.995
  165    HB   THR  24           HB       THR  24  15.862  -1.778  -6.591
  166    HG1  THR  24           HG1      THR  24  16.774  -2.951  -4.155
  167   HG21  THR  24          HG23      THR  24  17.262  -3.486  -7.647
  168   HG22  THR  24          HG21      THR  24  16.012  -4.225  -6.646
  169   HG23  THR  24          HG22      THR  24  17.673  -4.138  -6.061
  170    H    SER  25           HN       SER  25  18.090  -0.586  -3.603
  171    HA   SER  25           HA       SER  25  17.498   1.246  -2.392
  172    HG   SER  25           HG       SER  25  19.249   2.554  -5.633
  173    HB2  SER  25           HB2      SER  25  18.299   3.380  -3.264
  174    HB3  SER  25           HB1      SER  25  19.470   2.107  -3.605
  175    H    SER  26           HN       SER  26  15.428   0.067  -4.195
  176    HA   SER  26           HA       SER  26  13.447   2.111  -3.794
  177    HG   SER  26           HG       SER  26  14.939   1.371  -7.332
  178    HB2  SER  26           HB2      SER  26  12.701   2.209  -6.145
  179    HB3  SER  26           HB1      SER  26  14.342   2.828  -5.959
  180    H    LEU  27           HN       LEU  27  11.365   1.309  -3.749
  181    HA   LEU  27           HA       LEU  27  11.173  -1.616  -3.826
  182    HG   LEU  27           HG       LEU  27  11.558  -0.308  -1.231
  183    HB2  LEU  27           HB2      LEU  27   9.535   0.496  -2.440
  184    HB3  LEU  27           HB1      LEU  27   8.994  -1.165  -2.575
  185   HD11  LEU  27          HD11      LEU  27  10.396  -0.839   0.862
  186   HD12  LEU  27          HD12      LEU  27   8.904  -1.099  -0.041
  187   HD13  LEU  27          HD13      LEU  27   9.636   0.504   0.009
  188   HD21  LEU  27          HD23      LEU  27  11.692  -2.559  -2.098
  189   HD22  LEU  27          HD21      LEU  27  10.136  -2.964  -1.370
  190   HD23  LEU  27          HD22      LEU  27  11.525  -2.611  -0.343
  191    H    GLY  28           HN       GLY  28  10.032   1.269  -5.340
  192    HA2  GLY  28           HA2      GLY  28   9.061   1.313  -7.487
  193    HA3  GLY  28           HA1      GLY  28   8.573  -0.361  -7.277
  194    H    ILE  29           HN       ILE  29   7.681   0.836  -4.464
  195    HA   ILE  29           HA       ILE  29   4.937   0.841  -4.998
  196    HB   ILE  29           HB       ILE  29   6.354   2.156  -2.675
  197   HG12  ILE  29          HG12      ILE  29   5.215  -0.639  -2.909
  198   HG13  ILE  29          HG11      ILE  29   6.928  -0.246  -3.013
  199   HG21  ILE  29          HG21      ILE  29   4.027   2.867  -2.916
  200   HG22  ILE  29          HG22      ILE  29   4.245   1.861  -1.484
  201   HG23  ILE  29          HG23      ILE  29   3.513   1.180  -2.936
  202   HD11  ILE  29          HD13      ILE  29   5.144   0.151  -0.624
  203   HD12  ILE  29          HD11      ILE  29   6.839   0.628  -0.718
  204   HD13  ILE  29          HD12      ILE  29   6.396  -1.076  -0.817
  205    H    SER  30           HN       SER  30   3.971   2.241  -6.330
  206    HA   SER  30           HA       SER  30   4.689   5.089  -6.120
  207    HG   SER  30           HG       SER  30   4.501   6.015  -9.003
  208    HB2  SER  30           HB2      SER  30   5.120   4.134  -8.338
  209    HB3  SER  30           HB1      SER  30   3.444   3.601  -8.444
  210    H    ILE  31           HN       ILE  31   3.293   6.131  -4.872
  211    HA   ILE  31           HA       ILE  31   0.472   5.328  -4.877
  212    HB   ILE  31           HB       ILE  31   0.272   6.692  -2.829
  213   HG12  ILE  31          HG12      ILE  31   3.272   7.014  -3.086
  214   HG13  ILE  31          HG11      ILE  31   2.095   8.293  -3.362
  215   HG21  ILE  31          HG21      ILE  31   0.763   4.306  -2.685
  216   HG22  ILE  31          HG22      ILE  31   1.533   5.193  -1.370
  217   HG23  ILE  31          HG23      ILE  31   2.491   4.652  -2.747
  218   HD11  ILE  31          HD13      ILE  31   3.074   8.531  -1.179
  219   HD12  ILE  31          HD11      ILE  31   2.629   6.876  -0.762
  220   HD13  ILE  31          HD12      ILE  31   1.374   8.089  -1.016
  221    H    SER  32           HN       SER  32  -1.062   7.255  -4.467
  222    HA   SER  32           HA       SER  32  -0.273   9.667  -5.899
  223    HG   SER  32           HG       SER  32  -1.374   8.007  -8.770
  224    HB2  SER  32           HB2      SER  32  -2.607   7.943  -6.761
  225    HB3  SER  32           HB1      SER  32  -2.241   9.548  -7.394
  226    H    GLY  33           HN       GLY  33  -1.305  11.473  -5.199
  227    HA2  GLY  33           HA2      GLY  33  -2.841  11.273  -2.785
  228    HA3  GLY  33           HA1      GLY  33  -2.408  12.754  -3.624
  229    H    MET  34           HN       MET  34  -4.907  12.365  -2.449
  230    HA   MET  34           HA       MET  34  -6.682  11.986  -4.764
  231    HB2  MET  34           HB2      MET  34  -7.202  10.504  -2.909
  232    HB3  MET  34           HB1      MET  34  -7.284  11.870  -1.805
  233    HG2  MET  34           HG2      MET  34  -9.218  12.737  -3.007
  234    HG3  MET  34           HG1      MET  34  -9.132  11.383  -4.131
  235    HE1  MET  34           HE3      MET  34 -10.070   8.341  -1.903
  236    HE2  MET  34           HE1      MET  34  -8.448   8.918  -2.287
  237    HE3  MET  34           HE2      MET  34  -9.699   8.909  -3.531
  238    H    ARG  35           HN       ARG  35  -8.055  13.583  -5.406
  239    HA   ARG  35           HA       ARG  35  -8.608  15.894  -3.831
  240    HE   ARG  35           HE       ARG  35  -5.746  15.315  -8.842
  241    HB2  ARG  35           HB2      ARG  35  -7.472  17.562  -5.158
  242    HB3  ARG  35           HB1      ARG  35  -6.294  16.407  -4.557
  243    HG2  ARG  35           HG2      ARG  35  -7.469  16.200  -7.311
  244    HG3  ARG  35           HG1      ARG  35  -6.048  17.184  -6.960
  245    HD2  ARG  35           HD2      ARG  35  -4.884  15.216  -6.110
  246    HD3  ARG  35           HD1      ARG  35  -6.309  14.226  -6.424
  247   HH11  ARG  35          HH11      ARG  35  -3.879  13.520  -6.511
  248   HH12  ARG  35          HH12      ARG  35  -2.848  12.799  -7.700
  249   HH21  ARG  35          HH21      ARG  35  -4.391  14.369 -10.415
  250   HH22  ARG  35          HH22      ARG  35  -3.137  13.284  -9.920
  251    H    ASP  36           HN       ASP  36 -10.478  16.779  -4.468
  252    HA   ASP  36           HA       ASP  36 -11.352  16.573  -7.232
  253    HB2  ASP  36           HB2      ASP  36 -12.889  15.315  -4.950
  254    HB3  ASP  36           HB1      ASP  36 -13.548  15.585  -6.560
  255    H    GLN  37           HN       GLN  37 -12.893  17.198  -4.077
  256    HA   GLN  37           HA       GLN  37 -13.496  19.927  -5.010
  257    HB2  GLN  37           HB2      GLN  37 -15.643  19.766  -3.753
  258    HB3  GLN  37           HB1      GLN  37 -15.547  18.672  -5.126
  259    HG2  GLN  37           HG2      GLN  37 -15.001  16.829  -3.618
  260    HG3  GLN  37           HG1      GLN  37 -15.104  17.928  -2.244
  261   HE21  GLN  37          HE21      GLN  37 -17.108  18.670  -1.571
  262   HE22  GLN  37          HE22      GLN  37 -18.585  17.929  -2.076
  263    H    SER  38           HN       SER  38 -13.414  21.564  -3.492
  264    HA   SER  38           HA       SER  38 -11.619  21.215  -1.341
  265    HG   SER  38           HG       SER  38 -10.886  22.880  -2.753
  266    HB2  SER  38           HB2      SER  38 -13.503  23.515  -1.925
  267    HB3  SER  38           HB1      SER  38 -12.160  23.563  -0.781
  268    H    THR  39           HN       THR  39 -12.313  19.743   0.153
  269    HA   THR  39           HA       THR  39 -14.957  19.971   1.324
  270    HB   THR  39           HB       THR  39 -14.281  18.011   2.685
  271    HG1  THR  39           HG1      THR  39 -11.819  18.489   1.370
  272   HG21  THR  39          HG23      THR  39 -13.778  17.745  -0.281
  273   HG22  THR  39          HG21      THR  39 -15.343  17.646   0.527
  274   HG23  THR  39          HG22      THR  39 -14.120  16.410   0.820
  275    H    THR  40           HN       THR  40 -15.399  20.471   3.464
  276    HA   THR  40           HA       THR  40 -13.551  22.312   4.691
  277    HB   THR  40           HB       THR  40 -15.933  22.837   4.701
  278    HG1  THR  40           HG1      THR  40 -15.982  23.505   6.809
  279   HG21  THR  40          HG23      THR  40 -17.508  21.555   6.062
  280   HG22  THR  40          HG21      THR  40 -16.238  20.395   6.452
  281   HG23  THR  40          HG22      THR  40 -16.812  20.550   4.791
  282    H    GLY  41           HN       GLY  41 -13.590  19.084   4.671
  283    HA2  GLY  41           HA2      GLY  41 -12.456  18.932   7.388
  284    HA3  GLY  41           HA1      GLY  41 -13.603  17.717   6.840
  285    H    GLU  42           HN       GLU  42 -12.662  15.889   6.252
  286    HA   GLU  42           HA       GLU  42  -9.981  16.021   5.037
  287    HB2  GLU  42           HB2      GLU  42 -11.209  13.770   6.636
  288    HB3  GLU  42           HB1      GLU  42  -9.606  13.754   5.914
  289    HG2  GLU  42           HG2      GLU  42 -10.569  15.561   8.118
  290    HG3  GLU  42           HG1      GLU  42  -9.442  14.214   8.266
  291    H    ALA  43           HN       ALA  43  -9.517  14.704   3.273
  292    HA   ALA  43           HA       ALA  43 -11.379  12.867   2.160
  293    HB1  ALA  43           HB3      ALA  43 -11.147  15.521   0.745
  294    HB2  ALA  43           HB1      ALA  43 -12.567  14.943   1.617
  295    HB3  ALA  43           HB2      ALA  43 -12.020  14.102   0.167
  296    H    THR  44           HN       THR  44  -8.640  12.828   2.810
  297    HA   THR  44           HA       THR  44  -7.522  12.206   0.174
  298    HB   THR  44           HB       THR  44  -5.321  13.136   0.833
  299    HG1  THR  44           HG1      THR  44  -5.657  13.160   3.108
  300   HG21  THR  44          HG23      THR  44  -5.875  15.483   0.467
  301   HG22  THR  44          HG21      THR  44  -7.559  15.164   0.877
  302   HG23  THR  44          HG22      THR  44  -6.854  14.448  -0.571
  303    H    GLY  45           HN       GLY  45  -6.305  10.379   0.110
  304    HA2  GLY  45           HA2      GLY  45  -5.405   9.175   2.621
  305    HA3  GLY  45           HA1      GLY  45  -6.550   8.260   1.652
  306    H    ILE  46           HN       ILE  46  -3.952   7.384   2.345
  307    HA   ILE  46           HA       ILE  46  -2.341   7.683  -0.066
  308    HB   ILE  46           HB       ILE  46  -1.770   6.106   2.447
  309   HG12  ILE  46          HG12      ILE  46  -1.929   8.523   2.873
  310   HG13  ILE  46          HG11      ILE  46  -0.273   7.953   3.045
  311   HG21  ILE  46          HG21      ILE  46   0.013   6.847   0.132
  312   HG22  ILE  46          HG22      ILE  46  -0.545   5.228   0.556
  313   HG23  ILE  46          HG23      ILE  46   0.555   6.091   1.632
  314   HD11  ILE  46          HD13      ILE  46  -1.406   9.411   0.669
  315   HD12  ILE  46          HD11      ILE  46   0.251   8.829   0.826
  316   HD13  ILE  46          HD12      ILE  46  -0.348  10.088   1.906
  317    H    TYR  47           HN       TYR  47  -2.296   6.248  -1.671
  318    HA   TYR  47           HA       TYR  47  -2.875   3.458  -1.233
  319    HD1  TYR  47           HD1      TYR  47  -5.282   6.791  -1.630
  320    HD2  TYR  47           HD2      TYR  47  -4.615   4.335  -5.041
  321    HE1  TYR  47           HE1      TYR  47  -5.907   8.664  -3.095
  322    HE2  TYR  47           HE2      TYR  47  -5.236   6.203  -6.514
  323    HH   TYR  47           HH       TYR  47  -6.548   8.278  -6.403
  324    HB2  TYR  47           HB2      TYR  47  -4.735   3.361  -2.855
  325    HB3  TYR  47           HB1      TYR  47  -5.142   4.331  -1.443
  326    H    VAL  48           HN       VAL  48  -2.035   2.147  -2.815
  327    HA   VAL  48           HA       VAL  48  -0.230   3.427  -4.688
  328    HB   VAL  48           HB       VAL  48  -0.695   0.508  -4.060
  329   HG11  VAL  48          HG11      VAL  48   1.401   1.793  -5.809
  330   HG12  VAL  48          HG12      VAL  48   0.095   0.734  -6.343
  331   HG13  VAL  48          HG13      VAL  48   1.382   0.099  -5.318
  332   HG21  VAL  48          HG23      VAL  48   0.295   1.817  -2.236
  333   HG22  VAL  48          HG21      VAL  48   1.578   2.347  -3.323
  334   HG23  VAL  48          HG22      VAL  48   1.432   0.641  -2.896
  335    H    LYS  49           HN       LYS  49  -0.451   3.520  -6.850
  336    HA   LYS  49           HA       LYS  49  -2.787   2.181  -8.044
  337    HB2  LYS  49           HB2      LYS  49  -3.140   4.617  -7.799
  338    HB3  LYS  49           HB1      LYS  49  -1.699   4.909  -8.764
  339    HG2  LYS  49           HG2      LYS  49  -2.754   3.796 -10.672
  340    HG3  LYS  49           HG1      LYS  49  -4.200   3.515  -9.702
  341    HD2  LYS  49           HD2      LYS  49  -4.599   5.441 -11.056
  342    HD3  LYS  49           HD1      LYS  49  -4.373   5.994  -9.396
  343    HE2  LYS  49           HE2      LYS  49  -2.059   6.588  -9.906
  344    HE3  LYS  49           HE1      LYS  49  -2.272   6.019 -11.561
  345    HZ1  LYS  49           HZ3      LYS  49  -2.493   8.416 -11.421
  346    HZ2  LYS  49           HZ1      LYS  49  -3.750   8.266 -10.299
  347    HZ3  LYS  49           HZ2      LYS  49  -3.962   7.719 -11.885
  348    H    SER  50           HN       SER  50   0.577   2.880  -8.213
  349    HA   SER  50           HA       SER  50   0.763   1.246 -10.637
  350    HG   SER  50           HG       SER  50   3.541   2.647 -11.428
  351    HB2  SER  50           HB2      SER  50   0.877   3.558 -11.421
  352    HB3  SER  50           HB1      SER  50   2.172   3.902 -10.274
  353    H    LEU  51           HN       LEU  51   2.937   0.408 -11.026
  354    HA   LEU  51           HA       LEU  51   4.661   0.336  -8.655
  355    HG   LEU  51           HG       LEU  51   2.089  -1.374  -8.444
  356    HB2  LEU  51           HB2      LEU  51   3.683  -2.075 -10.188
  357    HB3  LEU  51           HB1      LEU  51   4.964  -2.115  -8.994
  358   HD11  LEU  51          HD11      LEU  51   2.035  -3.507  -7.219
  359   HD12  LEU  51          HD12      LEU  51   3.656  -3.871  -7.811
  360   HD13  LEU  51          HD13      LEU  51   2.313  -3.731  -8.947
  361   HD21  LEU  51          HD23      LEU  51   4.437  -1.727  -6.583
  362   HD22  LEU  51          HD21      LEU  51   2.764  -1.481  -6.084
  363   HD23  LEU  51          HD22      LEU  51   3.619  -0.210  -6.957
  364    H    ILE  52           HN       ILE  52   6.733   0.655  -9.154
  365    HA   ILE  52           HA       ILE  52   7.579   1.150 -11.790
  366    HB   ILE  52           HB       ILE  52   9.270   0.591  -9.348
  367   HG12  ILE  52          HG12      ILE  52   7.766   2.482  -9.004
  368   HG13  ILE  52          HG11      ILE  52   9.422   3.051  -9.181
  369   HG21  ILE  52          HG21      ILE  52  11.031   1.815 -10.557
  370   HG22  ILE  52          HG22      ILE  52   9.991   1.872 -11.980
  371   HG23  ILE  52          HG23      ILE  52  10.566   0.320 -11.370
  372   HD11  ILE  52          HD13      ILE  52   7.271   3.134 -11.282
  373   HD12  ILE  52          HD11      ILE  52   8.940   3.654 -11.511
  374   HD13  ILE  52          HD12      ILE  52   7.904   4.500 -10.363
  375    HA   PRO  53           HA       PRO  53   8.063  -3.200 -12.928
  376    HB2  PRO  53           HB2      PRO  53   8.936  -2.705 -15.471
  377    HB3  PRO  53           HB1      PRO  53   7.231  -2.703 -15.003
  378    HG2  PRO  53           HG2      PRO  53   9.105  -0.389 -15.339
  379    HG3  PRO  53           HG1      PRO  53   7.422  -0.553 -15.877
  380    HD2  PRO  53           HD2      PRO  53   8.062   0.827 -13.665
  381    HD3  PRO  53           HD1      PRO  53   6.574  -0.138 -13.761
  382    H    GLY  54           HN       GLY  54   9.801  -3.873 -11.724
  383    HA2  GLY  54           HA2      GLY  54  12.067  -4.778 -12.405
  384    HA3  GLY  54           HA1      GLY  54  12.476  -3.095 -12.705
  385    H    SER  55           HN       SER  55  10.456  -3.047 -10.130
  386    HA   SER  55           HA       SER  55  12.708  -2.895  -8.264
  387    HG   SER  55           HG       SER  55  11.458   0.103  -7.927
  388    HB2  SER  55           HB2      SER  55   9.864  -1.895  -7.986
  389    HB3  SER  55           HB1      SER  55  11.151  -1.657  -6.803
  390    H    ALA  56           HN       ALA  56  12.006  -3.475  -5.910
  391    HA   ALA  56           HA       ALA  56  11.716  -6.231  -5.747
  392    HB1  ALA  56           HB3      ALA  56  12.700  -4.874  -3.975
  393    HB2  ALA  56           HB1      ALA  56  11.420  -5.915  -3.350
  394    HB3  ALA  56           HB2      ALA  56  11.113  -4.197  -3.606
  395    H    ALA  57           HN       ALA  57   9.271  -3.793  -4.825
  396    HA   ALA  57           HA       ALA  57   7.173  -5.478  -4.245
  397    HB1  ALA  57           HB3      ALA  57   7.132  -3.067  -3.847
  398    HB2  ALA  57           HB1      ALA  57   5.690  -3.603  -4.708
  399    HB3  ALA  57           HB2      ALA  57   6.984  -2.781  -5.580
  400    H    ALA  58           HN       ALA  58   8.365  -4.487  -7.390
  401    HA   ALA  58           HA       ALA  58   6.100  -5.532  -8.827
  402    HB1  ALA  58           HB3      ALA  58   7.373  -4.984 -10.829
  403    HB2  ALA  58           HB1      ALA  58   8.802  -4.661  -9.847
  404    HB3  ALA  58           HB2      ALA  58   7.375  -3.634  -9.694
  405    H    LEU  59           HN       LEU  59   9.285  -6.679  -7.907
  406    HA   LEU  59           HA       LEU  59   9.441  -8.884  -9.651
  407    HG   LEU  59           HG       LEU  59  11.561  -6.995  -8.850
  408    HB2  LEU  59           HB2      LEU  59  10.684  -8.355  -6.959
  409    HB3  LEU  59           HB1      LEU  59  11.021  -9.805  -7.885
  410   HD11  LEU  59          HD11      LEU  59  12.983  -7.564  -6.956
  411   HD12  LEU  59          HD12      LEU  59  13.914  -7.517  -8.453
  412   HD13  LEU  59          HD13      LEU  59  13.454  -9.066  -7.749
  413   HD21  LEU  59          HD23      LEU  59  12.864  -8.121 -10.595
  414   HD22  LEU  59          HD21      LEU  59  11.160  -8.568 -10.663
  415   HD23  LEU  59          HD22      LEU  59  12.337  -9.685  -9.974
  416    H    ASP  60           HN       ASP  60   8.497  -8.777  -6.212
  417    HA   ASP  60           HA       ASP  60   7.765 -11.440  -5.942
  418    HB2  ASP  60           HB2      ASP  60   6.646  -8.996  -4.561
  419    HB3  ASP  60           HB1      ASP  60   6.328 -10.653  -4.055
  420    H    GLY  61           HN       GLY  61   5.924  -8.710  -7.184
  421    HA2  GLY  61           HA2      GLY  61   3.983  -8.620  -8.404
  422    HA3  GLY  61           HA1      GLY  61   4.239 -10.319  -8.765
  423    H    ARG  62           HN       ARG  62   4.154  -9.870  -5.453
  424    HA   ARG  62           HA       ARG  62   1.553 -11.117  -5.283
  425    HE   ARG  62           HE       ARG  62   2.276 -12.870  -1.792
  426    HB2  ARG  62           HB2      ARG  62   3.431 -10.265  -3.071
  427    HB3  ARG  62           HB1      ARG  62   2.028 -11.313  -2.896
  428    HG2  ARG  62           HG2      ARG  62   3.104 -12.960  -4.373
  429    HG3  ARG  62           HG1      ARG  62   4.524 -11.918  -4.467
  430    HD2  ARG  62           HD2      ARG  62   4.851 -13.685  -2.823
  431    HD3  ARG  62           HD1      ARG  62   4.821 -12.103  -2.047
  432   HH11  ARG  62          HH11      ARG  62   5.257 -14.566  -1.169
  433   HH12  ARG  62          HH12      ARG  62   4.587 -15.540   0.096
  434   HH21  ARG  62          HH21      ARG  62   1.387 -14.148  -0.129
  435   HH22  ARG  62          HH22      ARG  62   2.387 -15.303   0.688
  436    H    ILE  63           HN       ILE  63   2.406  -8.041  -5.735
  437    HA   ILE  63           HA       ILE  63   0.334  -6.953  -3.948
  438    HB   ILE  63           HB       ILE  63   2.550  -5.447  -5.346
  439   HG12  ILE  63          HG12      ILE  63   2.287  -6.169  -2.419
  440   HG13  ILE  63          HG11      ILE  63   3.336  -7.007  -3.557
  441   HG21  ILE  63          HG21      ILE  63   1.886  -3.592  -3.883
  442   HG22  ILE  63          HG22      ILE  63   0.557  -4.571  -3.258
  443   HG23  ILE  63          HG23      ILE  63   0.574  -4.085  -4.954
  444   HD11  ILE  63          HD13      ILE  63   4.592  -4.944  -3.914
  445   HD12  ILE  63          HD11      ILE  63   4.586  -5.422  -2.216
  446   HD13  ILE  63          HD12      ILE  63   3.542  -4.111  -2.768
  447    H    GLU  64           HN       GLU  64  -1.433  -6.015  -4.788
  448    HA   GLU  64           HA       GLU  64  -1.630  -5.874  -7.719
  449    HB2  GLU  64           HB2      GLU  64  -3.196  -7.422  -6.632
  450    HB3  GLU  64           HB1      GLU  64  -3.811  -6.110  -5.637
  451    HG2  GLU  64           HG2      GLU  64  -5.360  -6.500  -7.400
  452    HG3  GLU  64           HG1      GLU  64  -4.554  -4.963  -7.710
  453    HA   PRO  65           HA       PRO  65  -1.577  -1.406  -7.322
  454    HB2  PRO  65           HB2      PRO  65  -2.885  -0.946  -9.738
  455    HB3  PRO  65           HB1      PRO  65  -1.141  -1.118  -9.532
  456    HG2  PRO  65           HG2      PRO  65  -3.157  -3.143 -10.403
  457    HG3  PRO  65           HG1      PRO  65  -1.501  -2.882 -10.985
  458    HD2  PRO  65           HD2      PRO  65  -2.073  -4.897  -9.332
  459    HD3  PRO  65           HD1      PRO  65  -0.558  -3.985  -9.167
  460    H    ASN  66           HN       ASN  66  -3.233   0.402  -7.628
  461    HA   ASN  66           HA       ASN  66  -5.187   1.373  -6.987
  462    HB2  ASN  66           HB2      ASN  66  -6.286  -1.218  -8.088
  463    HB3  ASN  66           HB1      ASN  66  -7.310   0.100  -7.529
  464   HD21  ASN  66          HD21      ASN  66  -4.255   0.587  -9.162
  465   HD22  ASN  66          HD22      ASN  66  -4.919   1.234 -10.618
  466    H    ASP  67           HN       ASP  67  -3.635  -0.350  -5.147
  467    HA   ASP  67           HA       ASP  67  -5.695  -1.336  -3.320
  468    HB2  ASP  67           HB2      ASP  67  -3.833  -2.315  -2.062
  469    HB3  ASP  67           HB1      ASP  67  -3.751  -2.783  -3.757
  470    H    LYS  68           HN       LYS  68  -5.692  -0.697  -1.074
  471    HA   LYS  68           HA       LYS  68  -4.825   2.091  -0.744
  472    HB2  LYS  68           HB2      LYS  68  -7.250   1.620  -0.530
  473    HB3  LYS  68           HB1      LYS  68  -6.903   0.548   0.819
  474    HG2  LYS  68           HG2      LYS  68  -6.078   2.387   2.132
  475    HG3  LYS  68           HG1      LYS  68  -6.253   3.486   0.762
  476    HD2  LYS  68           HD2      LYS  68  -8.683   3.080   0.779
  477    HD3  LYS  68           HD1      LYS  68  -8.483   2.035   2.186
  478    HE2  LYS  68           HE2      LYS  68  -7.638   3.895   3.485
  479    HE3  LYS  68           HE1      LYS  68  -7.721   4.949   2.075
  480    HZ1  LYS  68           HZ3      LYS  68 -10.121   4.666   2.049
  481    HZ2  LYS  68           HZ1      LYS  68  -9.611   5.278   3.542
  482    HZ3  LYS  68           HZ2      LYS  68 -10.041   3.649   3.399
  483    H    ILE  69           HN       ILE  69  -2.929   2.241   0.257
  484    HA   ILE  69           HA       ILE  69  -1.866   0.251   1.979
  485    HB   ILE  69           HB       ILE  69  -0.987   3.129   1.713
  486   HG12  ILE  69          HG12      ILE  69  -1.037   1.978  -0.464
  487   HG13  ILE  69          HG11      ILE  69   0.611   2.322   0.048
  488   HG21  ILE  69          HG21      ILE  69   0.509   0.690   2.671
  489   HG22  ILE  69          HG22      ILE  69  -0.093   2.000   3.686
  490   HG23  ILE  69          HG23      ILE  69   1.174   2.315   2.501
  491   HD11  ILE  69          HD13      ILE  69   0.883   0.008   0.749
  492   HD12  ILE  69          HD11      ILE  69   0.419   0.113  -0.950
  493   HD13  ILE  69          HD12      ILE  69  -0.776  -0.340   0.264
  494    H    LEU  70           HN       LEU  70  -1.978   0.011   4.129
  495    HA   LEU  70           HA       LEU  70  -3.556   1.979   5.633
  496    HG   LEU  70           HG       LEU  70  -4.550  -0.696   4.436
  497    HB2  LEU  70           HB2      LEU  70  -2.911  -0.893   6.305
  498    HB3  LEU  70           HB1      LEU  70  -3.923   0.174   7.258
  499   HD11  LEU  70          HD11      LEU  70  -4.607  -2.592   5.964
  500   HD12  LEU  70          HD12      LEU  70  -6.234  -2.142   5.454
  501   HD13  LEU  70          HD13      LEU  70  -5.657  -1.692   7.058
  502   HD21  LEU  70          HD23      LEU  70  -6.221   0.729   6.505
  503   HD22  LEU  70          HD21      LEU  70  -6.766   0.211   4.910
  504   HD23  LEU  70          HD22      LEU  70  -5.527   1.457   5.057
  505    H    ARG  71           HN       ARG  71  -0.906  -0.308   6.331
  506    HA   ARG  71           HA       ARG  71   0.630   1.843   7.534
  507    HE   ARG  71           HE       ARG  71   1.390  -0.731  11.043
  508    HB2  ARG  71           HB2      ARG  71   0.946   0.604   9.652
  509    HB3  ARG  71           HB1      ARG  71  -0.715   1.124   9.406
  510    HG2  ARG  71           HG2      ARG  71  -1.361  -1.104   8.748
  511    HG3  ARG  71           HG1      ARG  71   0.315  -1.650   8.849
  512    HD2  ARG  71           HD2      ARG  71  -1.340  -0.604  11.145
  513    HD3  ARG  71           HD1      ARG  71  -0.980  -2.300  10.828
  514   HH11  ARG  71          HH11      ARG  71  -1.093  -2.316  12.907
  515   HH12  ARG  71          HH12      ARG  71  -0.090  -2.521  14.304
  516   HH21  ARG  71          HH21      ARG  71   2.712  -0.991  12.876
  517   HH22  ARG  71          HH22      ARG  71   2.073  -1.766  14.286
  518    H    VAL  72           HN       VAL  72   2.762   1.561   7.366
  519    HA   VAL  72           HA       VAL  72   3.732  -0.810   5.987
  520    HB   VAL  72           HB       VAL  72   5.356   1.606   6.787
  521   HG11  VAL  72          HG11      VAL  72   6.710  -0.227   6.056
  522   HG12  VAL  72          HG12      VAL  72   6.668   0.970   4.762
  523   HG13  VAL  72          HG13      VAL  72   5.683  -0.489   4.645
  524   HG21  VAL  72          HG23      VAL  72   4.852   2.576   4.608
  525   HG22  VAL  72          HG21      VAL  72   3.384   2.372   5.563
  526   HG23  VAL  72          HG22      VAL  72   3.753   1.243   4.259
  527    H    ASP  73           HN       ASP  73   5.982  -1.596   6.744
  528    HA   ASP  73           HA       ASP  73   5.819  -2.875   9.152
  529    HB2  ASP  73           HB2      ASP  73   7.489  -3.272   7.302
  530    HB3  ASP  73           HB1      ASP  73   8.426  -1.934   7.957
  531    H    ASP  74           HN       ASP  74   5.441  -1.974  11.068
  532    HA   ASP  74           HA       ASP  74   5.663  -0.730  12.952
  533    HB2  ASP  74           HB2      ASP  74   7.963  -1.708  12.814
  534    HB3  ASP  74           HB1      ASP  74   8.488  -0.238  12.001
  535    H    VAL  75           HN       VAL  75   5.428   0.651  10.067
  536    HA   VAL  75           HA       VAL  75   5.365   3.346  11.224
  537    HB   VAL  75           HB       VAL  75   6.529   2.713   8.507
  538   HG11  VAL  75          HG11      VAL  75   5.321   4.814   8.488
  539   HG12  VAL  75          HG12      VAL  75   7.057   5.121   8.437
  540   HG13  VAL  75          HG13      VAL  75   6.167   5.342   9.943
  541   HG21  VAL  75          HG23      VAL  75   7.856   3.703  11.030
  542   HG22  VAL  75          HG21      VAL  75   8.635   3.555   9.455
  543   HG23  VAL  75          HG22      VAL  75   8.063   2.113  10.294
  544    H    ASN  76           HN       ASN  76   3.177   3.541  11.279
  545    HA   ASN  76           HA       ASN  76   1.468   2.653   9.173
  546    HB2  ASN  76           HB2      ASN  76   0.922   4.538  11.476
  547    HB3  ASN  76           HB1      ASN  76  -0.307   3.853  10.418
  548   HD21  ASN  76          HD21      ASN  76  -1.352   2.821  12.098
  549   HD22  ASN  76          HD22      ASN  76  -0.696   1.429  12.885
  550    H    VAL  77           HN       VAL  77   0.203   3.948   7.750
  551    HA   VAL  77           HA       VAL  77   1.392   6.592   7.193
  552    HB   VAL  77           HB       VAL  77   0.898   6.241   4.818
  553   HG11  VAL  77          HG11      VAL  77   3.107   5.667   5.609
  554   HG12  VAL  77          HG12      VAL  77   2.607   4.516   4.371
  555   HG13  VAL  77          HG13      VAL  77   2.556   4.058   6.073
  556   HG21  VAL  77          HG23      VAL  77   0.229   4.041   3.993
  557   HG22  VAL  77          HG21      VAL  77  -0.999   4.720   5.060
  558   HG23  VAL  77          HG22      VAL  77   0.083   3.458   5.650
  559    H    GLN  78           HN       GLN  78  -0.973   5.836   8.832
  560    HA   GLN  78           HA       GLN  78  -3.211   6.861   7.276
  561    HB2  GLN  78           HB2      GLN  78  -3.099   5.933  10.151
  562    HB3  GLN  78           HB1      GLN  78  -4.559   6.336   9.257
  563    HG2  GLN  78           HG2      GLN  78  -2.662   4.095   8.599
  564    HG3  GLN  78           HG1      GLN  78  -4.215   3.927   9.416
  565   HE21  GLN  78          HE21      GLN  78  -2.613   4.587   6.402
  566   HE22  GLN  78          HE22      GLN  78  -3.998   4.391   5.389
  567    H    GLY  79           HN       GLY  79  -0.902   8.578   7.998
  568    HA2  GLY  79           HA2      GLY  79  -2.358  10.902   8.703
  569    HA3  GLY  79           HA1      GLY  79  -1.465  10.320  10.098
  570    H    MET  80           HN       MET  80  -0.075   9.724   7.003
  571    HA   MET  80           HA       MET  80   1.786  11.972   7.427
  572    HB2  MET  80           HB2      MET  80   2.442   9.253   6.284
  573    HB3  MET  80           HB1      MET  80   3.572  10.580   6.505
  574    HG2  MET  80           HG2      MET  80   3.063  10.456   8.964
  575    HG3  MET  80           HG1      MET  80   2.196   8.959   8.626
  576    HE1  MET  80           HE3      MET  80   4.131   7.930   6.168
  577    HE2  MET  80           HE1      MET  80   3.408   6.864   7.372
  578    HE3  MET  80           HE2      MET  80   5.145   6.801   7.066
  579    H    ALA  81           HN       ALA  81   2.345  13.201   5.696
  580    HA   ALA  81           HA       ALA  81   0.625  13.255   3.458
  581    HB1  ALA  81           HB3      ALA  81   2.048  15.038   2.624
  582    HB2  ALA  81           HB1      ALA  81   3.297  14.617   3.795
  583    HB3  ALA  81           HB2      ALA  81   1.748  15.252   4.349
  584    H    GLN  82           HN       GLN  82   1.200  13.017   1.208
  585    HA   GLN  82           HA       GLN  82   2.148  10.578   0.468
  586    HB2  GLN  82           HB2      GLN  82   0.958  12.087  -1.048
  587    HB3  GLN  82           HB1      GLN  82   2.366  13.137  -1.126
  588    HG2  GLN  82           HG2      GLN  82   3.649  11.320  -2.159
  589    HG3  GLN  82           HG1      GLN  82   2.214  10.297  -2.112
  590   HE21  GLN  82          HE21      GLN  82   2.168  10.060  -4.337
  591   HE22  GLN  82          HE22      GLN  82   1.699  11.341  -5.397
  592    H    SER  83           HN       SER  83   4.054  13.555   0.735
  593    HA   SER  83           HA       SER  83   6.474  12.576  -0.259
  594    HG   SER  83           HG       SER  83   8.063  15.219   1.619
  595    HB2  SER  83           HB2      SER  83   6.078  14.960   0.109
  596    HB3  SER  83           HB1      SER  83   6.006  14.695   1.851
  597    H    ASP  84           HN       ASP  84   5.397  12.818   3.130
  598    HA   ASP  84           HA       ASP  84   7.619  11.693   4.345
  599    HB2  ASP  84           HB2      ASP  84   4.718  11.516   5.182
  600    HB3  ASP  84           HB1      ASP  84   6.086  11.116   6.216
  601    H    VAL  85           HN       VAL  85   4.819  10.093   2.898
  602    HA   VAL  85           HA       VAL  85   5.364   7.489   3.803
  603    HB   VAL  85           HB       VAL  85   4.045   8.192   1.180
  604   HG11  VAL  85          HG11      VAL  85   2.827   6.096   1.538
  605   HG12  VAL  85          HG12      VAL  85   3.745   5.819   3.017
  606   HG13  VAL  85          HG13      VAL  85   4.569   5.830   1.458
  607   HG21  VAL  85          HG23      VAL  85   3.058   9.477   3.034
  608   HG22  VAL  85          HG21      VAL  85   2.766   7.972   3.903
  609   HG23  VAL  85          HG22      VAL  85   1.939   8.284   2.376
  610    H    VAL  86           HN       VAL  86   6.416   9.231   0.905
  611    HA   VAL  86           HA       VAL  86   7.695   7.073  -0.371
  612    HB   VAL  86           HB       VAL  86   8.316  10.025  -0.555
  613   HG11  VAL  86          HG11      VAL  86   9.079   7.779  -2.419
  614   HG12  VAL  86          HG12      VAL  86  10.179   8.652  -1.353
  615   HG13  VAL  86          HG13      VAL  86   9.384   9.495  -2.684
  616   HG21  VAL  86          HG23      VAL  86   6.009   9.471  -1.153
  617   HG22  VAL  86          HG21      VAL  86   6.596   8.266  -2.301
  618   HG23  VAL  86          HG22      VAL  86   6.937   9.975  -2.565
  619    H    GLU  87           HN       GLU  87   8.901   9.508   1.908
  620    HA   GLU  87           HA       GLU  87  11.608   8.846   1.830
  621    HB2  GLU  87           HB2      GLU  87   9.980   9.876   4.158
  622    HB3  GLU  87           HB1      GLU  87  11.737   9.869   4.082
  623    HG2  GLU  87           HG2      GLU  87  11.627  11.344   2.110
  624    HG3  GLU  87           HG1      GLU  87   9.873  11.399   2.282
  625    H    VAL  88           HN       VAL  88   9.034   7.576   3.926
  626    HA   VAL  88           HA       VAL  88  10.577   5.903   5.524
  627    HB   VAL  88           HB       VAL  88   7.731   5.559   4.576
  628   HG11  VAL  88          HG11      VAL  88   7.466   3.974   6.434
  629   HG12  VAL  88          HG12      VAL  88   9.196   4.075   6.758
  630   HG13  VAL  88          HG13      VAL  88   8.622   3.393   5.234
  631   HG21  VAL  88          HG23      VAL  88   8.876   6.591   7.171
  632   HG22  VAL  88          HG21      VAL  88   7.161   6.402   6.803
  633   HG23  VAL  88          HG22      VAL  88   8.132   7.566   5.903
  634    H    LEU  89           HN       LEU  89   8.723   4.983   2.625
  635    HA   LEU  89           HA       LEU  89   9.671   2.359   2.466
  636    HG   LEU  89           HG       LEU  89   7.014   3.889   2.007
  637    HB2  LEU  89           HB2      LEU  89   8.735   4.152   0.223
  638    HB3  LEU  89           HB1      LEU  89   8.869   2.406   0.142
  639   HD11  LEU  89          HD11      LEU  89   5.232   3.114   0.499
  640   HD12  LEU  89          HD12      LEU  89   6.459   2.516  -0.618
  641   HD13  LEU  89          HD13      LEU  89   6.335   4.243  -0.287
  642   HD21  LEU  89          HD23      LEU  89   7.679   1.698   2.838
  643   HD22  LEU  89          HD21      LEU  89   7.229   0.965   1.299
  644   HD23  LEU  89          HD22      LEU  89   5.992   1.688   2.326
  645    H    ARG  90           HN       ARG  90  11.147   5.351   1.568
  646    HA   ARG  90           HA       ARG  90  13.115   4.082  -0.154
  647    HE   ARG  90           HE       ARG  90  11.037   6.385  -1.662
  648    HB2  ARG  90           HB2      ARG  90  12.016   6.619  -0.056
  649    HB3  ARG  90           HB1      ARG  90  13.632   6.855   0.589
  650    HG2  ARG  90           HG2      ARG  90  13.599   7.240  -1.799
  651    HG3  ARG  90           HG1      ARG  90  14.583   5.828  -1.415
  652    HD2  ARG  90           HD2      ARG  90  13.087   5.543  -3.397
  653    HD3  ARG  90           HD1      ARG  90  12.861   4.339  -2.130
  654   HH11  ARG  90          HH11      ARG  90  11.697   3.995  -4.109
  655   HH12  ARG  90          HH12      ARG  90  10.043   3.854  -4.602
  656   HH21  ARG  90          HH21      ARG  90   8.852   6.194  -2.295
  657   HH22  ARG  90          HH22      ARG  90   8.426   5.102  -3.570
  658    H    ASN  91           HN       ASN  91  12.743   4.700   3.146
  659    HA   ASN  91           HA       ASN  91  15.644   4.739   3.598
  660    HB2  ASN  91           HB2      ASN  91  13.349   5.371   5.462
  661    HB3  ASN  91           HB1      ASN  91  15.041   5.346   5.948
  662   HD21  ASN  91          HD21      ASN  91  13.106   7.532   5.952
  663   HD22  ASN  91          HD22      ASN  91  13.805   8.787   4.991
  664    H    ALA  92           HN       ALA  92  13.041   2.631   3.529
  665    HA   ALA  92           HA       ALA  92  13.348   0.920   5.656
  666    HB1  ALA  92           HB3      ALA  92  12.791   0.125   2.802
  667    HB2  ALA  92           HB1      ALA  92  11.593   0.699   3.962
  668    HB3  ALA  92           HB2      ALA  92  12.427  -0.830   4.238
  669    H    GLY  93           HN       GLY  93  14.645  -0.080   2.500
  670    HA2  GLY  93           HA2      GLY  93  16.578  -1.191   1.940
  671    HA3  GLY  93           HA1      GLY  93  17.336  -0.326   3.269
  672    H    ASN  94           HN       ASN  94  14.617  -2.260   4.033
  673    HA   ASN  94           HA       ASN  94  16.218  -4.595   4.742
  674    HB2  ASN  94           HB2      ASN  94  15.545  -4.543   7.074
  675    HB3  ASN  94           HB1      ASN  94  16.327  -3.015   6.680
  676   HD21  ASN  94          HD21      ASN  94  13.238  -4.591   7.167
  677   HD22  ASN  94          HD22      ASN  94  12.354  -3.161   7.552
  678    HA   PRO  95           HA       PRO  95  12.476  -6.863   3.949
  679    HB2  PRO  95           HB2      PRO  95  12.594  -8.257   6.544
  680    HB3  PRO  95           HB1      PRO  95  12.706  -8.917   4.910
  681    HG2  PRO  95           HG2      PRO  95  14.848  -8.791   6.517
  682    HG3  PRO  95           HG1      PRO  95  14.981  -8.534   4.768
  683    HD2  PRO  95           HD2      PRO  95  14.941  -6.517   6.981
  684    HD3  PRO  95           HD1      PRO  95  15.948  -6.564   5.518
  685    H    VAL  96           HN       VAL  96  10.992  -5.140   4.101
  686    HA   VAL  96           HA       VAL  96   9.714  -4.718   6.708
  687    HB   VAL  96           HB       VAL  96   8.657  -2.739   5.658
  688   HG11  VAL  96          HG11      VAL  96  11.663  -2.834   5.430
  689   HG12  VAL  96          HG12      VAL  96  10.741  -2.504   6.896
  690   HG13  VAL  96          HG13      VAL  96  10.682  -1.372   5.545
  691   HG21  VAL  96          HG23      VAL  96   9.443  -1.962   3.480
  692   HG22  VAL  96          HG21      VAL  96   8.639  -3.525   3.346
  693   HG23  VAL  96          HG22      VAL  96  10.399  -3.432   3.294
  694    H    ARG  97           HN       ARG  97   7.443  -4.692   6.909
  695    HA   ARG  97           HA       ARG  97   6.087  -6.531   5.085
  696    HE   ARG  97           HE       ARG  97   1.754  -8.091   7.189
  697    HB2  ARG  97           HB2      ARG  97   6.064  -7.111   7.468
  698    HB3  ARG  97           HB1      ARG  97   5.324  -5.564   7.849
  699    HG2  ARG  97           HG2      ARG  97   3.327  -6.191   6.610
  700    HG3  ARG  97           HG1      ARG  97   4.073  -7.730   6.172
  701    HD2  ARG  97           HD2      ARG  97   4.182  -8.365   8.517
  702    HD3  ARG  97           HD1      ARG  97   3.499  -6.809   8.985
  703   HH11  ARG  97          HH11      ARG  97   2.924  -8.357  10.462
  704   HH12  ARG  97          HH12      ARG  97   1.484  -9.117  11.050
  705   HH21  ARG  97          HH21      ARG  97  -0.142  -9.094   7.956
  706   HH22  ARG  97          HH22      ARG  97  -0.259  -9.536   9.626
  707    H    LEU  98           HN       LEU  98   4.150  -6.019   4.100
  708    HA   LEU  98           HA       LEU  98   3.409  -3.166   4.151
  709    HG   LEU  98           HG       LEU  98   5.549  -4.397   2.381
  710    HB2  LEU  98           HB2      LEU  98   3.139  -5.093   1.845
  711    HB3  LEU  98           HB1      LEU  98   2.774  -3.379   1.819
  712   HD11  LEU  98          HD11      LEU  98   4.861  -5.306   0.227
  713   HD12  LEU  98          HD12      LEU  98   6.061  -4.031   0.021
  714   HD13  LEU  98          HD13      LEU  98   4.360  -3.698  -0.301
  715   HD21  LEU  98          HD23      LEU  98   5.095  -2.085   2.989
  716   HD22  LEU  98          HD21      LEU  98   4.481  -1.766   1.366
  717   HD23  LEU  98          HD22      LEU  98   6.183  -2.163   1.602
  718    H    LEU  99           HN       LEU  99   1.629  -3.093   5.436
  719    HA   LEU  99           HA       LEU  99  -0.436  -5.145   5.096
  720    HG   LEU  99           HG       LEU  99  -2.545  -3.942   6.901
  721    HB2  LEU  99           HB2      LEU  99   0.373  -4.560   7.385
  722    HB3  LEU  99           HB1      LEU  99  -0.278  -2.947   7.160
  723   HD11  LEU  99          HD11      LEU  99  -1.879  -6.161   6.144
  724   HD12  LEU  99          HD12      LEU  99  -2.900  -6.261   7.579
  725   HD13  LEU  99          HD13      LEU  99  -1.157  -6.491   7.719
  726   HD21  LEU  99          HD23      LEU  99  -2.800  -4.564   9.299
  727   HD22  LEU  99          HD21      LEU  99  -1.927  -3.054   9.038
  728   HD23  LEU  99          HD22      LEU  99  -1.044  -4.524   9.449
  729    H    LEU 100           HN       LEU 100  -1.729  -4.682   3.430
  730    HA   LEU 100           HA       LEU 100  -3.020  -2.044   3.397
  731    HG   LEU 100           HG       LEU 100  -0.467  -3.858   1.637
  732    HB2  LEU 100           HB2      LEU 100  -3.007  -2.454   0.796
  733    HB3  LEU 100           HB1      LEU 100  -1.659  -1.677   1.603
  734   HD11  LEU 100          HD11      LEU 100  -1.286  -5.667   0.195
  735   HD12  LEU 100          HD12      LEU 100  -2.792  -4.779  -0.043
  736   HD13  LEU 100          HD13      LEU 100  -2.357  -5.365   1.563
  737   HD21  LEU 100          HD23      LEU 100   0.039  -2.290  -0.110
  738   HD22  LEU 100          HD21      LEU 100  -1.354  -2.825  -1.050
  739   HD23  LEU 100          HD22      LEU 100   0.008  -3.915  -0.793
  740    H    ILE 101           HN       ILE 101  -5.086  -2.002   2.281
  741    HA   ILE 101           HA       ILE 101  -6.457  -4.596   2.470
  742    HB   ILE 101           HB       ILE 101  -7.357  -2.856   3.939
  743   HG12  ILE 101          HG12      ILE 101  -9.247  -3.410   1.642
  744   HG13  ILE 101          HG11      ILE 101  -8.854  -4.569   2.906
  745   HG21  ILE 101          HG21      ILE 101  -6.708  -0.904   2.627
  746   HG22  ILE 101          HG22      ILE 101  -8.423  -0.859   3.030
  747   HG23  ILE 101          HG23      ILE 101  -7.912  -1.317   1.406
  748   HD11  ILE 101          HD13      ILE 101 -10.236  -1.923   3.270
  749   HD12  ILE 101          HD11      ILE 101  -9.782  -3.018   4.576
  750   HD13  ILE 101          HD12      ILE 101 -10.968  -3.523   3.373
  751    H    ARG 102           HN       ARG 102  -7.481  -5.465   0.729
  752    HA   ARG 102           HA       ARG 102  -7.568  -3.846  -1.731
  753    HE   ARG 102           HE       ARG 102  -6.928  -5.894  -6.011
  754    HB2  ARG 102           HB2      ARG 102  -5.674  -5.350  -1.903
  755    HB3  ARG 102           HB1      ARG 102  -6.683  -6.723  -1.471
  756    HG2  ARG 102           HG2      ARG 102  -6.258  -6.719  -3.844
  757    HG3  ARG 102           HG1      ARG 102  -7.968  -6.414  -3.540
  758    HD2  ARG 102           HD2      ARG 102  -7.662  -4.054  -3.936
  759    HD3  ARG 102           HD1      ARG 102  -5.919  -4.270  -4.092
  760   HH11  ARG 102          HH11      ARG 102  -7.408  -2.535  -5.219
  761   HH12  ARG 102          HH12      ARG 102  -7.707  -2.060  -6.858
  762   HH21  ARG 102          HH21      ARG 102  -7.314  -5.277  -8.168
  763   HH22  ARG 102          HH22      ARG 102  -7.650  -3.618  -8.535
  764    H    ARG 103           HN       ARG 103  -9.422  -3.899  -2.840
  765    HA   ARG 103           HA       ARG 103 -11.628  -5.417  -1.744
  766    HE   ARG 103           HE       ARG 103 -12.734  -2.333  -5.141
  767    HB2  ARG 103           HB2      ARG 103 -11.925  -3.049  -2.375
  768    HB3  ARG 103           HB1      ARG 103 -11.565  -3.455  -4.047
  769    HG2  ARG 103           HG2      ARG 103 -13.548  -4.844  -4.167
  770    HG3  ARG 103           HG1      ARG 103 -13.895  -4.523  -2.467
  771    HD2  ARG 103           HD2      ARG 103 -15.265  -3.129  -3.934
  772    HD3  ARG 103           HD1      ARG 103 -14.169  -2.151  -2.958
  773   HH11  ARG 103          HH11      ARG 103 -16.178  -1.879  -4.871
  774   HH12  ARG 103          HH12      ARG 103 -16.306  -0.988  -6.351
  775   HH21  ARG 103          HH21      ARG 103 -12.891  -1.152  -7.083
  776   HH22  ARG 103          HH22      ARG 103 -14.437  -0.574  -7.607
  777    H    LEU 104           HN       LEU 104 -12.775  -7.011  -2.780
  778    HA   LEU 104           HA       LEU 104 -11.346  -8.436  -4.857
  779    HG   LEU 104           HG       LEU 104 -12.155  -8.959  -1.814
  780    HB2  LEU 104           HB2      LEU 104 -13.954  -9.167  -3.526
  781    HB3  LEU 104           HB1      LEU 104 -12.908 -10.229  -4.449
  782   HD11  LEU 104          HD11      LEU 104 -13.975 -10.566  -1.543
  783   HD12  LEU 104          HD12      LEU 104 -12.470 -11.175  -0.856
  784   HD13  LEU 104          HD13      LEU 104 -13.038 -11.780  -2.412
  785   HD21  LEU 104          HD23      LEU 104 -10.815 -11.114  -3.446
  786   HD22  LEU 104          HD21      LEU 104 -10.295 -10.540  -1.862
  787   HD23  LEU 104          HD22      LEU 104 -10.244  -9.457  -3.252
  788    HA   PRO 105           HA       PRO 105 -13.934  -7.034  -8.178
  789    HB2  PRO 105           HB2      PRO 105 -13.588  -8.969  -9.984
  790    HB3  PRO 105           HB1      PRO 105 -12.226  -7.958  -9.476
  791    HG2  PRO 105           HG2      PRO 105 -13.009 -10.690  -8.505
  792    HG3  PRO 105           HG1      PRO 105 -11.413 -10.125  -9.044
  793    HD2  PRO 105           HD2      PRO 105 -12.102 -10.263  -6.427
  794    HD3  PRO 105           HD1      PRO 105 -11.002  -9.018  -7.054
  795    H    LEU 106           HN       LEU 106 -15.621  -7.750  -6.349
  796    HA   LEU 106           HA       LEU 106 -17.196 -10.032  -6.702
  797    HG   LEU 106           HG       LEU 106 -16.169  -8.331  -4.330
  798    HB2  LEU 106           HB2      LEU 106 -18.014  -7.321  -5.654
  799    HB3  LEU 106           HB1      LEU 106 -18.932  -8.802  -5.455
  800   HD11  LEU 106          HD11      LEU 106 -17.790  -6.895  -3.242
  801   HD12  LEU 106          HD12      LEU 106 -17.313  -8.205  -2.160
  802   HD13  LEU 106          HD13      LEU 106 -18.868  -8.268  -2.990
  803   HD21  LEU 106          HD23      LEU 106 -16.617 -10.372  -3.049
  804   HD22  LEU 106          HD21      LEU 106 -16.620 -10.678  -4.786
  805   HD23  LEU 106          HD22      LEU 106 -18.145 -10.570  -3.906
  806    H    LEU 107           HN       LEU 107 -18.174 -10.600  -8.526
  807    HA   LEU 107           HA       LEU 107 -19.365  -8.522 -10.223
  808    HG   LEU 107           HG       LEU 107 -16.677 -10.165 -10.705
  809    HB2  LEU 107           HB2      LEU 107 -18.771 -11.417 -10.841
  810    HB3  LEU 107           HB1      LEU 107 -19.418 -10.244 -11.972
  811   HD11  LEU 107          HD11      LEU 107 -16.885 -11.885 -12.405
  812   HD12  LEU 107          HD12      LEU 107 -15.888 -10.552 -12.989
  813   HD13  LEU 107          HD13      LEU 107 -17.558 -10.708 -13.534
  814   HD21  LEU 107          HD23      LEU 107 -17.526  -7.915 -11.032
  815   HD22  LEU 107          HD21      LEU 107 -17.969  -8.302 -12.694
  816   HD23  LEU 107          HD22      LEU 107 -16.271  -8.271 -12.220
  817    H    GLU 108           HN       GLU 108 -21.348  -8.132  -9.358
  818    HA   GLU 108           HA       GLU 108 -23.534  -8.431  -8.820
  819    HB2  GLU 108           HB2      GLU 108 -23.201 -10.873 -10.572
  820    HB3  GLU 108           HB1      GLU 108 -24.747 -10.256 -10.006
  821    HG2  GLU 108           HG2      GLU 108 -24.374  -8.176 -11.210
  822    HG3  GLU 108           HG1      GLU 108 -22.804  -8.765 -11.756
  Start of MODEL   18
    1    H1   GLY   1           HT1      GLY   1  -2.321 -13.421   8.053
    2    H2   GLY   1           HT2      GLY   1  -3.190 -14.571   8.937
    3    H3   GLY   1           HT3      GLY   1  -3.489 -12.924   9.172
    4    HA2  GLY   1           HA1      GLY   1  -4.330 -12.716   6.921
    5    HA3  GLY   1           HA2      GLY   1  -4.005 -14.422   6.661
    6    H    SER   2           HN       SER   2  -4.860 -14.680   9.648
    7    HA   SER   2           HA       SER   2  -7.720 -14.946   9.032
    8    HG   SER   2           HG       SER   2  -7.253 -17.401   8.864
    9    HB2  SER   2           HB2      SER   2  -6.066 -16.286  11.185
   10    HB3  SER   2           HB1      SER   2  -7.782 -16.567  10.892
   11    H    HIS   3           HN       HIS   3  -5.514 -13.118  10.841
   12    HA   HIS   3           HA       HIS   3  -7.220 -12.482  13.048
   13    HD1  HIS   3           HD1      HIS   3  -5.244 -12.342  15.476
   14    HD2  HIS   3           HD2      HIS   3  -3.232 -13.461  12.018
   15    HE1  HIS   3           HE1      HIS   3  -3.667 -14.172  16.179
   16    HE2  HIS   3           HE2      HIS   3  -2.397 -14.770  14.087
   17    HB2  HIS   3           HB2      HIS   3  -4.744 -11.100  11.993
   18    HB3  HIS   3           HB1      HIS   3  -5.545 -10.703  13.509
   19    H    GLY   4           HN       GLY   4  -8.702 -10.907  13.249
   20    HA2  GLY   4           HA2      GLY   4  -9.960  -9.035  12.766
   21    HA3  GLY   4           HA1      GLY   4  -8.731  -8.569  11.598
   22    H    TYR   5           HN       TYR   5  -9.586  -8.311   9.656
   23    HA   TYR   5           HA       TYR   5 -12.016  -9.666   8.891
   24    HD1  TYR   5           HD2      TYR   5  -9.920  -6.302   9.241
   25    HD2  TYR   5           HD1      TYR   5 -13.790  -7.273   7.766
   26    HE1  TYR   5           HE2      TYR   5 -10.857  -4.383  10.457
   27    HE2  TYR   5           HE1      TYR   5 -14.739  -5.356   8.976
   28    HH   TYR   5           HH       TYR   5 -12.810  -2.914  10.354
   29    HB2  TYR   5           HB2      TYR   5 -10.242  -7.811   7.287
   30    HB3  TYR   5           HB1      TYR   5 -11.866  -8.329   6.844
   31    H    SER   6           HN       SER   6 -12.260 -11.269   7.403
   32    HA   SER   6           HA       SER   6  -9.897 -12.253   5.986
   33    HG   SER   6           HG       SER   6  -9.307 -14.805   6.404
   34    HB2  SER   6           HB2      SER   6 -10.003 -13.562   8.062
   35    HB3  SER   6           HB1      SER   6 -11.674 -14.002   7.707
   36    H    ASP   7           HN       ASP   7 -10.815 -11.542   4.061
   37    HA   ASP   7           HA       ASP   7 -12.102 -11.607   2.189
   38    HB2  ASP   7           HB2      ASP   7 -11.294 -13.930   2.155
   39    HB3  ASP   7           HB1      ASP   7 -12.667 -14.423   3.142
   40    H    ALA   8           HN       ALA   8 -13.606 -10.053   2.856
   41    HA   ALA   8           HA       ALA   8 -16.271 -11.142   3.385
   42    HB1  ALA   8           HB3      ALA   8 -15.390 -10.442   5.556
   43    HB2  ALA   8           HB1      ALA   8 -16.734  -9.417   5.050
   44    HB3  ALA   8           HB2      ALA   8 -15.076  -8.830   4.913
   45    H    SER   9           HN       SER   9 -17.477 -10.521   1.736
   46    HA   SER   9           HA       SER   9 -18.341  -9.323   0.008
   47    HG   SER   9           HG       SER   9 -17.871  -6.089   2.417
   48    HB2  SER   9           HB2      SER   9 -18.995  -7.096   0.491
   49    HB3  SER   9           HB1      SER   9 -18.969  -7.923   2.047
   50    H    GLY  10           HN       GLY  10 -15.519  -9.959  -0.101
   51    HA2  GLY  10           HA2      GLY  10 -14.044  -9.599  -1.902
   52    HA3  GLY  10           HA1      GLY  10 -14.768  -8.018  -2.151
   53    H    PHE  11           HN       PHE  11 -14.546  -6.892   0.342
   54    HA   PHE  11           HA       PHE  11 -11.892  -5.976   0.340
   55    HD1  PHE  11           HD2      PHE  11 -11.983  -3.137   0.896
   56    HD2  PHE  11           HD1      PHE  11 -15.795  -5.027   1.005
   57    HE1  PHE  11           HE2      PHE  11 -12.925  -1.304  -0.445
   58    HE2  PHE  11           HE1      PHE  11 -16.744  -3.197  -0.338
   59    HZ   PHE  11           HZ       PHE  11 -15.299  -1.324  -1.060
   60    HB2  PHE  11           HB2      PHE  11 -14.051  -5.755   2.444
   61    HB3  PHE  11           HB1      PHE  11 -12.512  -4.907   2.528
   62    H    SER  12           HN       SER  12 -10.345  -7.498   0.615
   63    HA   SER  12           HA       SER  12 -10.350  -8.938   3.186
   64    HG   SER  12           HG       SER  12  -7.920 -10.881   1.884
   65    HB2  SER  12           HB2      SER  12 -10.609 -10.515   1.340
   66    HB3  SER  12           HB1      SER  12  -9.191  -9.843   0.537
   67    H    LEU  13           HN       LEU  13  -8.399  -9.075   4.314
   68    HA   LEU  13           HA       LEU  13  -6.564  -6.901   3.763
   69    HG   LEU  13           HG       LEU  13  -8.544  -7.158   6.000
   70    HB2  LEU  13           HB2      LEU  13  -6.709  -8.872   6.045
   71    HB3  LEU  13           HB1      LEU  13  -5.555  -7.556   5.943
   72   HD11  LEU  13          HD11      LEU  13  -8.237  -6.473   8.326
   73   HD12  LEU  13          HD12      LEU  13  -6.536  -6.933   8.238
   74   HD13  LEU  13          HD13      LEU  13  -7.791  -8.163   8.088
   75   HD21  LEU  13          HD23      LEU  13  -7.896  -4.833   6.558
   76   HD22  LEU  13          HD21      LEU  13  -7.370  -5.333   4.949
   77   HD23  LEU  13          HD22      LEU  13  -6.211  -5.270   6.275
   78    H    TYR  14           HN       TYR  14  -4.752  -7.114   2.663
   79    HA   TYR  14           HA       TYR  14  -3.556  -9.794   2.399
   80    HD1  TYR  14           HD1      TYR  14  -6.083  -7.748   0.387
   81    HD2  TYR  14           HD2      TYR  14  -3.393 -10.894  -0.609
   82    HE1  TYR  14           HE1      TYR  14  -7.897  -8.924  -0.779
   83    HE2  TYR  14           HE2      TYR  14  -5.203 -12.079  -1.776
   84    HH   TYR  14           HH       TYR  14  -7.650 -12.166  -1.772
   85    HB2  TYR  14           HB2      TYR  14  -3.595  -7.459   0.483
   86    HB3  TYR  14           HB1      TYR  14  -2.551  -8.859   0.270
   87    H    SER  15           HN       SER  15  -1.299 -10.003   2.516
   88    HA   SER  15           HA       SER  15   0.247  -7.652   3.295
   89    HG   SER  15           HG       SER  15  -1.265  -9.161   6.181
   90    HB2  SER  15           HB2      SER  15   0.154 -10.153   4.997
   91    HB3  SER  15           HB1      SER  15   1.127  -8.714   5.303
   92    H    VAL  16           HN       VAL  16   2.321  -7.712   2.631
   93    HA   VAL  16           HA       VAL  16   3.439 -10.272   1.726
   94    HB   VAL  16           HB       VAL  16   3.659  -7.717   0.128
   95   HG11  VAL  16          HG11      VAL  16   4.653  -9.151  -1.578
   96   HG12  VAL  16          HG12      VAL  16   4.488 -10.546  -0.514
   97   HG13  VAL  16          HG13      VAL  16   5.574  -9.228  -0.076
   98   HG21  VAL  16          HG23      VAL  16   2.188  -8.798  -1.506
   99   HG22  VAL  16          HG21      VAL  16   1.375  -8.565   0.041
  100   HG23  VAL  16          HG22      VAL  16   1.974 -10.162  -0.409
  101    H    GLU  17           HN       GLU  17   5.507 -10.580   2.307
  102    HA   GLU  17           HA       GLU  17   6.816  -8.445   3.801
  103    HB2  GLU  17           HB2      GLU  17   7.495 -11.375   3.518
  104    HB3  GLU  17           HB1      GLU  17   8.370 -10.235   4.530
  105    HG2  GLU  17           HG2      GLU  17   6.386  -9.874   5.878
  106    HG3  GLU  17           HG1      GLU  17   5.466 -10.962   4.840
  107    H    LEU  18           HN       LEU  18   8.390  -7.259   2.991
  108    HA   LEU  18           HA       LEU  18   9.873  -8.276   0.658
  109    HG   LEU  18           HG       LEU  18   8.391  -5.497  -1.209
  110    HB2  LEU  18           HB2      LEU  18   8.659  -5.626   1.214
  111    HB3  LEU  18           HB1      LEU  18  10.210  -5.631   0.400
  112   HD11  LEU  18          HD11      LEU  18  10.444  -6.679  -1.840
  113   HD12  LEU  18          HD12      LEU  18   9.028  -7.342  -2.653
  114   HD13  LEU  18          HD13      LEU  18   9.735  -8.194  -1.283
  115   HD21  LEU  18          HD23      LEU  18   6.686  -6.648   0.152
  116   HD22  LEU  18          HD21      LEU  18   7.504  -8.180  -0.156
  117   HD23  LEU  18          HD22      LEU  18   6.785  -7.279  -1.491
  118    H    PHE  19           HN       PHE  19  12.084  -7.710   0.497
  119    HA   PHE  19           HA       PHE  19  13.307  -6.846   3.037
  120    HD1  PHE  19           HD2      PHE  19  12.450 -10.137   0.808
  121    HD2  PHE  19           HD1      PHE  19  14.197  -9.501   4.636
  122    HE1  PHE  19           HE2      PHE  19  11.130 -12.003   1.716
  123    HE2  PHE  19           HE1      PHE  19  12.877 -11.365   5.552
  124    HZ   PHE  19           HZ       PHE  19  11.373 -12.641   4.092
  125    HB2  PHE  19           HB2      PHE  19  14.528  -8.822   1.106
  126    HB3  PHE  19           HB1      PHE  19  15.088  -8.420   2.724
  127    H    ARG  20           HN       ARG  20  14.018  -4.798   2.644
  128    HA   ARG  20           HA       ARG  20  15.209  -4.243   0.021
  129    HE   ARG  20           HE       ARG  20  15.900  -0.022   2.094
  130    HB2  ARG  20           HB2      ARG  20  13.439  -2.728   1.113
  131    HB3  ARG  20           HB1      ARG  20  14.739  -2.194   2.175
  132    HG2  ARG  20           HG2      ARG  20  16.039  -1.650   0.065
  133    HG3  ARG  20           HG1      ARG  20  14.521  -1.880  -0.803
  134    HD2  ARG  20           HD2      ARG  20  14.435   0.374  -0.423
  135    HD3  ARG  20           HD1      ARG  20  13.612  -0.216   1.021
  136   HH11  ARG  20          HH11      ARG  20  14.855   2.016  -0.532
  137   HH12  ARG  20          HH12      ARG  20  15.884   3.335  -0.084
  138   HH21  ARG  20          HH21      ARG  20  17.259   1.709   2.686
  139   HH22  ARG  20          HH22      ARG  20  17.248   3.163   1.743
  140    H    GLU  21           HN       GLU  21  17.328  -4.124  -0.263
  141    HA   GLU  21           HA       GLU  21  19.062  -3.453   1.988
  142    HB2  GLU  21           HB2      GLU  21  18.958  -5.909   1.935
  143    HB3  GLU  21           HB1      GLU  21  19.460  -5.892   0.249
  144    HG2  GLU  21           HG2      GLU  21  21.320  -6.448   1.693
  145    HG3  GLU  21           HG1      GLU  21  21.596  -4.902   0.890
  146    H    LYS  22           HN       LYS  22  18.650  -3.932  -1.448
  147    HA   LYS  22           HA       LYS  22  21.148  -2.857  -2.250
  148    HB2  LYS  22           HB2      LYS  22  18.535  -3.218  -3.715
  149    HB3  LYS  22           HB1      LYS  22  19.988  -2.594  -4.487
  150    HG2  LYS  22           HG2      LYS  22  19.811  -5.273  -3.125
  151    HG3  LYS  22           HG1      LYS  22  19.593  -5.015  -4.857
  152    HD2  LYS  22           HD2      LYS  22  21.857  -4.113  -5.016
  153    HD3  LYS  22           HD1      LYS  22  22.074  -4.332  -3.278
  154    HE2  LYS  22           HE2      LYS  22  21.551  -6.532  -5.274
  155    HE3  LYS  22           HE1      LYS  22  23.120  -6.135  -4.576
  156    HZ1  LYS  22           HZ3      LYS  22  20.735  -7.065  -3.071
  157    HZ2  LYS  22           HZ1      LYS  22  22.228  -6.661  -2.386
  158    HZ3  LYS  22           HZ2      LYS  22  22.105  -7.990  -3.426
  159    H    ASP  23           HN       ASP  23  21.555  -0.827  -3.277
  160    HA   ASP  23           HA       ASP  23  20.194   1.354  -1.952
  161    HB2  ASP  23           HB2      ASP  23  22.554   1.347  -3.846
  162    HB3  ASP  23           HB1      ASP  23  21.955   2.759  -2.982
  163    H    THR  24           HN       THR  24  18.280   0.394  -3.429
  164    HA   THR  24           HA       THR  24  18.251   1.694  -6.039
  165    HB   THR  24           HB       THR  24  16.051   0.584  -6.333
  166    HG1  THR  24           HG1      THR  24  15.106  -0.389  -4.696
  167   HG21  THR  24          HG23      THR  24  16.909  -1.717  -6.447
  168   HG22  THR  24          HG21      THR  24  18.290  -1.245  -5.457
  169   HG23  THR  24          HG22      THR  24  18.082  -0.554  -7.065
  170    H    SER  25           HN       SER  25  17.136   2.179  -2.837
  171    HA   SER  25           HA       SER  25  15.911   3.799  -1.821
  172    HG   SER  25           HG       SER  25  15.737   7.036  -3.335
  173    HB2  SER  25           HB2      SER  25  17.529   5.270  -2.962
  174    HB3  SER  25           HB1      SER  25  16.468   5.339  -4.368
  175    H    SER  26           HN       SER  26  14.645   1.897  -3.864
  176    HA   SER  26           HA       SER  26  12.001   3.051  -3.683
  177    HG   SER  26           HG       SER  26  11.171   1.957  -6.785
  178    HB2  SER  26           HB2      SER  26  12.762   3.984  -5.810
  179    HB3  SER  26           HB1      SER  26  13.203   2.374  -6.378
  180    H    LEU  27           HN       LEU  27  10.397   1.529  -3.636
  181    HA   LEU  27           HA       LEU  27  11.299  -1.269  -3.745
  182    HG   LEU  27           HG       LEU  27  11.216   0.323  -1.159
  183    HB2  LEU  27           HB2      LEU  27   8.998  -0.020  -2.242
  184    HB3  LEU  27           HB1      LEU  27   9.331  -1.741  -2.297
  185   HD11  LEU  27          HD11      LEU  27  10.559  -0.566   1.022
  186   HD12  LEU  27          HD12      LEU  27   9.358  -1.595   0.241
  187   HD13  LEU  27          HD13      LEU  27   9.188   0.159   0.181
  188   HD21  LEU  27          HD23      LEU  27  12.339  -1.668  -0.211
  189   HD22  LEU  27          HD21      LEU  27  12.389  -1.620  -1.974
  190   HD23  LEU  27          HD22      LEU  27  11.255  -2.693  -1.153
  191    H    GLY  28           HN       GLY  28   9.339   1.033  -5.278
  192    HA2  GLY  28           HA2      GLY  28   8.469   0.476  -7.465
  193    HA3  GLY  28           HA1      GLY  28   8.068  -1.116  -6.845
  194    H    ILE  29           HN       ILE  29   7.374   1.399  -4.670
  195    HA   ILE  29           HA       ILE  29   4.515   1.078  -5.211
  196    HB   ILE  29           HB       ILE  29   5.897   2.305  -2.821
  197   HG12  ILE  29          HG12      ILE  29   4.500  -0.367  -3.069
  198   HG13  ILE  29          HG11      ILE  29   6.248  -0.155  -3.115
  199   HG21  ILE  29          HG21      ILE  29   2.995   1.621  -3.274
  200   HG22  ILE  29          HG22      ILE  29   3.682   3.242  -3.172
  201   HG23  ILE  29          HG23      ILE  29   3.690   2.190  -1.757
  202   HD11  ILE  29          HD13      ILE  29   4.436   0.501  -0.804
  203   HD12  ILE  29          HD11      ILE  29   6.179   0.762  -0.844
  204   HD13  ILE  29          HD12      ILE  29   5.530  -0.876  -0.925
  205    H    SER  30           HN       SER  30   3.614   2.551  -6.493
  206    HA   SER  30           HA       SER  30   4.587   5.329  -6.338
  207    HG   SER  30           HG       SER  30   3.830   6.577  -8.130
  208    HB2  SER  30           HB2      SER  30   4.934   4.326  -8.547
  209    HB3  SER  30           HB1      SER  30   3.221   3.919  -8.643
  210    H    ILE  31           HN       ILE  31   3.274   6.341  -4.934
  211    HA   ILE  31           HA       ILE  31   0.380   5.894  -5.127
  212    HB   ILE  31           HB       ILE  31   0.269   7.162  -2.978
  213   HG12  ILE  31          HG12      ILE  31   3.280   6.869  -2.988
  214   HG13  ILE  31          HG11      ILE  31   2.441   8.376  -3.335
  215   HG21  ILE  31          HG21      ILE  31   1.166   5.330  -1.603
  216   HG22  ILE  31          HG22      ILE  31   2.021   4.707  -3.014
  217   HG23  ILE  31          HG23      ILE  31   0.258   4.739  -2.994
  218   HD11  ILE  31          HD13      ILE  31   3.260   8.265  -1.033
  219   HD12  ILE  31          HD11      ILE  31   2.253   6.844  -0.754
  220   HD13  ILE  31          HD12      ILE  31   1.503   8.400  -1.109
  221    H    SER  32           HN       SER  32  -1.073   7.594  -5.372
  222    HA   SER  32           HA       SER  32   0.101  10.093  -6.402
  223    HG   SER  32           HG       SER  32  -0.302   9.399  -8.827
  224    HB2  SER  32           HB2      SER  32  -2.479   8.713  -7.165
  225    HB3  SER  32           HB1      SER  32  -1.994  10.309  -7.742
  226    H    GLY  33           HN       GLY  33  -0.430  11.956  -5.433
  227    HA2  GLY  33           HA2      GLY  33  -1.817  11.981  -2.978
  228    HA3  GLY  33           HA1      GLY  33  -1.337  13.401  -3.895
  229    H    MET  34           HN       MET  34  -3.889  12.285  -2.446
  230    HA   MET  34           HA       MET  34  -5.767  12.925  -4.623
  231    HB2  MET  34           HB2      MET  34  -6.013  10.661  -3.649
  232    HB3  MET  34           HB1      MET  34  -6.311  11.389  -2.078
  233    HG2  MET  34           HG2      MET  34  -8.387  10.715  -3.115
  234    HG3  MET  34           HG1      MET  34  -8.316  12.469  -2.954
  235    HE1  MET  34           HE3      MET  34 -10.349  12.023  -6.262
  236    HE2  MET  34           HE1      MET  34 -10.313  12.756  -4.658
  237    HE3  MET  34           HE2      MET  34 -10.426  11.003  -4.826
  238    H    ARG  35           HN       ARG  35  -5.648  15.173  -4.347
  239    HA   ARG  35           HA       ARG  35  -7.303  16.171  -2.185
  240    HE   ARG  35           HE       ARG  35  -3.463  15.631  -0.591
  241    HB2  ARG  35           HB2      ARG  35  -5.661  17.994  -1.649
  242    HB3  ARG  35           HB1      ARG  35  -5.179  16.388  -1.121
  243    HG2  ARG  35           HG2      ARG  35  -4.229  17.401  -3.759
  244    HG3  ARG  35           HG1      ARG  35  -3.469  17.985  -2.278
  245    HD2  ARG  35           HD2      ARG  35  -3.767  15.085  -3.050
  246    HD3  ARG  35           HD1      ARG  35  -2.303  16.042  -3.264
  247   HH11  ARG  35          HH11      ARG  35  -0.804  15.387  -2.829
  248   HH12  ARG  35          HH12      ARG  35   0.337  14.900  -1.621
  249   HH21  ARG  35          HH21      ARG  35  -1.966  14.991   1.008
  250   HH22  ARG  35          HH22      ARG  35  -0.324  14.674   0.559
  251    H    ASP  36           HN       ASP  36  -8.667  16.413  -4.085
  252    HA   ASP  36           HA       ASP  36  -8.052  18.027  -6.285
  253    HB2  ASP  36           HB2      ASP  36 -10.760  17.580  -5.012
  254    HB3  ASP  36           HB1      ASP  36 -10.470  18.161  -6.649
  255    H    GLN  37           HN       GLN  37  -8.706  20.175  -6.801
  256    HA   GLN  37           HA       GLN  37  -8.511  21.969  -4.515
  257    HB2  GLN  37           HB2      GLN  37  -7.957  23.690  -6.072
  258    HB3  GLN  37           HB1      GLN  37  -7.064  22.255  -6.549
  259    HG2  GLN  37           HG2      GLN  37  -9.635  23.185  -7.811
  260    HG3  GLN  37           HG1      GLN  37  -8.021  23.490  -8.452
  261   HE21  GLN  37          HE21      GLN  37  -6.846  21.790  -9.342
  262   HE22  GLN  37          HE22      GLN  37  -7.592  20.302  -9.804
  263    H    SER  38           HN       SER  38 -10.989  20.425  -5.551
  264    HA   SER  38           HA       SER  38 -12.817  22.693  -5.236
  265    HG   SER  38           HG       SER  38 -13.598  20.167  -8.324
  266    HB2  SER  38           HB2      SER  38 -14.290  21.810  -7.016
  267    HB3  SER  38           HB1      SER  38 -12.712  22.284  -7.645
  268    H    THR  39           HN       THR  39 -11.860  20.480  -3.520
  269    HA   THR  39           HA       THR  39 -13.855  18.506  -3.244
  270    HB   THR  39           HB       THR  39 -12.919  18.125  -0.989
  271    HG1  THR  39           HG1      THR  39 -12.302  20.629  -1.061
  272   HG21  THR  39          HG23      THR  39 -10.844  18.552  -3.144
  273   HG22  THR  39          HG21      THR  39 -11.817  17.101  -2.906
  274   HG23  THR  39          HG22      THR  39 -10.626  17.572  -1.694
  275    H    THR  40           HN       THR  40 -15.705  18.415  -2.072
  276    HA   THR  40           HA       THR  40 -16.726  20.956  -1.049
  277    HB   THR  40           HB       THR  40 -18.140  19.749  -2.651
  278    HG1  THR  40           HG1      THR  40 -19.632  20.695  -1.491
  279   HG21  THR  40          HG23      THR  40 -18.265  17.589  -0.543
  280   HG22  THR  40          HG21      THR  40 -17.432  17.464  -2.092
  281   HG23  THR  40          HG22      THR  40 -19.188  17.629  -2.046
  282    H    GLY  41           HN       GLY  41 -15.170  18.288   0.132
  283    HA2  GLY  41           HA2      GLY  41 -15.760  18.978   2.852
  284    HA3  GLY  41           HA1      GLY  41 -16.468  17.438   2.390
  285    H    GLU  42           HN       GLU  42 -15.267  15.905   3.313
  286    HA   GLU  42           HA       GLU  42 -12.339  16.160   3.200
  287    HB2  GLU  42           HB2      GLU  42 -14.022  14.361   4.954
  288    HB3  GLU  42           HB1      GLU  42 -12.274  14.535   5.024
  289    HG2  GLU  42           HG2      GLU  42 -12.537  16.876   5.682
  290    HG3  GLU  42           HG1      GLU  42 -14.289  16.690   5.624
  291    H    ALA  43           HN       ALA  43 -11.208  14.856   1.916
  292    HA   ALA  43           HA       ALA  43 -12.002  12.165   1.347
  293    HB1  ALA  43           HB3      ALA  43 -12.108  14.155  -0.918
  294    HB2  ALA  43           HB1      ALA  43 -13.494  13.346  -0.190
  295    HB3  ALA  43           HB2      ALA  43 -12.284  12.408  -1.064
  296    H    THR  44           HN       THR  44  -9.873  11.971   2.299
  297    HA   THR  44           HA       THR  44  -7.773  12.212   0.267
  298    HB   THR  44           HB       THR  44  -6.142  12.922   2.009
  299    HG1  THR  44           HG1      THR  44  -6.988  13.741   3.968
  300   HG21  THR  44          HG23      THR  44  -7.072  14.573   0.489
  301   HG22  THR  44          HG21      THR  44  -6.870  15.277   2.093
  302   HG23  THR  44          HG22      THR  44  -8.472  14.785   1.542
  303    H    GLY  45           HN       GLY  45  -5.962  10.788   0.595
  304    HA2  GLY  45           HA2      GLY  45  -5.556   8.981   2.621
  305    HA3  GLY  45           HA1      GLY  45  -6.763   8.225   1.592
  306    H    ILE  46           HN       ILE  46  -4.084   7.299   2.131
  307    HA   ILE  46           HA       ILE  46  -2.619   7.780  -0.343
  308    HB   ILE  46           HB       ILE  46  -1.903   6.052   2.030
  309   HG12  ILE  46          HG12      ILE  46  -1.992   8.440   2.592
  310   HG13  ILE  46          HG11      ILE  46  -0.334   7.851   2.607
  311   HG21  ILE  46          HG21      ILE  46   0.367   6.058   1.064
  312   HG22  ILE  46          HG22      ILE  46  -0.267   6.882  -0.361
  313   HG23  ILE  46          HG23      ILE  46  -0.813   5.251   0.031
  314   HD11  ILE  46          HD13      ILE  46  -0.481  10.046   1.588
  315   HD12  ILE  46          HD11      ILE  46  -1.627   9.432   0.397
  316   HD13  ILE  46          HD12      ILE  46   0.036   8.842   0.408
  317    H    TYR  47           HN       TYR  47  -2.569   6.418  -2.033
  318    HA   TYR  47           HA       TYR  47  -3.262   3.625  -1.706
  319    HD1  TYR  47           HD1      TYR  47  -5.026   7.244  -2.387
  320    HD2  TYR  47           HD2      TYR  47  -5.154   4.372  -5.525
  321    HE1  TYR  47           HE1      TYR  47  -5.438   9.042  -4.010
  322    HE2  TYR  47           HE2      TYR  47  -5.563   6.165  -7.156
  323    HH   TYR  47           HH       TYR  47  -6.528   8.499  -7.122
  324    HB2  TYR  47           HB2      TYR  47  -5.081   3.636  -3.313
  325    HB3  TYR  47           HB1      TYR  47  -5.455   4.738  -1.991
  326    H    VAL  48           HN       VAL  48  -2.231   2.349  -3.136
  327    HA   VAL  48           HA       VAL  48  -0.257   3.485  -4.844
  328    HB   VAL  48           HB       VAL  48  -1.223   0.625  -4.674
  329   HG11  VAL  48          HG11      VAL  48   1.266   1.785  -5.921
  330   HG12  VAL  48          HG12      VAL  48  -0.079   1.024  -6.772
  331   HG13  VAL  48          HG13      VAL  48   0.944   0.064  -5.702
  332   HG21  VAL  48          HG23      VAL  48   1.118   1.993  -3.354
  333   HG22  VAL  48          HG21      VAL  48   0.752   0.269  -3.269
  334   HG23  VAL  48          HG22      VAL  48  -0.353   1.442  -2.552
  335    H    LYS  49           HN       LYS  49  -0.691   4.410  -6.717
  336    HA   LYS  49           HA       LYS  49  -3.044   3.661  -8.247
  337    HB2  LYS  49           HB2      LYS  49  -2.428   6.043  -7.885
  338    HB3  LYS  49           HB1      LYS  49  -0.963   5.777  -8.819
  339    HG2  LYS  49           HG2      LYS  49  -2.359   5.181 -10.768
  340    HG3  LYS  49           HG1      LYS  49  -3.795   5.575  -9.818
  341    HD2  LYS  49           HD2      LYS  49  -2.886   7.866  -9.501
  342    HD3  LYS  49           HD1      LYS  49  -1.558   7.447 -10.584
  343    HE2  LYS  49           HE2      LYS  49  -4.491   7.469 -11.277
  344    HE3  LYS  49           HE1      LYS  49  -3.292   8.664 -11.772
  345    HZ1  LYS  49           HZ3      LYS  49  -3.731   7.070 -13.533
  346    HZ2  LYS  49           HZ1      LYS  49  -3.277   5.790 -12.524
  347    HZ3  LYS  49           HZ2      LYS  49  -2.132   6.938 -13.002
  348    H    SER  50           HN       SER  50   0.423   3.297  -8.366
  349    HA   SER  50           HA       SER  50   0.172   1.381 -10.512
  350    HG   SER  50           HG       SER  50   2.863   4.158 -11.244
  351    HB2  SER  50           HB2      SER  50   1.840   2.489 -11.969
  352    HB3  SER  50           HB1      SER  50   0.366   3.443 -11.801
  353    H    LEU  51           HN       LEU  51   2.413   0.498 -11.094
  354    HA   LEU  51           HA       LEU  51   4.155   0.491  -8.723
  355    HG   LEU  51           HG       LEU  51   1.634  -1.165  -8.637
  356    HB2  LEU  51           HB2      LEU  51   3.319  -1.902 -10.362
  357    HB3  LEU  51           HB1      LEU  51   4.518  -1.930  -9.084
  358   HD11  LEU  51          HD11      LEU  51   2.991  -3.827  -8.237
  359   HD12  LEU  51          HD12      LEU  51   1.727  -3.460  -9.411
  360   HD13  LEU  51          HD13      LEU  51   1.369  -3.412  -7.685
  361   HD21  LEU  51          HD23      LEU  51   3.188  -0.298  -6.975
  362   HD22  LEU  51          HD21      LEU  51   3.860  -1.912  -6.743
  363   HD23  LEU  51          HD22      LEU  51   2.189  -1.579  -6.286
  364    H    ILE  52           HN       ILE  52   6.370   0.056  -9.118
  365    HA   ILE  52           HA       ILE  52   7.262   0.982 -11.708
  366    HB   ILE  52           HB       ILE  52   8.902   0.166  -9.304
  367   HG12  ILE  52          HG12      ILE  52   7.396   2.031  -8.784
  368   HG13  ILE  52          HG11      ILE  52   9.069   2.575  -8.843
  369   HG21  ILE  52          HG21      ILE  52   9.643   1.728 -11.775
  370   HG22  ILE  52          HG22      ILE  52  10.191   0.105 -11.355
  371   HG23  ILE  52          HG23      ILE  52  10.683   1.484 -10.371
  372   HD11  ILE  52          HD13      ILE  52   7.601   4.185  -9.891
  373   HD12  ILE  52          HD11      ILE  52   7.002   2.949 -10.998
  374   HD13  ILE  52          HD12      ILE  52   8.683   3.473 -11.088
  375    HA   PRO  53           HA       PRO  53   7.528  -3.274 -13.217
  376    HB2  PRO  53           HB2      PRO  53   8.943  -1.895 -15.433
  377    HB3  PRO  53           HB1      PRO  53   7.571  -3.007 -15.492
  378    HG2  PRO  53           HG2      PRO  53   7.225  -0.399 -15.905
  379    HG3  PRO  53           HG1      PRO  53   6.033  -1.344 -14.991
  380    HD2  PRO  53           HD2      PRO  53   8.143   0.528 -13.990
  381    HD3  PRO  53           HD1      PRO  53   6.473   0.308 -13.428
  382    H    GLY  54           HN       GLY  54   9.057  -4.740 -12.795
  383    HA2  GLY  54           HA2      GLY  54  11.175  -5.706 -12.766
  384    HA3  GLY  54           HA1      GLY  54  11.857  -4.171 -13.280
  385    H    SER  55           HN       SER  55   9.761  -3.811 -10.647
  386    HA   SER  55           HA       SER  55  12.068  -3.501  -8.865
  387    HG   SER  55           HG       SER  55  11.620  -1.567  -7.269
  388    HB2  SER  55           HB2      SER  55  10.526  -1.563  -9.193
  389    HB3  SER  55           HB1      SER  55   9.237  -2.516  -8.458
  390    H    ALA  56           HN       ALA  56  11.545  -3.953  -6.480
  391    HA   ALA  56           HA       ALA  56  11.154  -6.686  -6.132
  392    HB1  ALA  56           HB3      ALA  56  12.354  -5.274  -4.534
  393    HB2  ALA  56           HB1      ALA  56  11.098  -6.226  -3.743
  394    HB3  ALA  56           HB2      ALA  56  10.833  -4.513  -4.067
  395    H    ALA  57           HN       ALA  57   8.922  -4.041  -5.285
  396    HA   ALA  57           HA       ALA  57   6.793  -5.484  -4.329
  397    HB1  ALA  57           HB3      ALA  57   6.640  -3.012  -6.049
  398    HB2  ALA  57           HB1      ALA  57   6.906  -3.041  -4.306
  399    HB3  ALA  57           HB2      ALA  57   5.376  -3.611  -4.974
  400    H    ALA  58           HN       ALA  58   7.527  -4.729  -7.718
  401    HA   ALA  58           HA       ALA  58   5.200  -5.911  -8.805
  402    HB1  ALA  58           HB3      ALA  58   6.560  -4.273 -10.019
  403    HB2  ALA  58           HB1      ALA  58   6.336  -5.757 -10.947
  404    HB3  ALA  58           HB2      ALA  58   7.869  -5.451 -10.129
  405    H    LEU  59           HN       LEU  59   8.359  -7.186  -7.961
  406    HA   LEU  59           HA       LEU  59   8.151  -9.638  -9.352
  407    HG   LEU  59           HG       LEU  59  10.475  -7.742  -9.013
  408    HB2  LEU  59           HB2      LEU  59   9.757  -8.858  -6.922
  409    HB3  LEU  59           HB1      LEU  59   9.905 -10.412  -7.720
  410   HD11  LEU  59          HD11      LEU  59  12.820  -8.436  -8.906
  411   HD12  LEU  59          HD12      LEU  59  12.350  -9.873  -7.997
  412   HD13  LEU  59          HD13      LEU  59  12.114  -8.271  -7.298
  413   HD21  LEU  59          HD23      LEU  59  11.440  -9.100 -10.816
  414   HD22  LEU  59          HD21      LEU  59   9.713  -9.397 -10.618
  415   HD23  LEU  59          HD22      LEU  59  10.884 -10.561 -10.000
  416    H    ASP  60           HN       ASP  60   7.033  -8.586  -6.195
  417    HA   ASP  60           HA       ASP  60   6.498 -11.081  -5.052
  418    HB2  ASP  60           HB2      ASP  60   4.993  -8.482  -4.683
  419    HB3  ASP  60           HB1      ASP  60   4.880  -9.883  -3.622
  420    H    GLY  61           HN       GLY  61   4.442  -8.993  -7.054
  421    HA2  GLY  61           HA2      GLY  61   2.834  -9.683  -8.598
  422    HA3  GLY  61           HA1      GLY  61   2.998 -11.326  -8.000
  423    H    ARG  62           HN       ARG  62   2.602 -10.589  -5.216
  424    HA   ARG  62           HA       ARG  62  -0.221 -10.804  -5.121
  425    HE   ARG  62           HE       ARG  62  -0.214 -12.066  -1.339
  426    HB2  ARG  62           HB2      ARG  62   1.718 -10.147  -2.894
  427    HB3  ARG  62           HB1      ARG  62   0.054 -10.674  -2.686
  428    HG2  ARG  62           HG2      ARG  62   0.604 -12.815  -3.734
  429    HG3  ARG  62           HG1      ARG  62   2.274 -12.284  -3.931
  430    HD2  ARG  62           HD2      ARG  62   2.017 -13.722  -1.971
  431    HD3  ARG  62           HD1      ARG  62   2.515 -12.093  -1.516
  432   HH11  ARG  62          HH11      ARG  62   2.336 -13.984   0.062
  433   HH12  ARG  62          HH12      ARG  62   1.469 -14.299   1.527
  434   HH21  ARG  62          HH21      ARG  62  -1.363 -12.478   0.585
  435   HH22  ARG  62          HH22      ARG  62  -0.633 -13.443   1.824
  436    H    ILE  63           HN       ILE  63   1.940  -8.131  -5.182
  437    HA   ILE  63           HA       ILE  63  -0.070  -6.273  -4.168
  438    HB   ILE  63           HB       ILE  63   2.747  -5.721  -5.115
  439   HG12  ILE  63          HG12      ILE  63   1.687  -5.850  -2.285
  440   HG13  ILE  63          HG11      ILE  63   2.545  -7.173  -3.069
  441   HG21  ILE  63          HG21      ILE  63   0.772  -3.976  -3.647
  442   HG22  ILE  63          HG22      ILE  63   1.315  -3.771  -5.312
  443   HG23  ILE  63          HG23      ILE  63   2.453  -3.559  -3.983
  444   HD11  ILE  63          HD13      ILE  63   3.650  -4.430  -2.514
  445   HD12  ILE  63          HD11      ILE  63   4.512  -5.745  -3.313
  446   HD13  ILE  63          HD12      ILE  63   4.022  -5.908  -1.627
  447    H    GLU  64           HN       GLU  64  -1.527  -5.498  -5.532
  448    HA   GLU  64           HA       GLU  64  -0.728  -5.024  -8.329
  449    HB2  GLU  64           HB2      GLU  64  -2.975  -5.527  -9.024
  450    HB3  GLU  64           HB1      GLU  64  -2.408  -6.850  -8.014
  451    HG2  GLU  64           HG2      GLU  64  -3.635  -5.868  -6.108
  452    HG3  GLU  64           HG1      GLU  64  -4.266  -4.631  -7.194
  453    HA   PRO  65           HA       PRO  65  -1.703  -0.739  -7.969
  454    HB2  PRO  65           HB2      PRO  65  -3.296  -0.294 -10.171
  455    HB3  PRO  65           HB1      PRO  65  -1.532  -0.396 -10.220
  456    HG2  PRO  65           HG2      PRO  65  -3.568  -2.507 -10.830
  457    HG3  PRO  65           HG1      PRO  65  -2.080  -2.100 -11.708
  458    HD2  PRO  65           HD2      PRO  65  -2.169  -4.205 -10.072
  459    HD3  PRO  65           HD1      PRO  65  -0.724  -3.175 -10.148
  460    H    ASN  66           HN       ASN  66  -3.649   0.842  -8.090
  461    HA   ASN  66           HA       ASN  66  -5.593   1.521  -7.121
  462    HB2  ASN  66           HB2      ASN  66  -6.567  -1.140  -8.185
  463    HB3  ASN  66           HB1      ASN  66  -7.606   0.163  -7.617
  464   HD21  ASN  66          HD21      ASN  66  -7.794   2.041  -8.842
  465   HD22  ASN  66          HD22      ASN  66  -7.320   2.102 -10.502
  466    H    ASP  67           HN       ASP  67  -3.712   0.181  -5.445
  467    HA   ASP  67           HA       ASP  67  -5.401  -1.334  -3.583
  468    HB2  ASP  67           HB2      ASP  67  -3.360  -2.472  -4.087
  469    HB3  ASP  67           HB1      ASP  67  -2.407  -1.015  -3.819
  470    H    LYS  68           HN       LYS  68  -5.440  -0.800  -1.327
  471    HA   LYS  68           HA       LYS  68  -4.873   2.049  -0.842
  472    HB2  LYS  68           HB2      LYS  68  -7.258   1.450  -0.727
  473    HB3  LYS  68           HB1      LYS  68  -6.897   0.264   0.521
  474    HG2  LYS  68           HG2      LYS  68  -6.231   1.976   2.050
  475    HG3  LYS  68           HG1      LYS  68  -6.353   3.208   0.793
  476    HD2  LYS  68           HD2      LYS  68  -8.769   2.766   0.628
  477    HD3  LYS  68           HD1      LYS  68  -8.626   1.581   1.929
  478    HE2  LYS  68           HE2      LYS  68  -7.852   3.323   3.444
  479    HE3  LYS  68           HE1      LYS  68  -7.950   4.512   2.147
  480    HZ1  LYS  68           HZ3      LYS  68 -10.333   4.138   2.032
  481    HZ2  LYS  68           HZ1      LYS  68  -9.883   4.611   3.593
  482    HZ3  LYS  68           HZ2      LYS  68 -10.240   2.990   3.271
  483    H    ILE  69           HN       ILE  69  -2.821   1.953  -0.047
  484    HA   ILE  69           HA       ILE  69  -1.808   0.032   1.722
  485    HB   ILE  69           HB       ILE  69  -0.937   2.912   1.446
  486   HG12  ILE  69          HG12      ILE  69  -0.945   1.710  -0.706
  487   HG13  ILE  69          HG11      ILE  69   0.690   2.087  -0.178
  488   HG21  ILE  69          HG21      ILE  69  -0.060   1.850   3.456
  489   HG22  ILE  69          HG22      ILE  69   1.223   2.121   2.277
  490   HG23  ILE  69          HG23      ILE  69   0.550   0.505   2.491
  491   HD11  ILE  69          HD13      ILE  69   0.951  -0.218   0.609
  492   HD12  ILE  69          HD11      ILE  69   0.580  -0.139  -1.114
  493   HD13  ILE  69          HD12      ILE  69  -0.678  -0.585   0.040
  494    H    LEU  70           HN       LEU  70  -1.916  -0.232   3.868
  495    HA   LEU  70           HA       LEU  70  -3.532   1.686   5.388
  496    HG   LEU  70           HG       LEU  70  -4.403  -1.039   4.215
  497    HB2  LEU  70           HB2      LEU  70  -2.733  -1.145   6.073
  498    HB3  LEU  70           HB1      LEU  70  -3.791  -0.124   7.026
  499   HD11  LEU  70          HD11      LEU  70  -5.989  -2.580   5.256
  500   HD12  LEU  70          HD12      LEU  70  -5.416  -2.095   6.852
  501   HD13  LEU  70          HD13      LEU  70  -4.331  -2.936   5.744
  502   HD21  LEU  70          HD23      LEU  70  -5.492   1.053   4.842
  503   HD22  LEU  70          HD21      LEU  70  -6.113   0.298   6.311
  504   HD23  LEU  70          HD22      LEU  70  -6.663  -0.261   4.731
  505    H    ARG  71           HN       ARG  71  -0.778  -0.475   6.120
  506    HA   ARG  71           HA       ARG  71   0.680   1.770   7.241
  507    HE   ARG  71           HE       ARG  71  -1.701   0.620  10.566
  508    HB2  ARG  71           HB2      ARG  71   1.043   0.588   9.406
  509    HB3  ARG  71           HB1      ARG  71  -0.610   1.133   9.155
  510    HG2  ARG  71           HG2      ARG  71  -1.265  -1.129   8.522
  511    HG3  ARG  71           HG1      ARG  71   0.397  -1.677   8.760
  512    HD2  ARG  71           HD2      ARG  71  -1.079  -2.173  10.684
  513    HD3  ARG  71           HD1      ARG  71   0.292  -1.147  11.104
  514   HH11  ARG  71          HH11      ARG  71  -1.412  -2.131  12.686
  515   HH12  ARG  71          HH12      ARG  71  -2.510  -1.498  13.866
  516   HH21  ARG  71          HH21      ARG  71  -3.147   1.459  12.110
  517   HH22  ARG  71          HH22      ARG  71  -3.496   0.544  13.538
  518    H    VAL  72           HN       VAL  72   2.806   1.571   7.052
  519    HA   VAL  72           HA       VAL  72   3.885  -0.816   5.796
  520    HB   VAL  72           HB       VAL  72   5.371   1.713   6.525
  521   HG11  VAL  72          HG11      VAL  72   5.902  -0.444   4.488
  522   HG12  VAL  72          HG12      VAL  72   6.834  -0.109   5.947
  523   HG13  VAL  72          HG13      VAL  72   6.818   1.056   4.625
  524   HG21  VAL  72          HG23      VAL  72   3.430   2.319   5.190
  525   HG22  VAL  72          HG21      VAL  72   3.866   1.111   3.982
  526   HG23  VAL  72          HG22      VAL  72   4.912   2.505   4.252
  527    H    ASP  73           HN       ASP  73   6.133  -1.524   6.612
  528    HA   ASP  73           HA       ASP  73   5.997  -2.702   9.065
  529    HB2  ASP  73           HB2      ASP  73   7.731  -3.043   7.229
  530    HB3  ASP  73           HB1      ASP  73   8.603  -1.689   7.938
  531    H    ASP  74           HN       ASP  74   5.800  -1.940  11.033
  532    HA   ASP  74           HA       ASP  74   5.792  -0.554  12.832
  533    HB2  ASP  74           HB2      ASP  74   7.947   0.036  13.661
  534    HB3  ASP  74           HB1      ASP  74   8.124  -1.484  12.791
  535    H    VAL  75           HN       VAL  75   5.250   0.742  10.112
  536    HA   VAL  75           HA       VAL  75   5.230   3.469  11.137
  537    HB   VAL  75           HB       VAL  75   6.463   2.769   8.465
  538   HG11  VAL  75          HG11      VAL  75   5.101   4.725   8.182
  539   HG12  VAL  75          HG12      VAL  75   6.792   5.228   8.242
  540   HG13  VAL  75          HG13      VAL  75   5.755   5.449   9.652
  541   HG21  VAL  75          HG23      VAL  75   7.628   4.115  10.902
  542   HG22  VAL  75          HG21      VAL  75   8.456   3.881   9.363
  543   HG23  VAL  75          HG22      VAL  75   7.994   2.485  10.337
  544    H    ASN  76           HN       ASN  76   3.040   3.599  11.195
  545    HA   ASN  76           HA       ASN  76   1.381   2.604   9.079
  546    HB2  ASN  76           HB2      ASN  76  -0.476   3.563  10.352
  547    HB3  ASN  76           HB1      ASN  76   0.594   2.653  11.414
  548   HD21  ASN  76          HD21      ASN  76  -1.287   4.762  12.063
  549   HD22  ASN  76          HD22      ASN  76  -0.370   6.011  12.826
  550    H    VAL  77           HN       VAL  77   0.237   3.757   7.531
  551    HA   VAL  77           HA       VAL  77   1.132   6.543   7.143
  552    HB   VAL  77           HB       VAL  77   0.853   6.210   4.728
  553   HG11  VAL  77          HG11      VAL  77   2.670   4.242   6.106
  554   HG12  VAL  77          HG12      VAL  77   3.055   5.886   5.599
  555   HG13  VAL  77          HG13      VAL  77   2.761   4.637   4.391
  556   HG21  VAL  77          HG23      VAL  77   0.508   3.969   3.811
  557   HG22  VAL  77          HG21      VAL  77  -0.869   4.481   4.789
  558   HG23  VAL  77          HG22      VAL  77   0.299   3.332   5.443
  559    H    GLN  78           HN       GLN  78  -1.208   5.623   8.632
  560    HA   GLN  78           HA       GLN  78  -3.465   6.306   6.928
  561    HB2  GLN  78           HB2      GLN  78  -3.312   5.488   9.832
  562    HB3  GLN  78           HB1      GLN  78  -4.811   5.837   8.982
  563    HG2  GLN  78           HG2      GLN  78  -2.859   3.670   8.245
  564    HG3  GLN  78           HG1      GLN  78  -4.354   3.436   9.149
  565   HE21  GLN  78          HE21      GLN  78  -2.958   4.147   6.047
  566   HE22  GLN  78          HE22      GLN  78  -4.391   3.890   5.117
  567    H    GLY  79           HN       GLY  79  -1.662   8.416   7.216
  568    HA2  GLY  79           HA2      GLY  79  -3.175  10.604   7.649
  569    HA3  GLY  79           HA1      GLY  79  -2.659  10.192   9.276
  570    H    MET  80           HN       MET  80  -0.560   9.559   6.570
  571    HA   MET  80           HA       MET  80   1.115  11.832   7.414
  572    HB2  MET  80           HB2      MET  80   2.057   9.193   6.278
  573    HB3  MET  80           HB1      MET  80   3.077  10.511   6.840
  574    HG2  MET  80           HG2      MET  80   1.939  10.182   9.104
  575    HG3  MET  80           HG1      MET  80   1.364   8.651   8.446
  576    HE1  MET  80           HE3      MET  80   3.082   6.826   7.390
  577    HE2  MET  80           HE1      MET  80   4.833   6.927   7.575
  578    HE3  MET  80           HE2      MET  80   3.992   8.059   6.517
  579    H    ALA  81           HN       ALA  81   1.950  13.157   5.878
  580    HA   ALA  81           HA       ALA  81   0.669  13.377   3.402
  581    HB1  ALA  81           HB3      ALA  81   3.320  14.551   4.231
  582    HB2  ALA  81           HB1      ALA  81   1.736  15.264   4.533
  583    HB3  ALA  81           HB2      ALA  81   2.322  15.088   2.880
  584    H    GLN  82           HN       GLN  82   1.679  13.304   1.248
  585    HA   GLN  82           HA       GLN  82   2.629  10.785   0.599
  586    HB2  GLN  82           HB2      GLN  82   1.593  12.293  -1.030
  587    HB3  GLN  82           HB1      GLN  82   2.989  13.359  -0.946
  588    HG2  GLN  82           HG2      GLN  82   4.401  11.608  -1.870
  589    HG3  GLN  82           HG1      GLN  82   3.022  10.512  -1.923
  590   HE21  GLN  82          HE21      GLN  82   1.421  10.823  -3.463
  591   HE22  GLN  82          HE22      GLN  82   1.652  11.837  -4.843
  592    H    SER  83           HN       SER  83   4.516  13.815   0.644
  593    HA   SER  83           HA       SER  83   7.012  12.797   0.103
  594    HG   SER  83           HG       SER  83   5.608  14.547   2.656
  595    HB2  SER  83           HB2      SER  83   7.919  14.758   1.303
  596    HB3  SER  83           HB1      SER  83   6.566  15.194   0.260
  597    H    ASP  84           HN       ASP  84   5.237  12.698   3.125
  598    HA   ASP  84           HA       ASP  84   7.416  11.912   4.767
  599    HB2  ASP  84           HB2      ASP  84   5.271  12.883   5.614
  600    HB3  ASP  84           HB1      ASP  84   4.476  11.363   5.217
  601    H    VAL  85           HN       VAL  85   4.844  10.081   3.130
  602    HA   VAL  85           HA       VAL  85   5.651   7.537   4.050
  603    HB   VAL  85           HB       VAL  85   4.251   8.081   1.433
  604   HG11  VAL  85          HG11      VAL  85   3.211   5.901   1.860
  605   HG12  VAL  85          HG12      VAL  85   4.167   5.742   3.333
  606   HG13  VAL  85          HG13      VAL  85   4.967   5.781   1.762
  607   HG21  VAL  85          HG23      VAL  85   2.140   7.933   2.696
  608   HG22  VAL  85          HG21      VAL  85   3.106   9.334   3.161
  609   HG23  VAL  85          HG22      VAL  85   3.062   7.910   4.200
  610    H    VAL  86           HN       VAL  86   6.737   9.565   1.440
  611    HA   VAL  86           HA       VAL  86   8.066   7.601  -0.093
  612    HB   VAL  86           HB       VAL  86   8.589  10.568   0.130
  613   HG11  VAL  86          HG11      VAL  86   9.570   8.582  -1.917
  614   HG12  VAL  86          HG12      VAL  86  10.556   9.449  -0.740
  615   HG13  VAL  86          HG13      VAL  86   9.743  10.333  -2.030
  616   HG21  VAL  86          HG23      VAL  86   7.285  10.749  -1.901
  617   HG22  VAL  86          HG21      VAL  86   6.334   9.941  -0.657
  618   HG23  VAL  86          HG22      VAL  86   7.071   8.999  -1.952
  619    H    GLU  87           HN       GLU  87   9.429  10.022   2.167
  620    HA   GLU  87           HA       GLU  87  12.039   9.087   2.155
  621    HB2  GLU  87           HB2      GLU  87  12.322  10.231   4.299
  622    HB3  GLU  87           HB1      GLU  87  11.401  11.218   3.172
  623    HG2  GLU  87           HG2      GLU  87   9.330  10.528   4.289
  624    HG3  GLU  87           HG1      GLU  87  10.281   9.587   5.439
  625    H    VAL  88           HN       VAL  88   9.268   7.969   4.028
  626    HA   VAL  88           HA       VAL  88  10.575   6.321   5.858
  627    HB   VAL  88           HB       VAL  88   7.864   6.027   4.563
  628   HG11  VAL  88          HG11      VAL  88   7.339   4.408   6.343
  629   HG12  VAL  88          HG12      VAL  88   9.027   4.442   6.853
  630   HG13  VAL  88          HG13      VAL  88   8.600   3.819   5.259
  631   HG21  VAL  88          HG23      VAL  88   8.286   7.986   6.048
  632   HG22  VAL  88          HG21      VAL  88   8.611   6.858   7.362
  633   HG23  VAL  88          HG22      VAL  88   7.011   6.910   6.620
  634    H    LEU  89           HN       LEU  89   9.159   5.391   2.721
  635    HA   LEU  89           HA       LEU  89  10.027   2.744   2.721
  636    HG   LEU  89           HG       LEU  89   7.588   4.380   1.796
  637    HB2  LEU  89           HB2      LEU  89   9.620   4.557   0.342
  638    HB3  LEU  89           HB1      LEU  89   9.679   2.806   0.294
  639   HD11  LEU  89          HD11      LEU  89   7.396   4.798  -0.592
  640   HD12  LEU  89          HD12      LEU  89   6.075   3.773  -0.027
  641   HD13  LEU  89          HD13      LEU  89   7.427   3.063  -0.911
  642   HD21  LEU  89          HD23      LEU  89   7.782   1.460   1.066
  643   HD22  LEU  89          HD21      LEU  89   6.408   2.232   1.857
  644   HD23  LEU  89          HD22      LEU  89   7.965   2.145   2.680
  645    H    ARG  90           HN       ARG  90  11.751   5.681   2.016
  646    HA   ARG  90           HA       ARG  90  13.970   4.290   0.764
  647    HE   ARG  90           HE       ARG  90  11.523   8.160  -1.925
  648    HB2  ARG  90           HB2      ARG  90  13.733   7.189   1.582
  649    HB3  ARG  90           HB1      ARG  90  14.984   6.498   0.556
  650    HG2  ARG  90           HG2      ARG  90  13.267   5.911  -1.102
  651    HG3  ARG  90           HG1      ARG  90  12.048   6.676  -0.083
  652    HD2  ARG  90           HD2      ARG  90  13.360   8.794  -0.241
  653    HD3  ARG  90           HD1      ARG  90  14.407   7.996  -1.415
  654   HH11  ARG  90          HH11      ARG  90  14.795   9.018  -2.763
  655   HH12  ARG  90          HH12      ARG  90  14.364   9.665  -4.311
  656   HH21  ARG  90          HH21      ARG  90  10.946   9.010  -3.955
  657   HH22  ARG  90          HH22      ARG  90  12.172   9.663  -4.988
  658    H    ASN  91           HN       ASN  91  13.009   5.170   3.916
  659    HA   ASN  91           HA       ASN  91  15.727   5.164   4.966
  660    HB2  ASN  91           HB2      ASN  91  13.048   5.574   6.307
  661    HB3  ASN  91           HB1      ASN  91  14.586   5.584   7.163
  662   HD21  ASN  91          HD21      ASN  91  15.975   6.875   4.932
  663   HD22  ASN  91          HD22      ASN  91  15.486   8.531   4.965
  664    H    ALA  92           HN       ALA  92  13.251   2.964   4.324
  665    HA   ALA  92           HA       ALA  92  13.293   1.133   6.374
  666    HB1  ALA  92           HB3      ALA  92  12.700  -0.558   4.702
  667    HB2  ALA  92           HB1      ALA  92  13.183   0.550   3.418
  668    HB3  ALA  92           HB2      ALA  92  11.812   0.947   4.455
  669    H    GLY  93           HN       GLY  93  15.001   0.191   3.424
  670    HA2  GLY  93           HA2      GLY  93  17.038  -0.823   3.101
  671    HA3  GLY  93           HA1      GLY  93  17.596   0.060   4.514
  672    H    ASN  94           HN       ASN  94  14.878  -1.956   4.996
  673    HA   ASN  94           HA       ASN  94  16.471  -4.248   5.831
  674    HB2  ASN  94           HB2      ASN  94  15.162  -4.162   8.078
  675    HB3  ASN  94           HB1      ASN  94  16.563  -3.117   7.876
  676   HD21  ASN  94          HD21      ASN  94  13.463  -2.556   6.352
  677   HD22  ASN  94          HD22      ASN  94  13.064  -1.140   7.254
  678    HA   PRO  95           HA       PRO  95  12.923  -6.722   4.786
  679    HB2  PRO  95           HB2      PRO  95  12.703  -7.777   7.554
  680    HB3  PRO  95           HB1      PRO  95  12.924  -8.649   6.034
  681    HG2  PRO  95           HG2      PRO  95  14.938  -8.392   7.756
  682    HG3  PRO  95           HG1      PRO  95  15.216  -8.285   6.007
  683    HD2  PRO  95           HD2      PRO  95  15.039  -6.090   8.037
  684    HD3  PRO  95           HD1      PRO  95  16.151  -6.267   6.663
  685    H    VAL  96           HN       VAL  96  11.453  -4.976   4.540
  686    HA   VAL  96           HA       VAL  96   9.830  -4.255   6.864
  687    HB   VAL  96           HB       VAL  96   8.835  -2.540   5.332
  688   HG11  VAL  96          HG11      VAL  96  11.829  -2.442   5.666
  689   HG12  VAL  96          HG12      VAL  96  10.637  -1.989   6.883
  690   HG13  VAL  96          HG13      VAL  96  10.770  -1.059   5.391
  691   HG21  VAL  96          HG23      VAL  96   9.309  -3.676   3.213
  692   HG22  VAL  96          HG21      VAL  96  11.037  -3.430   3.469
  693   HG23  VAL  96          HG22      VAL  96   9.973  -2.043   3.236
  694    H    ARG  97           HN       ARG  97   7.633  -4.508   6.960
  695    HA   ARG  97           HA       ARG  97   6.499  -6.453   5.090
  696    HE   ARG  97           HE       ARG  97   2.615  -8.930   6.890
  697    HB2  ARG  97           HB2      ARG  97   6.489  -7.003   7.522
  698    HB3  ARG  97           HB1      ARG  97   5.473  -5.596   7.804
  699    HG2  ARG  97           HG2      ARG  97   3.712  -6.561   6.446
  700    HG3  ARG  97           HG1      ARG  97   4.736  -7.950   6.077
  701    HD2  ARG  97           HD2      ARG  97   4.796  -8.523   8.464
  702    HD3  ARG  97           HD1      ARG  97   3.753  -7.145   8.814
  703   HH11  ARG  97          HH11      ARG  97   3.094  -8.385  10.301
  704   HH12  ARG  97          HH12      ARG  97   1.705  -9.307  10.772
  705   HH21  ARG  97          HH21      ARG  97   0.787 -10.143   7.504
  706   HH22  ARG  97          HH22      ARG  97   0.396 -10.307   9.183
  707    H    LEU  98           HN       LEU  98   4.585  -6.052   4.020
  708    HA   LEU  98           HA       LEU  98   3.691  -3.247   4.057
  709    HG   LEU  98           HG       LEU  98   5.881  -4.431   2.265
  710    HB2  LEU  98           HB2      LEU  98   3.530  -5.242   1.801
  711    HB3  LEU  98           HB1      LEU  98   3.044  -3.559   1.729
  712   HD11  LEU  98          HD11      LEU  98   6.326  -3.904  -0.085
  713   HD12  LEU  98          HD12      LEU  98   4.601  -3.651  -0.352
  714   HD13  LEU  98          HD13      LEU  98   5.201  -5.253   0.077
  715   HD21  LEU  98          HD23      LEU  98   5.362  -2.182   3.009
  716   HD22  LEU  98          HD21      LEU  98   4.660  -1.799   1.438
  717   HD23  LEU  98          HD22      LEU  98   6.387  -2.123   1.576
  718    H    LEU  99           HN       LEU  99   1.872  -3.126   5.245
  719    HA   LEU  99           HA       LEU  99  -0.119  -5.266   4.991
  720    HG   LEU  99           HG       LEU  99  -2.288  -4.020   6.736
  721    HB2  LEU  99           HB2      LEU  99   0.642  -4.538   7.261
  722    HB3  LEU  99           HB1      LEU  99  -0.061  -2.965   6.944
  723   HD11  LEU  99          HD11      LEU  99  -2.570  -6.342   7.501
  724   HD12  LEU  99          HD12      LEU  99  -0.816  -6.520   7.553
  725   HD13  LEU  99          HD13      LEU  99  -1.628  -6.230   6.015
  726   HD21  LEU  99          HD23      LEU  99  -1.783  -3.093   8.852
  727   HD22  LEU  99          HD21      LEU  99  -0.738  -4.448   9.278
  728   HD23  LEU  99          HD22      LEU  99  -2.482  -4.681   9.164
  729    H    LEU 100           HN       LEU 100  -1.273  -4.864   3.170
  730    HA   LEU 100           HA       LEU 100  -2.648  -2.263   3.030
  731    HG   LEU 100           HG       LEU 100  -0.045  -4.122   1.426
  732    HB2  LEU 100           HB2      LEU 100  -2.593  -2.822   0.449
  733    HB3  LEU 100           HB1      LEU 100  -1.282  -1.965   1.236
  734   HD11  LEU 100          HD11      LEU 100  -0.776  -6.025   0.102
  735   HD12  LEU 100          HD12      LEU 100  -2.255  -5.169  -0.337
  736   HD13  LEU 100          HD13      LEU 100  -1.967  -5.631   1.341
  737   HD21  LEU 100          HD23      LEU 100  -0.854  -3.313  -1.364
  738   HD22  LEU 100          HD21      LEU 100   0.587  -4.232  -0.929
  739   HD23  LEU 100          HD22      LEU 100   0.411  -2.562  -0.391
  740    H    ILE 101           HN       ILE 101  -4.650  -2.330   1.689
  741    HA   ILE 101           HA       ILE 101  -5.992  -4.937   1.980
  742    HB   ILE 101           HB       ILE 101  -6.879  -3.314   3.572
  743   HG12  ILE 101          HG12      ILE 101  -8.834  -3.782   1.310
  744   HG13  ILE 101          HG11      ILE 101  -8.380  -4.995   2.502
  745   HG21  ILE 101          HG21      ILE 101  -6.323  -1.269   2.367
  746   HG22  ILE 101          HG22      ILE 101  -8.028  -1.293   2.818
  747   HG23  ILE 101          HG23      ILE 101  -7.549  -1.639   1.156
  748   HD11  ILE 101          HD13      ILE 101  -9.294  -3.558   4.273
  749   HD12  ILE 101          HD11      ILE 101 -10.504  -4.012   3.072
  750   HD13  ILE 101          HD12      ILE 101  -9.796  -2.396   3.044
  751    H    ARG 102           HN       ARG 102  -7.184  -5.709   0.321
  752    HA   ARG 102           HA       ARG 102  -7.443  -4.050  -2.093
  753    HE   ARG 102           HE       ARG 102  -5.915  -5.620  -5.491
  754    HB2  ARG 102           HB2      ARG 102  -6.293  -6.808  -1.831
  755    HB3  ARG 102           HB1      ARG 102  -7.079  -6.323  -3.326
  756    HG2  ARG 102           HG2      ARG 102  -4.794  -4.833  -2.057
  757    HG3  ARG 102           HG1      ARG 102  -4.615  -6.042  -3.330
  758    HD2  ARG 102           HD2      ARG 102  -6.155  -3.455  -3.514
  759    HD3  ARG 102           HD1      ARG 102  -4.606  -3.807  -4.280
  760   HH11  ARG 102          HH11      ARG 102  -7.337  -2.627  -4.412
  761   HH12  ARG 102          HH12      ARG 102  -8.556  -2.613  -5.642
  762   HH21  ARG 102          HH21      ARG 102  -7.518  -5.611  -7.113
  763   HH22  ARG 102          HH22      ARG 102  -8.659  -4.309  -7.179
  764    H    ARG 103           HN       ARG 103  -9.371  -4.152  -3.098
  765    HA   ARG 103           HA       ARG 103 -11.413  -5.856  -1.880
  766    HE   ARG 103           HE       ARG 103 -11.338  -1.258  -5.736
  767    HB2  ARG 103           HB2      ARG 103 -13.024  -4.385  -3.044
  768    HB3  ARG 103           HB1      ARG 103 -11.942  -3.490  -1.986
  769    HG2  ARG 103           HG2      ARG 103 -10.608  -2.804  -3.900
  770    HG3  ARG 103           HG1      ARG 103 -11.654  -3.733  -4.974
  771    HD2  ARG 103           HD2      ARG 103 -13.559  -2.334  -4.300
  772    HD3  ARG 103           HD1      ARG 103 -12.487  -1.391  -3.265
  773   HH11  ARG 103          HH11      ARG 103 -14.482  -0.498  -4.440
  774   HH12  ARG 103          HH12      ARG 103 -14.786   0.770  -5.579
  775   HH21  ARG 103          HH21      ARG 103 -11.731   0.411  -7.238
  776   HH22  ARG 103          HH22      ARG 103 -13.224   1.287  -7.169
  777    H    LEU 104           HN       LEU 104 -12.479  -7.421  -2.958
  778    HA   LEU 104           HA       LEU 104 -11.400  -8.242  -5.523
  779    HG   LEU 104           HG       LEU 104 -11.355  -9.355  -2.603
  780    HB2  LEU 104           HB2      LEU 104 -13.529  -9.580  -3.855
  781    HB3  LEU 104           HB1      LEU 104 -12.619 -10.295  -5.173
  782   HD11  LEU 104          HD11      LEU 104 -12.934 -11.133  -2.111
  783   HD12  LEU 104          HD12      LEU 104 -11.275 -11.715  -1.962
  784   HD13  LEU 104          HD13      LEU 104 -12.231 -12.129  -3.385
  785   HD21  LEU 104          HD23      LEU 104  -9.849  -9.477  -4.521
  786   HD22  LEU 104          HD21      LEU 104 -10.351 -11.143  -4.813
  787   HD23  LEU 104          HD22      LEU 104  -9.479 -10.731  -3.337
  788    HA   PRO 105           HA       PRO 105 -14.841  -6.660  -7.844
  789    HB2  PRO 105           HB2      PRO 105 -14.565  -7.991 -10.134
  790    HB3  PRO 105           HB1      PRO 105 -13.310  -6.863  -9.598
  791    HG2  PRO 105           HG2      PRO 105 -13.406  -9.849  -9.310
  792    HG3  PRO 105           HG1      PRO 105 -12.071  -8.837  -9.901
  793    HD2  PRO 105           HD2      PRO 105 -12.214  -9.763  -7.346
  794    HD3  PRO 105           HD1      PRO 105 -11.439  -8.223  -7.769
  795    H    LEU 106           HN       LEU 106 -15.920  -8.164  -6.012
  796    HA   LEU 106           HA       LEU 106 -17.368 -10.394  -7.190
  797    HG   LEU 106           HG       LEU 106 -15.339 -10.664  -5.042
  798    HB2  LEU 106           HB2      LEU 106 -17.293  -9.253  -4.401
  799    HB3  LEU 106           HB1      LEU 106 -18.351 -10.571  -4.870
  800   HD11  LEU 106          HD11      LEU 106 -16.035 -10.523  -2.727
  801   HD12  LEU 106          HD12      LEU 106 -15.486 -12.158  -3.096
  802   HD13  LEU 106          HD13      LEU 106 -17.212 -11.812  -2.977
  803   HD21  LEU 106          HD23      LEU 106 -16.453 -12.127  -6.639
  804   HD22  LEU 106          HD21      LEU 106 -17.436 -12.812  -5.345
  805   HD23  LEU 106          HD22      LEU 106 -15.691 -13.067  -5.356
  806    H    LEU 107           HN       LEU 107 -18.851  -9.590  -8.600
  807    HA   LEU 107           HA       LEU 107 -20.694  -7.518  -7.648
  808    HG   LEU 107           HG       LEU 107 -19.650  -6.262 -10.989
  809    HB2  LEU 107           HB2      LEU 107 -20.021  -8.578 -10.378
  810    HB3  LEU 107           HB1      LEU 107 -21.470  -7.633 -10.102
  811   HD11  LEU 107          HD11      LEU 107 -19.819  -4.453  -9.422
  812   HD12  LEU 107          HD12      LEU 107 -20.261  -5.563  -8.125
  813   HD13  LEU 107          HD13      LEU 107 -21.360  -5.309  -9.481
  814   HD21  LEU 107          HD23      LEU 107 -17.669  -5.794  -9.664
  815   HD22  LEU 107          HD21      LEU 107 -17.770  -7.515 -10.033
  816   HD23  LEU 107          HD22      LEU 107 -18.205  -6.931  -8.427
  817    H    GLU 108           HN       GLU 108 -23.003  -7.852  -8.656
  818    HA   GLU 108           HA       GLU 108 -23.918 -10.569  -8.786
  819    HB2  GLU 108           HB2      GLU 108 -23.640 -10.268  -6.345
  820    HB3  GLU 108           HB1      GLU 108 -24.736  -8.894  -6.405
  821    HG2  GLU 108           HG2      GLU 108 -26.536 -10.361  -7.160
  822    HG3  GLU 108           HG1      GLU 108 -25.436 -11.738  -7.101
  Start of MODEL   19
    1    H1   GLY   1           HT1      GLY   1 -11.024  -3.668  18.811
    2    H2   GLY   1           HT2      GLY   1 -10.988  -5.294  18.345
    3    H3   GLY   1           HT3      GLY   1 -11.721  -4.849  19.804
    4    HA2  GLY   1           HA1      GLY   1 -13.416  -5.310  18.181
    5    HA3  GLY   1           HA2      GLY   1 -13.414  -3.602  18.596
    6    H    SER   2           HN       SER   2 -11.437  -2.539  17.125
    7    HA   SER   2           HA       SER   2 -12.554  -2.609  14.477
    8    HG   SER   2           HG       SER   2  -9.807  -1.808  16.317
    9    HB2  SER   2           HB2      SER   2 -10.854  -0.848  13.993
   10    HB3  SER   2           HB1      SER   2 -11.861  -0.474  15.391
   11    H    HIS   3           HN       HIS   3 -10.676  -2.361  12.675
   12    HA   HIS   3           HA       HIS   3  -9.276  -3.521  11.314
   13    HD1  HIS   3           HD1      HIS   3  -5.840  -2.937  11.370
   14    HD2  HIS   3           HD2      HIS   3  -8.259  -1.283  14.314
   15    HE1  HIS   3           HE1      HIS   3  -5.057  -0.562  11.624
   16    HE2  HIS   3           HE2      HIS   3  -6.586   0.442  13.358
   17    HB2  HIS   3           HB2      HIS   3  -8.030  -4.185  13.984
   18    HB3  HIS   3           HB1      HIS   3  -7.308  -4.635  12.444
   19    H    GLY   4           HN       GLY   4 -11.662  -4.782  11.727
   20    HA2  GLY   4           HA2      GLY   4 -10.848  -7.594  11.518
   21    HA3  GLY   4           HA1      GLY   4 -12.136  -7.177  12.638
   22    H    TYR   5           HN       TYR   5 -11.239  -6.581   9.238
   23    HA   TYR   5           HA       TYR   5 -14.055  -7.073   8.524
   24    HD1  TYR   5           HD1      TYR   5 -15.681  -4.714   7.664
   25    HD2  TYR   5           HD2      TYR   5 -11.817  -3.769   9.173
   26    HE1  TYR   5           HE1      TYR   5 -16.659  -2.916   9.027
   27    HE2  TYR   5           HE2      TYR   5 -12.784  -1.969  10.542
   28    HH   TYR   5           HH       TYR   5 -16.112  -1.655  11.077
   29    HB2  TYR   5           HB2      TYR   5 -12.075  -5.191   7.227
   30    HB3  TYR   5           HB1      TYR   5 -13.669  -5.558   6.577
   31    H    SER   6           HN       SER   6 -12.931  -9.325   8.599
   32    HA   SER   6           HA       SER   6 -11.427  -9.953   6.195
   33    HG   SER   6           HG       SER   6  -9.947 -11.683   8.725
   34    HB2  SER   6           HB2      SER   6 -12.385 -11.733   8.450
   35    HB3  SER   6           HB1      SER   6 -11.317 -12.235   7.139
   36    H    ASP   7           HN       ASP   7 -12.704  -9.874   4.422
   37    HA   ASP   7           HA       ASP   7 -14.348 -10.386   2.934
   38    HB2  ASP   7           HB2      ASP   7 -14.501 -12.950   4.537
   39    HB3  ASP   7           HB1      ASP   7 -15.090 -12.716   2.894
   40    H    ALA   8           HN       ALA   8 -15.602  -8.656   4.008
   41    HA   ALA   8           HA       ALA   8 -17.908  -9.676   5.520
   42    HB1  ALA   8           HB3      ALA   8 -18.256  -7.377   6.255
   43    HB2  ALA   8           HB1      ALA   8 -16.901  -6.843   5.260
   44    HB3  ALA   8           HB2      ALA   8 -16.620  -7.917   6.631
   45    H    SER   9           HN       SER   9 -16.975  -7.885   2.657
   46    HA   SER   9           HA       SER   9 -19.229  -8.530   1.213
   47    HG   SER   9           HG       SER   9 -19.665  -5.028   3.107
   48    HB2  SER   9           HB2      SER   9 -20.404  -6.378   1.080
   49    HB3  SER   9           HB1      SER   9 -20.397  -6.980   2.737
   50    H    GLY  10           HN       GLY  10 -16.366  -8.327   0.997
   51    HA2  GLY  10           HA2      GLY  10 -15.386  -8.072  -1.240
   52    HA3  GLY  10           HA1      GLY  10 -16.202  -6.518  -1.333
   53    H    PHE  11           HN       PHE  11 -14.830  -7.356   1.696
   54    HA   PHE  11           HA       PHE  11 -12.403  -5.804   1.124
   55    HD1  PHE  11           HD2      PHE  11 -12.437  -2.893   1.509
   56    HD2  PHE  11           HD1      PHE  11 -16.188  -4.712   2.363
   57    HE1  PHE  11           HE2      PHE  11 -13.584  -1.095   0.282
   58    HE2  PHE  11           HE1      PHE  11 -17.342  -2.918   1.138
   59    HZ   PHE  11           HZ       PHE  11 -16.045  -1.110   0.093
   60    HB2  PHE  11           HB2      PHE  11 -14.209  -5.395   3.518
   61    HB3  PHE  11           HB1      PHE  11 -12.667  -4.590   3.253
   62    H    SER  12           HN       SER  12 -10.594  -6.658   1.956
   63    HA   SER  12           HA       SER  12 -10.700  -8.393   4.276
   64    HG   SER  12           HG       SER  12  -8.964 -10.087   4.029
   65    HB2  SER  12           HB2      SER  12 -11.165  -9.967   2.467
   66    HB3  SER  12           HB1      SER  12  -9.739  -9.411   1.592
   67    H    LEU  13           HN       LEU  13  -8.841  -8.410   5.420
   68    HA   LEU  13           HA       LEU  13  -6.826  -6.488   4.721
   69    HG   LEU  13           HG       LEU  13  -8.672  -6.433   6.989
   70    HB2  LEU  13           HB2      LEU  13  -7.082  -8.407   7.036
   71    HB3  LEU  13           HB1      LEU  13  -5.774  -7.251   6.871
   72   HD11  LEU  13          HD11      LEU  13  -6.655  -6.636   9.222
   73   HD12  LEU  13          HD12      LEU  13  -8.142  -7.571   9.055
   74   HD13  LEU  13          HD13      LEU  13  -8.220  -5.831   9.337
   75   HD21  LEU  13          HD23      LEU  13  -6.081  -4.930   7.336
   76   HD22  LEU  13          HD21      LEU  13  -7.691  -4.251   7.584
   77   HD23  LEU  13          HD22      LEU  13  -7.201  -4.797   5.979
   78    H    TYR  14           HN       TYR  14  -5.125  -6.879   3.488
   79    HA   TYR  14           HA       TYR  14  -4.056  -9.623   3.389
   80    HD1  TYR  14           HD2      TYR  14  -4.048 -11.244   1.057
   81    HD2  TYR  14           HD1      TYR  14  -6.730  -7.939   0.888
   82    HE1  TYR  14           HE2      TYR  14  -5.829 -12.736   0.257
   83    HE2  TYR  14           HE1      TYR  14  -8.515  -9.427   0.091
   84    HH   TYR  14           HH       TYR  14  -8.323 -12.782   0.242
   85    HB2  TYR  14           HB2      TYR  14  -4.387  -7.572   1.211
   86    HB3  TYR  14           HB1      TYR  14  -3.231  -8.890   1.059
   87    H    SER  15           HN       SER  15  -1.719  -9.730   2.797
   88    HA   SER  15           HA       SER  15  -0.148  -7.369   3.403
   89    HG   SER  15           HG       SER  15  -0.886 -10.406   5.445
   90    HB2  SER  15           HB2      SER  15   1.107  -8.452   5.227
   91    HB3  SER  15           HB1      SER  15  -0.599  -8.277   5.637
   92    H    VAL  16           HN       VAL  16   1.981  -7.492   2.700
   93    HA   VAL  16           HA       VAL  16   2.766  -9.966   1.314
   94    HB   VAL  16           HB       VAL  16   3.279  -7.219   0.178
   95   HG11  VAL  16          HG11      VAL  16   3.453  -9.965  -1.056
   96   HG12  VAL  16          HG12      VAL  16   4.822  -9.000  -0.503
   97   HG13  VAL  16          HG13      VAL  16   3.834  -8.437  -1.851
   98   HG21  VAL  16          HG23      VAL  16   0.869  -7.604   0.216
   99   HG22  VAL  16          HG21      VAL  16   1.097  -9.161  -0.581
  100   HG23  VAL  16          HG22      VAL  16   1.492  -7.668  -1.433
  101    H    GLU  17           HN       GLU  17   4.856 -10.557   1.566
  102    HA   GLU  17           HA       GLU  17   6.455  -8.987   3.417
  103    HB2  GLU  17           HB2      GLU  17   6.820 -11.754   2.268
  104    HB3  GLU  17           HB1      GLU  17   7.958 -10.997   3.375
  105    HG2  GLU  17           HG2      GLU  17   6.208 -10.844   5.071
  106    HG3  GLU  17           HG1      GLU  17   5.070 -11.609   3.962
  107    H    LEU  18           HN       LEU  18   7.750  -7.481   2.648
  108    HA   LEU  18           HA       LEU  18   9.179  -7.991   0.121
  109    HG   LEU  18           HG       LEU  18   7.463  -5.035  -1.173
  110    HB2  LEU  18           HB2      LEU  18   7.798  -5.595   1.164
  111    HB3  LEU  18           HB1      LEU  18   9.338  -5.304   0.380
  112   HD11  LEU  18          HD11      LEU  18   9.162  -7.450  -1.784
  113   HD12  LEU  18          HD12      LEU  18   9.618  -5.765  -2.046
  114   HD13  LEU  18          HD13      LEU  18   8.288  -6.472  -2.964
  115   HD21  LEU  18          HD23      LEU  18   5.923  -6.627  -0.125
  116   HD22  LEU  18          HD21      LEU  18   6.937  -7.963  -0.673
  117   HD23  LEU  18          HD22      LEU  18   6.114  -6.938  -1.850
  118    H    PHE  19           HN       PHE  19  11.285  -6.778  -0.033
  119    HA   PHE  19           HA       PHE  19  12.590  -6.082   2.434
  120    HD1  PHE  19           HD2      PHE  19  11.431  -9.660   0.976
  121    HD2  PHE  19           HD1      PHE  19  15.427  -8.447   0.157
  122    HE1  PHE  19           HE2      PHE  19  11.513 -11.222  -0.923
  123    HE2  PHE  19           HE1      PHE  19  15.514 -10.005  -1.745
  124    HZ   PHE  19           HZ       PHE  19  13.556 -11.413  -2.272
  125    HB2  PHE  19           HB2      PHE  19  14.385  -7.817   2.185
  126    HB3  PHE  19           HB1      PHE  19  12.815  -8.461   2.651
  127    H    ARG  20           HN       ARG  20  14.061  -4.553   2.043
  128    HA   ARG  20           HA       ARG  20  14.909  -4.171  -0.742
  129    HE   ARG  20           HE       ARG  20  13.553  -0.221  -0.897
  130    HB2  ARG  20           HB2      ARG  20  13.799  -2.253   0.305
  131    HB3  ARG  20           HB1      ARG  20  15.000  -2.249   1.591
  132    HG2  ARG  20           HG2      ARG  20  16.748  -1.755  -0.056
  133    HG3  ARG  20           HG1      ARG  20  15.526  -1.725  -1.328
  134    HD2  ARG  20           HD2      ARG  20  15.293   0.037   1.083
  135    HD3  ARG  20           HD1      ARG  20  16.298   0.505  -0.286
  136   HH11  ARG  20          HH11      ARG  20  15.866   2.307  -0.263
  137   HH12  ARG  20          HH12      ARG  20  14.906   3.549  -0.994
  138   HH21  ARG  20          HH21      ARG  20  12.280   1.415  -1.866
  139   HH22  ARG  20          HH22      ARG  20  12.869   3.042  -1.903
  140    H    GLU  21           HN       GLU  21  16.508  -5.823  -0.663
  141    HA   GLU  21           HA       GLU  21  18.807  -5.329   1.082
  142    HB2  GLU  21           HB2      GLU  21  18.158  -7.658  -0.734
  143    HB3  GLU  21           HB1      GLU  21  19.599  -7.539   0.267
  144    HG2  GLU  21           HG2      GLU  21  16.782  -7.536   1.321
  145    HG3  GLU  21           HG1      GLU  21  17.825  -8.955   1.235
  146    H    LYS  22           HN       LYS  22  17.738  -4.857  -2.118
  147    HA   LYS  22           HA       LYS  22  20.448  -4.631  -3.188
  148    HB2  LYS  22           HB2      LYS  22  17.819  -4.216  -4.620
  149    HB3  LYS  22           HB1      LYS  22  19.404  -4.407  -5.355
  150    HG2  LYS  22           HG2      LYS  22  18.009  -6.530  -3.741
  151    HG3  LYS  22           HG1      LYS  22  17.986  -6.426  -5.502
  152    HD2  LYS  22           HD2      LYS  22  20.426  -6.640  -5.543
  153    HD3  LYS  22           HD1      LYS  22  20.444  -6.747  -3.780
  154    HE2  LYS  22           HE2      LYS  22  20.607  -8.959  -4.815
  155    HE3  LYS  22           HE1      LYS  22  19.125  -8.790  -3.873
  156    HZ1  LYS  22           HZ3      LYS  22  18.711  -9.866  -5.994
  157    HZ2  LYS  22           HZ1      LYS  22  19.335  -8.530  -6.826
  158    HZ3  LYS  22           HZ2      LYS  22  17.914  -8.377  -5.922
  159    H    ASP  23           HN       ASP  23  21.313  -2.711  -3.964
  160    HA   ASP  23           HA       ASP  23  20.295  -0.318  -2.716
  161    HB2  ASP  23           HB2      ASP  23  22.734  -0.843  -2.829
  162    HB3  ASP  23           HB1      ASP  23  22.663  -0.624  -4.575
  163    H    THR  24           HN       THR  24  18.254  -0.488  -4.020
  164    HA   THR  24           HA       THR  24  18.581   0.674  -6.704
  165    HB   THR  24           HB       THR  24  16.310  -0.069  -7.187
  166    HG1  THR  24           HG1      THR  24  15.779   0.034  -4.778
  167   HG21  THR  24          HG23      THR  24  16.682  -2.496  -7.135
  168   HG22  THR  24          HG21      THR  24  18.001  -2.266  -5.988
  169   HG23  THR  24          HG22      THR  24  18.137  -1.630  -7.628
  170    H    SER  25           HN       SER  25  17.787   1.445  -3.552
  171    HA   SER  25           HA       SER  25  16.782   3.198  -2.516
  172    HG   SER  25           HG       SER  25  16.888   5.586  -5.542
  173    HB2  SER  25           HB2      SER  25  17.177   5.376  -3.483
  174    HB3  SER  25           HB1      SER  25  18.573   4.355  -3.825
  175    H    SER  26           HN       SER  26  15.134   1.454  -4.342
  176    HA   SER  26           HA       SER  26  12.714   3.012  -4.150
  177    HG   SER  26           HG       SER  26  12.901   4.662  -6.472
  178    HB2  SER  26           HB2      SER  26  13.673   2.043  -6.854
  179    HB3  SER  26           HB1      SER  26  12.077   2.716  -6.522
  180    H    LEU  27           HN       LEU  27  11.036   1.734  -3.658
  181    HA   LEU  27           HA       LEU  27  11.466  -1.151  -3.682
  182    HG   LEU  27           HG       LEU  27  11.693   0.216  -1.196
  183    HB2  LEU  27           HB2      LEU  27   9.478   0.643  -2.315
  184    HB3  LEU  27           HB1      LEU  27   9.246  -1.093  -2.379
  185   HD11  LEU  27          HD11      LEU  27  10.707  -0.277   0.984
  186   HD12  LEU  27          HD12      LEU  27   9.231  -0.829   0.194
  187   HD13  LEU  27          HD13      LEU  27   9.716   0.862   0.073
  188   HD21  LEU  27          HD23      LEU  27  12.026  -2.076  -1.950
  189   HD22  LEU  27          HD21      LEU  27  10.614  -2.595  -1.030
  190   HD23  LEU  27          HD22      LEU  27  12.040  -1.987  -0.189
  191    H    GLY  28           HN       GLY  28   9.624   1.301  -5.277
  192    HA2  GLY  28           HA2      GLY  28   8.677   0.927  -7.426
  193    HA3  GLY  28           HA1      GLY  28   8.459  -0.765  -7.007
  194    H    ILE  29           HN       ILE  29   7.555   1.886  -4.903
  195    HA   ILE  29           HA       ILE  29   4.736   1.104  -5.249
  196    HB   ILE  29           HB       ILE  29   5.959   2.535  -2.889
  197   HG12  ILE  29          HG12      ILE  29   5.202  -0.385  -3.128
  198   HG13  ILE  29          HG11      ILE  29   6.852   0.223  -3.198
  199   HG21  ILE  29          HG21      ILE  29   3.868   1.954  -1.765
  200   HG22  ILE  29          HG22      ILE  29   3.279   1.197  -3.245
  201   HG23  ILE  29          HG23      ILE  29   3.571   2.935  -3.199
  202   HD11  ILE  29          HD13      ILE  29   6.609   1.091  -0.918
  203   HD12  ILE  29          HD11      ILE  29   6.365  -0.654  -1.005
  204   HD13  ILE  29          HD12      ILE  29   4.977   0.424  -0.854
  205    H    SER  30           HN       SER  30   3.740   2.473  -6.602
  206    HA   SER  30           HA       SER  30   4.410   5.331  -6.466
  207    HG   SER  30           HG       SER  30   5.600   4.429  -8.213
  208    HB2  SER  30           HB2      SER  30   2.927   3.806  -8.621
  209    HB3  SER  30           HB1      SER  30   3.354   5.516  -8.677
  210    H    ILE  31           HN       ILE  31   3.184   5.900  -4.678
  211    HA   ILE  31           HA       ILE  31   0.335   5.336  -4.649
  212    HB   ILE  31           HB       ILE  31   0.365   6.605  -2.496
  213   HG12  ILE  31          HG12      ILE  31   3.362   6.614  -2.928
  214   HG13  ILE  31          HG11      ILE  31   2.328   8.033  -3.048
  215   HG21  ILE  31          HG21      ILE  31   2.328   4.328  -2.733
  216   HG22  ILE  31          HG22      ILE  31   0.580   4.181  -2.545
  217   HG23  ILE  31          HG23      ILE  31   1.554   4.866  -1.243
  218   HD11  ILE  31          HD13      ILE  31   2.779   6.378  -0.575
  219   HD12  ILE  31          HD11      ILE  31   1.736   7.796  -0.691
  220   HD13  ILE  31          HD12      ILE  31   3.477   7.961  -0.915
  221    H    SER  32           HN       SER  32  -1.180   7.159  -4.137
  222    HA   SER  32           HA       SER  32  -0.409   9.720  -5.317
  223    HG   SER  32           HG       SER  32  -1.653   7.712  -8.007
  224    HB2  SER  32           HB2      SER  32  -2.790   8.097  -6.249
  225    HB3  SER  32           HB1      SER  32  -2.427   9.750  -6.746
  226    H    GLY  33           HN       GLY  33  -1.368  11.445  -4.372
  227    HA2  GLY  33           HA2      GLY  33  -2.689  11.112  -1.897
  228    HA3  GLY  33           HA1      GLY  33  -2.511  12.627  -2.769
  229    H    MET  34           HN       MET  34  -4.789  11.948  -1.285
  230    HA   MET  34           HA       MET  34  -6.801  11.514  -3.396
  231    HB2  MET  34           HB2      MET  34  -6.819   9.789  -1.637
  232    HB3  MET  34           HB1      MET  34  -7.054  11.035  -0.421
  233    HG2  MET  34           HG2      MET  34  -9.210  11.598  -1.380
  234    HG3  MET  34           HG1      MET  34  -8.973  10.399  -2.650
  235    HE1  MET  34           HE3      MET  34 -11.566  10.524  -0.764
  236    HE2  MET  34           HE1      MET  34 -11.796   8.810  -0.420
  237    HE3  MET  34           HE2      MET  34 -11.349   9.331  -2.045
  238    H    ARG  35           HN       ARG  35  -7.703  13.353  -4.030
  239    HA   ARG  35           HA       ARG  35  -8.102  15.493  -2.043
  240    HE   ARG  35           HE       ARG  35  -3.610  16.052  -3.738
  241    HB2  ARG  35           HB2      ARG  35  -7.845  15.688  -5.051
  242    HB3  ARG  35           HB1      ARG  35  -8.174  17.042  -3.981
  243    HG2  ARG  35           HG2      ARG  35  -5.899  17.204  -4.397
  244    HG3  ARG  35           HG1      ARG  35  -5.974  16.412  -2.822
  245    HD2  ARG  35           HD2      ARG  35  -5.570  14.265  -3.825
  246    HD3  ARG  35           HD1      ARG  35  -5.682  14.953  -5.445
  247   HH11  ARG  35          HH11      ARG  35  -4.453  13.755  -6.220
  248   HH12  ARG  35          HH12      ARG  35  -2.825  13.566  -6.778
  249   HH21  ARG  35          HH21      ARG  35  -1.463  15.807  -4.467
  250   HH22  ARG  35          HH22      ARG  35  -1.126  14.732  -5.782
  251    H    ASP  36           HN       ASP  36 -10.121  15.086  -1.267
  252    HA   ASP  36           HA       ASP  36 -12.327  15.454  -3.133
  253    HB2  ASP  36           HB2      ASP  36 -12.055  13.018  -3.035
  254    HB3  ASP  36           HB1      ASP  36 -12.160  13.068  -1.278
  255    H    GLN  37           HN       GLN  37 -14.280  16.129  -2.136
  256    HA   GLN  37           HA       GLN  37 -13.846  17.345   0.495
  257    HB2  GLN  37           HB2      GLN  37 -15.963  17.899  -1.592
  258    HB3  GLN  37           HB1      GLN  37 -15.789  18.761  -0.070
  259    HG2  GLN  37           HG2      GLN  37 -13.569  19.531  -0.773
  260    HG3  GLN  37           HG1      GLN  37 -13.782  18.699  -2.313
  261   HE21  GLN  37          HE21      GLN  37 -13.371  21.535  -1.749
  262   HE22  GLN  37          HE22      GLN  37 -14.717  22.361  -2.449
  263    H    SER  38           HN       SER  38 -14.846  16.615   2.251
  264    HA   SER  38           HA       SER  38 -17.377  15.184   2.011
  265    HG   SER  38           HG       SER  38 -15.333  13.816   0.999
  266    HB2  SER  38           HB2      SER  38 -14.952  14.032   3.412
  267    HB3  SER  38           HB1      SER  38 -16.578  13.354   3.479
  268    H    THR  39           HN       THR  39 -18.763  15.788   3.548
  269    HA   THR  39           HA       THR  39 -17.781  17.500   5.700
  270    HB   THR  39           HB       THR  39 -20.153  18.069   6.069
  271    HG1  THR  39           HG1      THR  39 -20.964  15.999   5.265
  272   HG21  THR  39          HG23      THR  39 -18.840  19.391   4.489
  273   HG22  THR  39          HG21      THR  39 -20.517  19.269   3.958
  274   HG23  THR  39          HG22      THR  39 -19.273  18.284   3.188
  275    H    THR  40           HN       THR  40 -19.053  17.318   7.801
  276    HA   THR  40           HA       THR  40 -19.159  16.165   9.762
  277    HB   THR  40           HB       THR  40 -21.447  15.915   8.857
  278    HG1  THR  40           HG1      THR  40 -21.018  15.076  10.917
  279   HG21  THR  40          HG23      THR  40 -20.993  14.578   6.878
  280   HG22  THR  40          HG21      THR  40 -22.136  13.737   7.924
  281   HG23  THR  40          HG22      THR  40 -20.445  13.235   7.882
  282    H    GLY  41           HN       GLY  41 -16.936  15.407   8.131
  283    HA2  GLY  41           HA2      GLY  41 -15.762  13.411   9.539
  284    HA3  GLY  41           HA1      GLY  41 -16.669  12.535   8.314
  285    H    GLU  42           HN       GLU  42 -13.981  12.236   8.393
  286    HA   GLU  42           HA       GLU  42 -12.842  14.024   6.381
  287    HB2  GLU  42           HB2      GLU  42 -11.538  11.773   7.924
  288    HB3  GLU  42           HB1      GLU  42 -10.715  12.921   6.880
  289    HG2  GLU  42           HG2      GLU  42 -12.166  13.575   9.434
  290    HG3  GLU  42           HG1      GLU  42 -10.417  13.491   9.218
  291    H    ALA  43           HN       ALA  43 -11.282  12.739   4.817
  292    HA   ALA  43           HA       ALA  43 -12.261  10.195   3.919
  293    HB1  ALA  43           HB3      ALA  43 -14.004  11.666   3.024
  294    HB2  ALA  43           HB1      ALA  43 -13.062  10.915   1.737
  295    HB3  ALA  43           HB2      ALA  43 -12.775  12.600   2.172
  296    H    THR  44           HN       THR  44  -9.743  11.115   4.731
  297    HA   THR  44           HA       THR  44  -8.211  11.295   2.232
  298    HB   THR  44           HB       THR  44  -6.309  11.984   3.596
  299    HG1  THR  44           HG1      THR  44  -7.203  10.729   5.504
  300   HG21  THR  44          HG23      THR  44  -8.824  13.507   4.291
  301   HG22  THR  44          HG21      THR  44  -7.850  13.722   2.837
  302   HG23  THR  44          HG22      THR  44  -7.178  14.129   4.415
  303    H    GLY  45           HN       GLY  45  -6.641   9.804   1.704
  304    HA2  GLY  45           HA2      GLY  45  -5.777   7.743   3.475
  305    HA3  GLY  45           HA1      GLY  45  -7.005   7.148   2.369
  306    H    ILE  46           HN       ILE  46  -4.179   6.406   2.604
  307    HA   ILE  46           HA       ILE  46  -3.108   7.368   0.043
  308    HB   ILE  46           HB       ILE  46  -1.722   5.767   2.198
  309   HG12  ILE  46          HG12      ILE  46  -2.306   8.030   2.962
  310   HG13  ILE  46          HG11      ILE  46  -0.567   7.856   2.757
  311   HG21  ILE  46          HG21      ILE  46   0.337   6.362   0.993
  312   HG22  ILE  46          HG22      ILE  46  -0.636   7.117  -0.270
  313   HG23  ILE  46          HG23      ILE  46  -0.753   5.380   0.013
  314   HD11  ILE  46          HD13      ILE  46  -0.695   9.037   0.630
  315   HD12  ILE  46          HD11      ILE  46  -1.358  10.007   1.944
  316   HD13  ILE  46          HD12      ILE  46  -2.442   9.193   0.817
  317    H    TYR  47           HN       TYR  47  -2.963   6.078  -1.695
  318    HA   TYR  47           HA       TYR  47  -3.172   3.184  -1.379
  319    HD1  TYR  47           HD1      TYR  47  -5.777   6.381  -1.844
  320    HD2  TYR  47           HD2      TYR  47  -4.750   4.029  -5.238
  321    HE1  TYR  47           HE1      TYR  47  -6.431   8.236  -3.321
  322    HE2  TYR  47           HE2      TYR  47  -5.400   5.879  -6.724
  323    HH   TYR  47           HH       TYR  47  -5.934   9.024  -5.615
  324    HB2  TYR  47           HB2      TYR  47  -4.943   3.013  -3.072
  325    HB3  TYR  47           HB1      TYR  47  -5.486   3.938  -1.675
  326    H    VAL  48           HN       VAL  48  -2.450   1.983  -3.194
  327    HA   VAL  48           HA       VAL  48  -0.460   3.391  -4.766
  328    HB   VAL  48           HB       VAL  48  -1.122   0.448  -4.574
  329   HG11  VAL  48          HG11      VAL  48   1.117   1.828  -6.052
  330   HG12  VAL  48          HG12      VAL  48  -0.214   0.916  -6.768
  331   HG13  VAL  48          HG13      VAL  48   0.995   0.088  -5.787
  332   HG21  VAL  48          HG23      VAL  48   0.913   0.271  -3.293
  333   HG22  VAL  48          HG21      VAL  48  -0.134   1.484  -2.559
  334   HG23  VAL  48          HG22      VAL  48   1.249   1.987  -3.527
  335    H    LYS  49           HN       LYS  49  -0.780   4.095  -6.761
  336    HA   LYS  49           HA       LYS  49  -3.154   3.192  -8.219
  337    HB2  LYS  49           HB2      LYS  49  -2.886   5.615  -7.853
  338    HB3  LYS  49           HB1      LYS  49  -1.356   5.571  -8.717
  339    HG2  LYS  49           HG2      LYS  49  -2.503   4.920 -10.757
  340    HG3  LYS  49           HG1      LYS  49  -4.044   4.894  -9.897
  341    HD2  LYS  49           HD2      LYS  49  -2.292   7.336 -10.148
  342    HD3  LYS  49           HD1      LYS  49  -3.630   6.968 -11.237
  343    HE2  LYS  49           HE2      LYS  49  -3.835   7.369  -8.253
  344    HE3  LYS  49           HE1      LYS  49  -4.300   8.541  -9.484
  345    HZ1  LYS  49           HZ3      LYS  49  -5.519   5.856  -9.122
  346    HZ2  LYS  49           HZ1      LYS  49  -5.975   7.002 -10.280
  347    HZ3  LYS  49           HZ2      LYS  49  -6.210   7.321  -8.635
  348    H    SER  50           HN       SER  50   0.317   3.173  -8.324
  349    HA   SER  50           HA       SER  50   0.238   1.355 -10.585
  350    HG   SER  50           HG       SER  50   0.222   3.353 -12.813
  351    HB2  SER  50           HB2      SER  50   1.797   3.947 -10.701
  352    HB3  SER  50           HB1      SER  50   1.939   2.629 -11.864
  353    H    LEU  51           HN       LEU  51   2.532   0.576 -11.099
  354    HA   LEU  51           HA       LEU  51   4.208   0.540  -8.686
  355    HG   LEU  51           HG       LEU  51   1.694  -1.192  -8.581
  356    HB2  LEU  51           HB2      LEU  51   3.364  -1.867 -10.300
  357    HB3  LEU  51           HB1      LEU  51   4.594  -1.890  -9.053
  358   HD11  LEU  51          HD11      LEU  51   1.591  -3.395  -7.475
  359   HD12  LEU  51          HD12      LEU  51   3.211  -3.747  -8.078
  360   HD13  LEU  51          HD13      LEU  51   1.879  -3.511  -9.210
  361   HD21  LEU  51          HD23      LEU  51   2.268  -1.406  -6.224
  362   HD22  LEU  51          HD21      LEU  51   3.243  -0.153  -6.992
  363   HD23  LEU  51          HD22      LEU  51   3.948  -1.733  -6.649
  364    H    ILE  52           HN       ILE  52   6.419   0.274  -9.040
  365    HA   ILE  52           HA       ILE  52   7.289   0.959 -11.731
  366    HB   ILE  52           HB       ILE  52   8.928   0.725  -9.205
  367   HG12  ILE  52          HG12      ILE  52   7.196   2.463  -9.017
  368   HG13  ILE  52          HG11      ILE  52   8.805   3.171  -9.105
  369   HG21  ILE  52          HG21      ILE  52  10.579   2.065 -10.445
  370   HG22  ILE  52          HG22      ILE  52   9.565   1.954 -11.883
  371   HG23  ILE  52          HG23      ILE  52  10.280   0.496 -11.195
  372   HD11  ILE  52          HD13      ILE  52   8.443   3.703 -11.457
  373   HD12  ILE  52          HD11      ILE  52   7.206   4.428 -10.430
  374   HD13  ILE  52          HD12      ILE  52   6.834   2.984 -11.373
  375    HA   PRO  53           HA       PRO  53   8.072  -3.464 -12.380
  376    HB2  PRO  53           HB2      PRO  53   9.050  -3.122 -14.931
  377    HB3  PRO  53           HB1      PRO  53   7.338  -3.297 -14.533
  378    HG2  PRO  53           HG2      PRO  53   8.918  -0.815 -15.061
  379    HG3  PRO  53           HG1      PRO  53   7.276  -1.234 -15.589
  380    HD2  PRO  53           HD2      PRO  53   7.710   0.436 -13.532
  381    HD3  PRO  53           HD1      PRO  53   6.346  -0.700 -13.535
  382    H    GLY  54           HN       GLY  54   9.866  -4.642 -12.024
  383    HA2  GLY  54           HA2      GLY  54  12.173  -5.155 -12.278
  384    HA3  GLY  54           HA1      GLY  54  12.488  -3.455 -12.589
  385    H    SER  55           HN       SER  55  10.525  -3.151 -10.120
  386    HA   SER  55           HA       SER  55  12.705  -2.992  -8.202
  387    HG   SER  55           HG       SER  55  12.230  -0.809  -8.747
  388    HB2  SER  55           HB2      SER  55   9.828  -2.069  -7.993
  389    HB3  SER  55           HB1      SER  55  11.091  -1.753  -6.803
  390    H    ALA  56           HN       ALA  56  11.683  -3.386  -5.800
  391    HA   ALA  56           HA       ALA  56  11.531  -6.205  -5.578
  392    HB1  ALA  56           HB3      ALA  56  12.536  -4.777  -3.856
  393    HB2  ALA  56           HB1      ALA  56  11.280  -5.823  -3.193
  394    HB3  ALA  56           HB2      ALA  56  10.943  -4.117  -3.486
  395    H    ALA  57           HN       ALA  57   9.134  -3.716  -4.696
  396    HA   ALA  57           HA       ALA  57   7.016  -5.381  -4.085
  397    HB1  ALA  57           HB3      ALA  57   6.852  -2.659  -5.371
  398    HB2  ALA  57           HB1      ALA  57   7.050  -2.970  -3.646
  399    HB3  ALA  57           HB2      ALA  57   5.571  -3.468  -4.469
  400    H    ALA  58           HN       ALA  58   8.178  -4.358  -7.231
  401    HA   ALA  58           HA       ALA  58   5.867  -5.252  -8.672
  402    HB1  ALA  58           HB3      ALA  58   7.203  -4.832 -10.672
  403    HB2  ALA  58           HB1      ALA  58   8.639  -4.613  -9.673
  404    HB3  ALA  58           HB2      ALA  58   7.295  -3.478  -9.546
  405    H    LEU  59           HN       LEU  59   9.168  -6.533  -8.251
  406    HA   LEU  59           HA       LEU  59   8.784  -8.867  -9.773
  407    HG   LEU  59           HG       LEU  59  11.056  -6.974  -9.657
  408    HB2  LEU  59           HB2      LEU  59  10.704  -8.253  -7.531
  409    HB3  LEU  59           HB1      LEU  59  10.759  -9.733  -8.470
  410   HD11  LEU  59          HD11      LEU  59  13.174  -8.997  -8.942
  411   HD12  LEU  59          HD12      LEU  59  12.899  -7.453  -8.135
  412   HD13  LEU  59          HD13      LEU  59  13.438  -7.487  -9.814
  413   HD21  LEU  59          HD23      LEU  59  11.560  -9.727 -10.785
  414   HD22  LEU  59          HD21      LEU  59  11.899  -8.201 -11.602
  415   HD23  LEU  59          HD22      LEU  59  10.235  -8.649 -11.225
  416    H    ASP  60           HN       ASP  60   7.715  -8.006  -6.634
  417    HA   ASP  60           HA       ASP  60   7.589 -10.497  -5.373
  418    HB2  ASP  60           HB2      ASP  60   7.159  -8.281  -4.286
  419    HB3  ASP  60           HB1      ASP  60   5.587  -8.248  -5.079
  420    H    GLY  61           HN       GLY  61   5.030  -8.811  -7.207
  421    HA2  GLY  61           HA2      GLY  61   3.665  -9.917  -8.820
  422    HA3  GLY  61           HA1      GLY  61   3.996 -11.441  -8.011
  423    H    ARG  62           HN       ARG  62   3.391 -10.774  -5.384
  424    HA   ARG  62           HA       ARG  62   0.608 -11.121  -5.348
  425    HE   ARG  62           HE       ARG  62   0.634 -11.917  -1.368
  426    HB2  ARG  62           HB2      ARG  62   2.419 -10.207  -3.107
  427    HB3  ARG  62           HB1      ARG  62   0.783 -10.822  -2.913
  428    HG2  ARG  62           HG2      ARG  62   1.503 -12.978  -3.851
  429    HG3  ARG  62           HG1      ARG  62   3.149 -12.353  -3.975
  430    HD2  ARG  62           HD2      ARG  62   2.851 -13.719  -1.967
  431    HD3  ARG  62           HD1      ARG  62   3.233 -12.046  -1.564
  432   HH11  ARG  62          HH11      ARG  62   2.700 -14.546  -0.386
  433   HH12  ARG  62          HH12      ARG  62   1.658 -15.053   0.901
  434   HH21  ARG  62          HH21      ARG  62  -0.743 -12.578   0.325
  435   HH22  ARG  62          HH22      ARG  62  -0.298 -13.935   1.305
  436    H    ILE  63           HN       ILE  63   2.578  -8.244  -5.248
  437    HA   ILE  63           HA       ILE  63   0.367  -6.553  -4.440
  438    HB   ILE  63           HB       ILE  63   3.102  -5.725  -5.422
  439   HG12  ILE  63          HG12      ILE  63   2.109  -6.038  -2.579
  440   HG13  ILE  63          HG11      ILE  63   3.172  -7.180  -3.396
  441   HG21  ILE  63          HG21      ILE  63   2.598  -3.608  -4.302
  442   HG22  ILE  63          HG22      ILE  63   0.997  -4.214  -3.878
  443   HG23  ILE  63          HG23      ILE  63   1.425  -3.962  -5.571
  444   HD11  ILE  63          HD13      ILE  63   4.448  -5.745  -1.943
  445   HD12  ILE  63          HD11      ILE  63   3.794  -4.310  -2.735
  446   HD13  ILE  63          HD12      ILE  63   4.855  -5.403  -3.624
  447    H    GLU  64           HN       GLU  64  -1.179  -6.179  -5.878
  448    HA   GLU  64           HA       GLU  64  -0.424  -5.693  -8.683
  449    HB2  GLU  64           HB2      GLU  64  -1.940  -7.618  -8.301
  450    HB3  GLU  64           HB1      GLU  64  -3.105  -6.532  -7.559
  451    HG2  GLU  64           HG2      GLU  64  -3.310  -5.322  -9.682
  452    HG3  GLU  64           HG1      GLU  64  -2.172  -6.449 -10.419
  453    HA   PRO  65           HA       PRO  65  -1.381  -1.371  -8.316
  454    HB2  PRO  65           HB2      PRO  65  -2.813  -1.837 -10.898
  455    HB3  PRO  65           HB1      PRO  65  -1.659  -0.569 -10.466
  456    HG2  PRO  65           HG2      PRO  65  -0.902  -2.636 -11.961
  457    HG3  PRO  65           HG1      PRO  65   0.174  -1.967 -10.720
  458    HD2  PRO  65           HD2      PRO  65  -1.398  -4.493 -10.706
  459    HD3  PRO  65           HD1      PRO  65   0.159  -4.125  -9.939
  460    H    ASN  66           HN       ASN  66  -3.237   0.098  -8.255
  461    HA   ASN  66           HA       ASN  66  -5.315   0.698  -7.571
  462    HB2  ASN  66           HB2      ASN  66  -6.161  -1.911  -8.852
  463    HB3  ASN  66           HB1      ASN  66  -7.245  -0.613  -8.362
  464   HD21  ASN  66          HD21      ASN  66  -6.797  -1.788 -10.989
  465   HD22  ASN  66          HD22      ASN  66  -6.324  -0.486 -12.022
  466    H    ASP  67           HN       ASP  67  -3.866  -0.146  -5.574
  467    HA   ASP  67           HA       ASP  67  -5.693  -1.810  -3.969
  468    HB2  ASP  67           HB2      ASP  67  -3.721  -2.722  -2.779
  469    HB3  ASP  67           HB1      ASP  67  -3.722  -3.147  -4.488
  470    H    LYS  68           HN       LYS  68  -5.521  -1.391  -1.606
  471    HA   LYS  68           HA       LYS  68  -4.865   1.446  -1.149
  472    HB2  LYS  68           HB2      LYS  68  -7.242   0.913  -0.903
  473    HB3  LYS  68           HB1      LYS  68  -6.855  -0.316   0.290
  474    HG2  LYS  68           HG2      LYS  68  -5.995   1.387   1.795
  475    HG3  LYS  68           HG1      LYS  68  -6.326   2.632   0.590
  476    HD2  LYS  68           HD2      LYS  68  -8.711   2.105   0.700
  477    HD3  LYS  68           HD1      LYS  68  -8.382   0.851   1.897
  478    HE2  LYS  68           HE2      LYS  68  -7.509   2.537   3.430
  479    HE3  LYS  68           HE1      LYS  68  -7.811   3.793   2.231
  480    HZ1  LYS  68           HZ3      LYS  68 -10.176   3.285   2.357
  481    HZ2  LYS  68           HZ1      LYS  68  -9.570   3.716   3.878
  482    HZ3  LYS  68           HZ2      LYS  68  -9.878   2.092   3.519
  483    H    ILE  69           HN       ILE  69  -3.201   1.879   0.129
  484    HA   ILE  69           HA       ILE  69  -2.029  -0.247   1.739
  485    HB   ILE  69           HB       ILE  69  -1.016   2.572   1.352
  486   HG12  ILE  69          HG12      ILE  69  -1.198   1.431  -0.810
  487   HG13  ILE  69          HG11      ILE  69   0.488   1.634  -0.347
  488   HG21  ILE  69          HG21      ILE  69   0.319   0.058   2.343
  489   HG22  ILE  69          HG22      ILE  69  -0.072   1.493   3.290
  490   HG23  ILE  69          HG23      ILE  69   1.147   1.581   2.019
  491   HD11  ILE  69          HD13      ILE  69   0.532  -0.711   0.402
  492   HD12  ILE  69          HD11      ILE  69   0.151  -0.543  -1.312
  493   HD13  ILE  69          HD12      ILE  69  -1.133  -0.894  -0.155
  494    H    LEU  70           HN       LEU  70  -1.713  -0.135   3.957
  495    HA   LEU  70           HA       LEU  70  -3.338   1.890   5.345
  496    HG   LEU  70           HG       LEU  70  -4.463  -0.839   4.398
  497    HB2  LEU  70           HB2      LEU  70  -2.744  -0.947   6.183
  498    HB3  LEU  70           HB1      LEU  70  -3.671   0.212   7.117
  499   HD11  LEU  70          HD11      LEU  70  -4.566  -2.590   6.079
  500   HD12  LEU  70          HD12      LEU  70  -6.189  -2.078   5.619
  501   HD13  LEU  70          HD13      LEU  70  -5.494  -1.534   7.145
  502   HD21  LEU  70          HD23      LEU  70  -5.289   1.421   4.869
  503   HD22  LEU  70          HD21      LEU  70  -5.985   0.846   6.384
  504   HD23  LEU  70          HD22      LEU  70  -6.597   0.239   4.846
  505    H    ARG  71           HN       ARG  71  -0.725  -0.407   6.193
  506    HA   ARG  71           HA       ARG  71   0.884   1.813   7.159
  507    HE   ARG  71           HE       ARG  71   1.663  -0.810  11.020
  508    HB2  ARG  71           HB2      ARG  71   1.174   0.847   9.394
  509    HB3  ARG  71           HB1      ARG  71  -0.502   1.287   9.089
  510    HG2  ARG  71           HG2      ARG  71  -1.052  -1.039   8.648
  511    HG3  ARG  71           HG1      ARG  71   0.634  -1.496   8.901
  512    HD2  ARG  71           HD2      ARG  71  -1.160  -0.215  10.959
  513    HD3  ARG  71           HD1      ARG  71  -0.769  -1.933  10.875
  514   HH11  ARG  71          HH11      ARG  71  -1.238  -0.336  12.892
  515   HH12  ARG  71          HH12      ARG  71  -0.388   0.073  14.345
  516   HH21  ARG  71          HH21      ARG  71   2.790  -0.276  12.931
  517   HH22  ARG  71          HH22      ARG  71   1.899   0.109  14.367
  518    H    VAL  72           HN       VAL  72   3.010   1.467   7.020
  519    HA   VAL  72           HA       VAL  72   3.943  -1.012   5.845
  520    HB   VAL  72           HB       VAL  72   5.626   1.373   6.633
  521   HG11  VAL  72          HG11      VAL  72   6.953  -0.528   6.051
  522   HG12  VAL  72          HG12      VAL  72   7.014   0.610   4.705
  523   HG13  VAL  72          HG13      VAL  72   5.991  -0.823   4.604
  524   HG21  VAL  72          HG23      VAL  72   3.769   2.163   5.277
  525   HG22  VAL  72          HG21      VAL  72   4.130   0.948   4.052
  526   HG23  VAL  72          HG22      VAL  72   5.282   2.244   4.376
  527    H    ASP  73           HN       ASP  73   6.207  -1.767   6.777
  528    HA   ASP  73           HA       ASP  73   5.843  -3.017   9.175
  529    HB2  ASP  73           HB2      ASP  73   7.713  -3.321   7.444
  530    HB3  ASP  73           HB1      ASP  73   8.566  -2.057   8.323
  531    H    ASP  74           HN       ASP  74   5.264  -2.095  11.027
  532    HA   ASP  74           HA       ASP  74   5.213  -0.750  12.857
  533    HB2  ASP  74           HB2      ASP  74   8.178  -0.691  12.289
  534    HB3  ASP  74           HB1      ASP  74   7.440  -0.129  13.786
  535    H    VAL  75           HN       VAL  75   5.154   0.578  10.079
  536    HA   VAL  75           HA       VAL  75   5.287   3.300  11.124
  537    HB   VAL  75           HB       VAL  75   6.703   2.487   8.579
  538   HG11  VAL  75          HG11      VAL  75   5.622   4.609   8.252
  539   HG12  VAL  75          HG12      VAL  75   7.353   4.878   8.462
  540   HG13  VAL  75          HG13      VAL  75   6.241   5.207   9.791
  541   HG21  VAL  75          HG23      VAL  75   7.989   1.961  10.581
  542   HG22  VAL  75          HG21      VAL  75   7.783   3.613  11.161
  543   HG23  VAL  75          HG22      VAL  75   8.721   3.301   9.701
  544    H    ASN  76           HN       ASN  76   3.147   3.730  10.920
  545    HA   ASN  76           HA       ASN  76   1.487   2.814   8.841
  546    HB2  ASN  76           HB2      ASN  76   1.110   5.255  10.589
  547    HB3  ASN  76           HB1      ASN  76  -0.147   4.439   9.666
  548   HD21  ASN  76          HD21      ASN  76   1.940   4.284  12.435
  549   HD22  ASN  76          HD22      ASN  76   1.121   2.991  13.235
  550    H    VAL  77           HN       VAL  77   0.538   3.977   7.076
  551    HA   VAL  77           HA       VAL  77   1.911   6.426   6.260
  552    HB   VAL  77           HB       VAL  77   2.173   5.507   3.927
  553   HG11  VAL  77          HG11      VAL  77   4.075   5.816   5.411
  554   HG12  VAL  77          HG12      VAL  77   4.280   4.362   4.433
  555   HG13  VAL  77          HG13      VAL  77   3.795   4.227   6.123
  556   HG21  VAL  77          HG23      VAL  77   1.759   2.875   5.344
  557   HG22  VAL  77          HG21      VAL  77   2.306   3.075   3.680
  558   HG23  VAL  77          HG22      VAL  77   0.682   3.587   4.141
  559    H    GLN  78           HN       GLN  78  -0.614   6.447   7.170
  560    HA   GLN  78           HA       GLN  78  -2.105   7.129   4.757
  561    HB2  GLN  78           HB2      GLN  78  -4.151   6.054   5.585
  562    HB3  GLN  78           HB1      GLN  78  -2.872   4.885   5.286
  563    HG2  GLN  78           HG2      GLN  78  -2.475   4.575   7.583
  564    HG3  GLN  78           HG1      GLN  78  -3.411   6.005   8.017
  565   HE21  GLN  78          HE21      GLN  78  -4.443   3.652   5.635
  566   HE22  GLN  78          HE22      GLN  78  -5.767   3.029   6.546
  567    H    GLY  79           HN       GLY  79  -0.733   8.454   7.084
  568    HA2  GLY  79           HA2      GLY  79  -2.930  10.297   7.696
  569    HA3  GLY  79           HA1      GLY  79  -2.011   9.623   9.035
  570    H    MET  80           HN       MET  80   0.180   9.814   6.660
  571    HA   MET  80           HA       MET  80   1.047  12.495   7.504
  572    HB2  MET  80           HB2      MET  80   2.679  10.166   6.475
  573    HB3  MET  80           HB1      MET  80   3.329  11.750   6.876
  574    HG2  MET  80           HG2      MET  80   2.628  11.452   9.197
  575    HG3  MET  80           HG1      MET  80   1.981   9.863   8.795
  576    HE1  MET  80           HE3      MET  80   3.438   7.803   8.090
  577    HE2  MET  80           HE1      MET  80   5.192   7.838   7.909
  578    HE3  MET  80           HE2      MET  80   4.170   8.723   6.776
  579    H    ALA  81           HN       ALA  81   2.596  13.493   5.790
  580    HA   ALA  81           HA       ALA  81   1.032  13.994   3.474
  581    HB1  ALA  81           HB3      ALA  81   2.825  15.475   2.796
  582    HB2  ALA  81           HB1      ALA  81   3.895  14.770   4.005
  583    HB3  ALA  81           HB2      ALA  81   2.480  15.689   4.512
  584    H    GLN  82           HN       GLN  82   1.971  13.880   1.233
  585    HA   GLN  82           HA       GLN  82   2.435  11.222   0.511
  586    HB2  GLN  82           HB2      GLN  82   1.508  12.936  -1.007
  587    HB3  GLN  82           HB1      GLN  82   3.085  13.712  -1.075
  588    HG2  GLN  82           HG2      GLN  82   2.949  12.457  -3.036
  589    HG3  GLN  82           HG1      GLN  82   3.964  11.498  -1.960
  590   HE21  GLN  82          HE21      GLN  82   2.358  10.686  -4.259
  591   HE22  GLN  82          HE22      GLN  82   1.272   9.475  -3.677
  592    H    SER  83           HN       SER  83   4.726  13.949   0.371
  593    HA   SER  83           HA       SER  83   6.998  12.561  -0.338
  594    HG   SER  83           HG       SER  83   8.946  13.708   0.174
  595    HB2  SER  83           HB2      SER  83   6.900  15.009  -0.252
  596    HB3  SER  83           HB1      SER  83   6.811  14.952   1.510
  597    H    ASP  84           HN       ASP  84   5.618  13.014   2.881
  598    HA   ASP  84           HA       ASP  84   7.719  11.995   4.404
  599    HB2  ASP  84           HB2      ASP  84   4.737  11.978   4.862
  600    HB3  ASP  84           HB1      ASP  84   5.886  11.392   6.062
  601    H    VAL  85           HN       VAL  85   4.990  10.313   2.885
  602    HA   VAL  85           HA       VAL  85   5.565   7.744   3.860
  603    HB   VAL  85           HB       VAL  85   4.271   8.452   1.220
  604   HG11  VAL  85          HG11      VAL  85   4.958   6.120   1.332
  605   HG12  VAL  85          HG12      VAL  85   3.201   6.252   1.417
  606   HG13  VAL  85          HG13      VAL  85   4.134   5.936   2.880
  607   HG21  VAL  85          HG23      VAL  85   3.036   8.007   3.937
  608   HG22  VAL  85          HG21      VAL  85   2.147   8.238   2.431
  609   HG23  VAL  85          HG22      VAL  85   3.140   9.543   3.077
  610    H    VAL  86           HN       VAL  86   6.729   9.489   1.023
  611    HA   VAL  86           HA       VAL  86   8.058   7.334  -0.214
  612    HB   VAL  86           HB       VAL  86   8.904  10.226  -0.369
  613   HG11  VAL  86          HG11      VAL  86   9.669   9.605  -2.607
  614   HG12  VAL  86          HG12      VAL  86   9.142   7.946  -2.328
  615   HG13  VAL  86          HG13      VAL  86  10.452   8.628  -1.366
  616   HG21  VAL  86          HG23      VAL  86   6.735   8.801  -1.904
  617   HG22  VAL  86          HG21      VAL  86   7.369  10.400  -2.297
  618   HG23  VAL  86          HG22      VAL  86   6.525  10.136  -0.771
  619    H    GLU  87           HN       GLU  87   9.096   9.684   2.212
  620    HA   GLU  87           HA       GLU  87  11.822   9.073   2.246
  621    HB2  GLU  87           HB2      GLU  87  10.003  10.034   4.460
  622    HB3  GLU  87           HB1      GLU  87  11.752   9.928   4.615
  623    HG2  GLU  87           HG2      GLU  87  12.018  11.512   2.782
  624    HG3  GLU  87           HG1      GLU  87  10.266  11.613   2.612
  625    H    VAL  88           HN       VAL  88   9.201   7.764   4.272
  626    HA   VAL  88           HA       VAL  88  10.667   5.988   5.802
  627    HB   VAL  88           HB       VAL  88   7.855   5.712   4.745
  628   HG11  VAL  88          HG11      VAL  88   8.660   3.506   5.302
  629   HG12  VAL  88          HG12      VAL  88   7.531   4.049   6.546
  630   HG13  VAL  88          HG13      VAL  88   9.267   4.084   6.855
  631   HG21  VAL  88          HG23      VAL  88   8.227   7.642   6.187
  632   HG22  VAL  88          HG21      VAL  88   8.922   6.596   7.425
  633   HG23  VAL  88          HG22      VAL  88   7.219   6.441   6.993
  634    H    LEU  89           HN       LEU  89   9.015   5.298   2.725
  635    HA   LEU  89           HA       LEU  89   9.815   2.639   2.497
  636    HG   LEU  89           HG       LEU  89   7.339   4.438   1.795
  637    HB2  LEU  89           HB2      LEU  89   9.279   4.603   0.266
  638    HB3  LEU  89           HB1      LEU  89   9.288   2.857   0.114
  639   HD11  LEU  89          HD11      LEU  89   6.991   4.810  -0.589
  640   HD12  LEU  89          HD12      LEU  89   5.695   3.828   0.096
  641   HD13  LEU  89          HD13      LEU  89   6.964   3.068  -0.864
  642   HD21  LEU  89          HD23      LEU  89   7.741   2.218   2.696
  643   HD22  LEU  89          HD21      LEU  89   7.451   1.503   1.111
  644   HD23  LEU  89          HD22      LEU  89   6.136   2.306   1.969
  645    H    ARG  90           HN       ARG  90  11.517   5.599   1.737
  646    HA   ARG  90           HA       ARG  90  13.622   4.212   0.307
  647    HE   ARG  90           HE       ARG  90  12.475   8.740   0.337
  648    HB2  ARG  90           HB2      ARG  90  13.278   7.101   1.114
  649    HB3  ARG  90           HB1      ARG  90  14.683   6.496   0.247
  650    HG2  ARG  90           HG2      ARG  90  13.241   5.792  -1.598
  651    HG3  ARG  90           HG1      ARG  90  11.834   6.405  -0.728
  652    HD2  ARG  90           HD2      ARG  90  14.193   8.041  -1.651
  653    HD3  ARG  90           HD1      ARG  90  12.609   7.993  -2.422
  654   HH11  ARG  90          HH11      ARG  90  13.078   9.918  -2.886
  655   HH12  ARG  90          HH12      ARG  90  12.636  11.551  -2.510
  656   HH21  ARG  90          HH21      ARG  90  11.893  10.887   0.840
  657   HH22  ARG  90          HH22      ARG  90  11.971  12.102  -0.391
  658    H    ASN  91           HN       ASN  91  12.880   4.904   3.531
  659    HA   ASN  91           HA       ASN  91  15.668   4.919   4.396
  660    HB2  ASN  91           HB2      ASN  91  13.101   5.181   5.975
  661    HB3  ASN  91           HB1      ASN  91  14.719   5.276   6.663
  662   HD21  ASN  91          HD21      ASN  91  15.786   6.699   4.341
  663   HD22  ASN  91          HD22      ASN  91  15.198   8.317   4.468
  664    H    ALA  92           HN       ALA  92  13.166   2.716   3.842
  665    HA   ALA  92           HA       ALA  92  13.406   0.818   5.829
  666    HB1  ALA  92           HB3      ALA  92  11.738   0.721   4.043
  667    HB2  ALA  92           HB1      ALA  92  12.608  -0.806   4.199
  668    HB3  ALA  92           HB2      ALA  92  13.002   0.303   2.885
  669    H    GLY  93           HN       GLY  93  14.805   0.008   2.680
  670    HA2  GLY  93           HA2      GLY  93  16.806  -0.974   2.112
  671    HA3  GLY  93           HA1      GLY  93  17.495  -0.168   3.513
  672    H    ASN  94           HN       ASN  94  14.846  -2.138   4.272
  673    HA   ASN  94           HA       ASN  94  16.452  -4.525   4.726
  674    HB2  ASN  94           HB2      ASN  94  15.557  -4.544   7.148
  675    HB3  ASN  94           HB1      ASN  94  16.904  -3.476   6.778
  676   HD21  ASN  94          HD21      ASN  94  13.629  -2.798   5.779
  677   HD22  ASN  94          HD22      ASN  94  13.376  -1.464   6.842
  678    HA   PRO  95           HA       PRO  95  12.704  -6.817   4.084
  679    HB2  PRO  95           HB2      PRO  95  12.905  -8.083   6.759
  680    HB3  PRO  95           HB1      PRO  95  12.846  -8.835   5.162
  681    HG2  PRO  95           HG2      PRO  95  15.121  -8.750   6.548
  682    HG3  PRO  95           HG1      PRO  95  15.114  -8.528   4.788
  683    HD2  PRO  95           HD2      PRO  95  15.366  -6.483   6.957
  684    HD3  PRO  95           HD1      PRO  95  16.209  -6.582   5.397
  685    H    VAL  96           HN       VAL  96  11.002  -5.428   4.124
  686    HA   VAL  96           HA       VAL  96   9.844  -4.774   6.754
  687    HB   VAL  96           HB       VAL  96   8.787  -2.831   5.676
  688   HG11  VAL  96          HG11      VAL  96  10.879  -2.480   6.804
  689   HG12  VAL  96          HG12      VAL  96  10.857  -1.505   5.334
  690   HG13  VAL  96          HG13      VAL  96  11.781  -3.006   5.382
  691   HG21  VAL  96          HG23      VAL  96   8.620  -3.650   3.403
  692   HG22  VAL  96          HG21      VAL  96  10.378  -3.680   3.256
  693   HG23  VAL  96          HG22      VAL  96   9.533  -2.141   3.426
  694    H    ARG  97           HN       ARG  97   7.557  -4.739   6.951
  695    HA   ARG  97           HA       ARG  97   6.221  -6.630   5.158
  696    HE   ARG  97           HE       ARG  97   2.042  -8.493   7.270
  697    HB2  ARG  97           HB2      ARG  97   6.248  -7.225   7.541
  698    HB3  ARG  97           HB1      ARG  97   5.469  -5.699   7.937
  699    HG2  ARG  97           HG2      ARG  97   3.485  -6.377   6.695
  700    HG3  ARG  97           HG1      ARG  97   4.268  -7.901   6.269
  701    HD2  ARG  97           HD2      ARG  97   4.391  -8.512   8.622
  702    HD3  ARG  97           HD1      ARG  97   3.667  -6.970   9.077
  703   HH11  ARG  97          HH11      ARG  97   2.902  -8.025  10.614
  704   HH12  ARG  97          HH12      ARG  97   1.409  -8.660  11.221
  705   HH21  ARG  97          HH21      ARG  97   0.075  -9.331   8.060
  706   HH22  ARG  97          HH22      ARG  97  -0.196  -9.403   9.769
  707    H    LEU  98           HN       LEU  98   4.302  -6.117   4.144
  708    HA   LEU  98           HA       LEU  98   3.528  -3.276   4.275
  709    HG   LEU  98           HG       LEU  98   5.565  -4.914   2.246
  710    HB2  LEU  98           HB2      LEU  98   3.130  -5.074   1.898
  711    HB3  LEU  98           HB1      LEU  98   3.011  -3.327   1.962
  712   HD11  LEU  98          HD11      LEU  98   4.661  -4.992  -0.017
  713   HD12  LEU  98          HD12      LEU  98   6.120  -4.003   0.052
  714   HD13  LEU  98          HD13      LEU  98   4.536  -3.232  -0.035
  715   HD21  LEU  98          HD23      LEU  98   5.069  -1.940   2.135
  716   HD22  LEU  98          HD21      LEU  98   6.655  -2.709   2.050
  717   HD23  LEU  98          HD22      LEU  98   5.679  -2.857   3.512
  718    H    LEU  99           HN       LEU  99   1.699  -3.119   5.412
  719    HA   LEU  99           HA       LEU  99  -0.329  -5.216   5.184
  720    HG   LEU  99           HG       LEU  99  -2.512  -3.714   6.749
  721    HB2  LEU  99           HB2      LEU  99   0.336  -4.458   7.435
  722    HB3  LEU  99           HB1      LEU  99  -0.200  -2.836   7.039
  723   HD11  LEU  99          HD11      LEU  99  -1.962  -6.026   6.228
  724   HD12  LEU  99          HD12      LEU  99  -3.042  -5.934   7.618
  725   HD13  LEU  99          HD13      LEU  99  -1.324  -6.253   7.856
  726   HD21  LEU  99          HD23      LEU  99  -1.961  -2.667   8.823
  727   HD22  LEU  99          HD21      LEU  99  -1.158  -4.125   9.408
  728   HD23  LEU  99          HD22      LEU  99  -2.908  -4.111   9.181
  729    H    LEU 100           HN       LEU 100  -1.534  -4.928   3.405
  730    HA   LEU 100           HA       LEU 100  -2.831  -2.312   3.060
  731    HG   LEU 100           HG       LEU 100  -0.236  -4.293   1.586
  732    HB2  LEU 100           HB2      LEU 100  -2.794  -3.079   0.528
  733    HB3  LEU 100           HB1      LEU 100  -1.474  -2.174   1.243
  734   HD11  LEU 100          HD11      LEU 100  -1.018  -6.308   0.390
  735   HD12  LEU 100          HD12      LEU 100  -2.557  -5.498   0.091
  736   HD13  LEU 100          HD13      LEU 100  -2.055  -5.857   1.744
  737   HD21  LEU 100          HD23      LEU 100   0.229  -2.984  -0.380
  738   HD22  LEU 100          HD21      LEU 100  -1.136  -3.708  -1.229
  739   HD23  LEU 100          HD22      LEU 100   0.262  -4.696  -0.802
  740    H    ILE 101           HN       ILE 101  -4.919  -2.352   2.083
  741    HA   ILE 101           HA       ILE 101  -6.285  -4.925   2.451
  742    HB   ILE 101           HB       ILE 101  -7.172  -3.180   3.876
  743   HG12  ILE 101          HG12      ILE 101  -9.079  -3.667   1.576
  744   HG13  ILE 101          HG11      ILE 101  -8.732  -4.836   2.845
  745   HG21  ILE 101          HG21      ILE 101  -6.461  -1.244   2.586
  746   HG22  ILE 101          HG22      ILE 101  -8.182  -1.148   2.960
  747   HG23  ILE 101          HG23      ILE 101  -7.655  -1.618   1.343
  748   HD11  ILE 101          HD13      ILE 101  -9.989  -2.129   3.230
  749   HD12  ILE 101          HD11      ILE 101  -9.637  -3.293   4.508
  750   HD13  ILE 101          HD12      ILE 101 -10.823  -3.684   3.262
  751    H    ARG 102           HN       ARG 102  -7.409  -5.860   0.843
  752    HA   ARG 102           HA       ARG 102  -7.437  -4.483  -1.765
  753    HE   ARG 102           HE       ARG 102  -6.647  -5.599  -4.355
  754    HB2  ARG 102           HB2      ARG 102  -7.178  -7.435  -1.167
  755    HB3  ARG 102           HB1      ARG 102  -7.365  -6.760  -2.778
  756    HG2  ARG 102           HG2      ARG 102  -5.090  -6.070  -0.937
  757    HG3  ARG 102           HG1      ARG 102  -5.026  -7.352  -2.146
  758    HD2  ARG 102           HD2      ARG 102  -5.462  -4.410  -2.642
  759    HD3  ARG 102           HD1      ARG 102  -4.024  -5.349  -3.043
  760   HH11  ARG 102          HH11      ARG 102  -3.199  -6.097  -4.313
  761   HH12  ARG 102          HH12      ARG 102  -3.127  -6.630  -5.959
  762   HH21  ARG 102          HH21      ARG 102  -6.561  -6.298  -6.522
  763   HH22  ARG 102          HH22      ARG 102  -5.038  -6.747  -7.214
  764    H    ARG 103           HN       ARG 103  -9.286  -4.660  -3.042
  765    HA   ARG 103           HA       ARG 103 -11.693  -5.312  -1.536
  766    HE   ARG 103           HE       ARG 103 -11.077  -1.954  -4.822
  767    HB2  ARG 103           HB2      ARG 103 -11.346  -3.902  -4.187
  768    HB3  ARG 103           HB1      ARG 103 -12.884  -4.148  -3.373
  769    HG2  ARG 103           HG2      ARG 103 -12.053  -2.821  -1.468
  770    HG3  ARG 103           HG1      ARG 103 -10.562  -2.520  -2.364
  771    HD2  ARG 103           HD2      ARG 103 -13.336  -1.744  -3.256
  772    HD3  ARG 103           HD1      ARG 103 -12.148  -0.653  -2.544
  773   HH11  ARG 103          HH11      ARG 103 -13.294   0.567  -3.880
  774   HH12  ARG 103          HH12      ARG 103 -13.087   1.473  -5.341
  775   HH21  ARG 103          HH21      ARG 103 -10.802  -0.766  -6.751
  776   HH22  ARG 103          HH22      ARG 103 -11.675   0.713  -6.975
  777    H    LEU 104           HN       LEU 104 -12.454  -7.297  -1.686
  778    HA   LEU 104           HA       LEU 104 -11.860  -8.972  -3.965
  779    HG   LEU 104           HG       LEU 104 -11.102  -9.180  -0.985
  780    HB2  LEU 104           HB2      LEU 104 -13.520  -9.513  -1.500
  781    HB3  LEU 104           HB1      LEU 104 -13.063 -10.711  -2.696
  782   HD11  LEU 104          HD11      LEU 104 -12.467 -10.641   0.391
  783   HD12  LEU 104          HD12      LEU 104 -10.834 -11.288   0.238
  784   HD13  LEU 104          HD13      LEU 104 -12.152 -11.992  -0.699
  785   HD21  LEU 104          HD23      LEU 104  -9.479 -10.782  -1.794
  786   HD22  LEU 104          HD21      LEU 104 -10.229  -9.953  -3.158
  787   HD23  LEU 104          HD22      LEU 104 -10.718 -11.597  -2.749
  788    HA   PRO 105           HA       PRO 105 -15.744  -8.123  -5.964
  789    HB2  PRO 105           HB2      PRO 105 -15.641  -9.923  -7.927
  790    HB3  PRO 105           HB1      PRO 105 -14.491  -8.581  -7.870
  791    HG2  PRO 105           HG2      PRO 105 -14.115 -11.434  -7.059
  792    HG3  PRO 105           HG1      PRO 105 -13.008 -10.370  -7.944
  793    HD2  PRO 105           HD2      PRO 105 -12.850 -10.899  -5.236
  794    HD3  PRO 105           HD1      PRO 105 -12.172  -9.459  -6.021
  795    H    LEU 106           HN       LEU 106 -17.812  -9.090  -6.398
  796    HA   LEU 106           HA       LEU 106 -18.283 -11.715  -5.188
  797    HG   LEU 106           HG       LEU 106 -17.755  -9.544  -3.141
  798    HB2  LEU 106           HB2      LEU 106 -19.794  -9.190  -4.519
  799    HB3  LEU 106           HB1      LEU 106 -20.335 -10.799  -4.085
  800   HD11  LEU 106          HD11      LEU 106 -19.649  -8.375  -2.194
  801   HD12  LEU 106          HD12      LEU 106 -18.895  -9.387  -0.963
  802   HD13  LEU 106          HD13      LEU 106 -20.396  -9.903  -1.731
  803   HD21  LEU 106          HD23      LEU 106 -17.729 -11.425  -1.557
  804   HD22  LEU 106          HD21      LEU 106 -17.630 -11.964  -3.233
  805   HD23  LEU 106          HD22      LEU 106 -19.151 -12.099  -2.353
  806    H    LEU 107           HN       LEU 107 -19.217 -12.926  -6.679
  807    HA   LEU 107           HA       LEU 107 -20.376 -11.921  -9.040
  808    HG   LEU 107           HG       LEU 107 -19.126 -15.359  -9.688
  809    HB2  LEU 107           HB2      LEU 107 -20.418 -14.633  -7.740
  810    HB3  LEU 107           HB1      LEU 107 -21.266 -14.318  -9.241
  811   HD11  LEU 107          HD11      LEU 107 -18.326 -13.855 -11.342
  812   HD12  LEU 107          HD12      LEU 107 -18.969 -12.461 -10.474
  813   HD13  LEU 107          HD13      LEU 107 -20.071 -13.621 -11.217
  814   HD21  LEU 107          HD23      LEU 107 -17.883 -12.967  -8.335
  815   HD22  LEU 107          HD21      LEU 107 -17.023 -14.278  -9.141
  816   HD23  LEU 107          HD22      LEU 107 -17.945 -14.599  -7.672
  817    H    GLU 108           HN       GLU 108 -22.290 -11.028  -9.351
  818    HA   GLU 108           HA       GLU 108 -24.368 -11.333  -7.328
  819    HB2  GLU 108           HB2      GLU 108 -24.185  -9.495  -9.722
  820    HB3  GLU 108           HB1      GLU 108 -25.492  -9.490  -8.545
  821    HG2  GLU 108           HG2      GLU 108 -23.886  -8.908  -6.784
  822    HG3  GLU 108           HG1      GLU 108 -22.600  -8.873  -7.989
  Start of MODEL   20
    1    H1   GLY   1           HT1      GLY   1 -14.311 -12.547  17.340
    2    H2   GLY   1           HT2      GLY   1 -13.410 -11.485  18.300
    3    H3   GLY   1           HT3      GLY   1 -13.997 -12.929  18.958
    4    HA2  GLY   1           HA1      GLY   1 -11.641 -13.119  18.506
    5    HA3  GLY   1           HA2      GLY   1 -12.575 -14.222  17.505
    6    H    SER   2           HN       SER   2 -10.665 -14.239  16.136
    7    HA   SER   2           HA       SER   2  -9.535 -13.668  14.248
    8    HG   SER   2           HG       SER   2 -12.540 -13.987  13.931
    9    HB2  SER   2           HB2      SER   2 -11.899 -11.829  13.810
   10    HB3  SER   2           HB1      SER   2 -10.714 -12.282  12.586
   11    H    HIS   3           HN       HIS   3  -8.825 -11.541  12.926
   12    HA   HIS   3           HA       HIS   3  -8.160  -9.433  14.857
   13    HD1  HIS   3           HD1      HIS   3  -5.640  -9.875  16.592
   14    HD2  HIS   3           HD2      HIS   3  -6.210 -13.249  14.235
   15    HE1  HIS   3           HE1      HIS   3  -5.102 -11.832  18.077
   16    HE2  HIS   3           HE2      HIS   3  -5.400 -13.860  16.613
   17    HB2  HIS   3           HB2      HIS   3  -6.179 -10.756  12.991
   18    HB3  HIS   3           HB1      HIS   3  -5.840  -9.387  14.045
   19    H    GLY   4           HN       GLY   4  -9.860  -8.301  13.703
   20    HA2  GLY   4           HA2      GLY   4 -10.038  -6.342  12.362
   21    HA3  GLY   4           HA1      GLY   4  -8.789  -6.985  11.307
   22    H    TYR   5           HN       TYR   5 -10.875  -5.996  10.037
   23    HA   TYR   5           HA       TYR   5 -13.052  -7.770   9.653
   24    HD1  TYR   5           HD2      TYR   5 -11.673  -4.043   9.786
   25    HD2  TYR   5           HD1      TYR   5 -15.425  -5.898   9.023
   26    HE1  TYR   5           HE2      TYR   5 -12.769  -2.429  11.285
   27    HE2  TYR   5           HE1      TYR   5 -16.532  -4.288  10.518
   28    HH   TYR   5           HH       TYR   5 -15.038  -1.470  11.613
   29    HB2  TYR   5           HB2      TYR   5 -11.982  -5.562   7.884
   30    HB3  TYR   5           HB1      TYR   5 -13.518  -6.387   7.639
   31    H    SER   6           HN       SER   6 -12.280  -9.831   9.252
   32    HA   SER   6           HA       SER   6 -10.590 -10.248   6.905
   33    HG   SER   6           HG       SER   6 -11.630 -13.297   9.319
   34    HB2  SER   6           HB2      SER   6 -10.453 -12.590   7.688
   35    HB3  SER   6           HB1      SER   6  -9.968 -11.450   8.943
   36    H    ASP   7           HN       ASP   7 -11.635 -10.332   5.033
   37    HA   ASP   7           HA       ASP   7 -13.140 -10.864   3.415
   38    HB2  ASP   7           HB2      ASP   7 -13.662 -13.235   5.222
   39    HB3  ASP   7           HB1      ASP   7 -14.177 -13.104   3.543
   40    H    ALA   8           HN       ALA   8 -14.063  -8.927   5.022
   41    HA   ALA   8           HA       ALA   8 -16.854  -9.647   5.622
   42    HB1  ALA   8           HB3      ALA   8 -15.581  -8.748   7.516
   43    HB2  ALA   8           HB1      ALA   8 -16.918  -7.689   7.063
   44    HB3  ALA   8           HB2      ALA   8 -15.268  -7.274   6.598
   45    H    SER   9           HN       SER   9 -18.177  -9.189   3.996
   46    HA   SER   9           HA       SER   9 -19.204  -8.128   2.270
   47    HG   SER   9           HG       SER   9 -20.526  -5.736   4.135
   48    HB2  SER   9           HB2      SER   9 -18.054  -5.676   3.622
   49    HB3  SER   9           HB1      SER   9 -19.314  -5.658   2.388
   50    H    GLY  10           HN       GLY  10 -16.409  -9.020   1.972
   51    HA2  GLY  10           HA2      GLY  10 -15.271  -9.094  -0.124
   52    HA3  GLY  10           HA1      GLY  10 -15.800  -7.448  -0.433
   53    H    PHE  11           HN       PHE  11 -15.048  -6.366   2.100
   54    HA   PHE  11           HA       PHE  11 -12.375  -5.668   1.568
   55    HD1  PHE  11           HD2      PHE  11 -12.399  -2.954   1.792
   56    HD2  PHE  11           HD1      PHE  11 -16.002  -4.487   3.458
   57    HE1  PHE  11           HE2      PHE  11 -13.662  -1.126   0.734
   58    HE2  PHE  11           HE1      PHE  11 -17.272  -2.664   2.402
   59    HZ   PHE  11           HZ       PHE  11 -16.101  -0.979   1.039
   60    HB2  PHE  11           HB2      PHE  11 -13.952  -5.368   4.135
   61    HB3  PHE  11           HB1      PHE  11 -12.443  -4.542   3.763
   62    H    SER  12           HN       SER  12 -10.775  -7.094   1.633
   63    HA   SER  12           HA       SER  12 -10.549  -8.814   4.014
   64    HG   SER  12           HG       SER  12  -8.488 -10.271   3.250
   65    HB2  SER  12           HB2      SER  12 -10.986 -10.148   2.001
   66    HB3  SER  12           HB1      SER  12  -9.609  -9.397   1.193
   67    H    LEU  13           HN       LEU  13  -8.699  -8.713   5.154
   68    HA   LEU  13           HA       LEU  13  -6.831  -6.628   4.540
   69    HG   LEU  13           HG       LEU  13  -8.699  -7.069   6.905
   70    HB2  LEU  13           HB2      LEU  13  -6.814  -8.705   6.731
   71    HB3  LEU  13           HB1      LEU  13  -5.707  -7.349   6.625
   72   HD11  LEU  13          HD11      LEU  13  -8.252  -6.454   9.221
   73   HD12  LEU  13          HD12      LEU  13  -6.539  -6.811   8.994
   74   HD13  LEU  13          HD13      LEU  13  -7.731  -8.108   8.892
   75   HD21  LEU  13          HD23      LEU  13  -6.427  -5.094   7.050
   76   HD22  LEU  13          HD21      LEU  13  -8.094  -4.737   7.505
   77   HD23  LEU  13          HD22      LEU  13  -7.705  -5.158   5.836
   78    H    TYR  14           HN       TYR  14  -5.097  -6.802   3.315
   79    HA   TYR  14           HA       TYR  14  -3.940  -9.472   2.861
   80    HD1  TYR  14           HD1      TYR  14  -6.606  -7.608   0.969
   81    HD2  TYR  14           HD2      TYR  14  -3.640 -10.442  -0.171
   82    HE1  TYR  14           HE1      TYR  14  -8.323  -8.932  -0.190
   83    HE2  TYR  14           HE2      TYR  14  -5.351 -11.769  -1.335
   84    HH   TYR  14           HH       TYR  14  -7.817 -12.096  -1.222
   85    HB2  TYR  14           HB2      TYR  14  -4.197  -7.070   1.067
   86    HB3  TYR  14           HB1      TYR  14  -2.999  -8.319   0.748
   87    H    SER  15           HN       SER  15  -1.630  -9.611   2.623
   88    HA   SER  15           HA       SER  15  -0.040  -7.338   3.470
   89    HG   SER  15           HG       SER  15   1.761  -9.309   5.762
   90    HB2  SER  15           HB2      SER  15  -0.709  -8.304   5.613
   91    HB3  SER  15           HB1      SER  15  -0.133  -9.889   5.097
   92    H    VAL  16           HN       VAL  16   1.913  -7.345   2.543
   93    HA   VAL  16           HA       VAL  16   2.959  -9.878   1.472
   94    HB   VAL  16           HB       VAL  16   2.962  -7.234   0.006
   95   HG11  VAL  16          HG11      VAL  16   4.983  -8.505  -0.428
   96   HG12  VAL  16          HG12      VAL  16   3.939  -8.517  -1.848
   97   HG13  VAL  16          HG13      VAL  16   4.026  -9.937  -0.805
   98   HG21  VAL  16          HG23      VAL  16   1.485  -8.335  -1.596
   99   HG22  VAL  16          HG21      VAL  16   0.760  -8.297   0.012
  100   HG23  VAL  16          HG22      VAL  16   1.476  -9.790  -0.597
  101    H    GLU  17           HN       GLU  17   5.027 -10.249   1.983
  102    HA   GLU  17           HA       GLU  17   6.493  -8.159   3.390
  103    HB2  GLU  17           HB2      GLU  17   7.116 -11.097   3.044
  104    HB3  GLU  17           HB1      GLU  17   8.020  -9.975   4.051
  105    HG2  GLU  17           HG2      GLU  17   6.035  -9.623   5.437
  106    HG3  GLU  17           HG1      GLU  17   5.141 -10.766   4.433
  107    H    LEU  18           HN       LEU  18   7.920  -6.937   2.372
  108    HA   LEU  18           HA       LEU  18   9.333  -8.054   0.040
  109    HG   LEU  18           HG       LEU  18   6.599  -6.282  -0.381
  110    HB2  LEU  18           HB2      LEU  18   8.487  -5.205   0.547
  111    HB3  LEU  18           HB1      LEU  18   9.524  -5.710  -0.772
  112   HD11  LEU  18          HD11      LEU  18   7.208  -4.207  -1.490
  113   HD12  LEU  18          HD12      LEU  18   6.453  -5.327  -2.623
  114   HD13  LEU  18          HD13      LEU  18   8.202  -5.103  -2.638
  115   HD21  LEU  18          HD23      LEU  18   7.576  -8.407  -0.998
  116   HD22  LEU  18          HD21      LEU  18   8.495  -7.642  -2.296
  117   HD23  LEU  18          HD22      LEU  18   6.735  -7.722  -2.389
  118    H    PHE  19           HN       PHE  19  11.366  -8.484   0.548
  119    HA   PHE  19           HA       PHE  19  12.691  -7.198   2.755
  120    HD1  PHE  19           HD2      PHE  19  11.826 -10.448   0.494
  121    HD2  PHE  19           HD1      PHE  19  13.694  -9.803   4.262
  122    HE1  PHE  19           HE2      PHE  19  10.569 -12.343   1.436
  123    HE2  PHE  19           HE1      PHE  19  12.441 -11.697   5.211
  124    HZ   PHE  19           HZ       PHE  19  10.880 -12.976   3.790
  125    HB2  PHE  19           HB2      PHE  19  13.876  -9.093   0.721
  126    HB3  PHE  19           HB1      PHE  19  14.512  -8.716   2.318
  127    H    ARG  20           HN       ARG  20  13.586  -5.230   2.569
  128    HA   ARG  20           HA       ARG  20  14.629  -4.417  -0.052
  129    HE   ARG  20           HE       ARG  20  15.849   0.694   1.414
  130    HB2  ARG  20           HB2      ARG  20  13.077  -2.837   0.871
  131    HB3  ARG  20           HB1      ARG  20  13.919  -2.825   2.414
  132    HG2  ARG  20           HG2      ARG  20  15.769  -1.657   1.494
  133    HG3  ARG  20           HG1      ARG  20  15.177  -1.890  -0.151
  134    HD2  ARG  20           HD2      ARG  20  13.427  -0.359   0.141
  135    HD3  ARG  20           HD1      ARG  20  13.572  -0.396   1.899
  136   HH11  ARG  20          HH11      ARG  20  12.959   1.185  -0.470
  137   HH12  ARG  20          HH12      ARG  20  13.388   2.794  -0.945
  138   HH21  ARG  20          HH21      ARG  20  16.420   2.811   0.795
  139   HH22  ARG  20          HH22      ARG  20  15.356   3.718  -0.228
  140    H    GLU  21           HN       GLU  21  16.682  -5.063  -0.295
  141    HA   GLU  21           HA       GLU  21  18.650  -4.093   1.619
  142    HB2  GLU  21           HB2      GLU  21  19.788  -6.251   1.787
  143    HB3  GLU  21           HB1      GLU  21  18.146  -6.359   2.408
  144    HG2  GLU  21           HG2      GLU  21  17.408  -7.436   0.377
  145    HG3  GLU  21           HG1      GLU  21  19.011  -7.246  -0.335
  146    H    LYS  22           HN       LYS  22  17.667  -4.016  -1.364
  147    HA   LYS  22           HA       LYS  22  20.212  -4.551  -2.694
  148    HB2  LYS  22           HB2      LYS  22  17.624  -3.588  -3.923
  149    HB3  LYS  22           HB1      LYS  22  19.015  -4.252  -4.767
  150    HG2  LYS  22           HG2      LYS  22  17.223  -5.752  -2.867
  151    HG3  LYS  22           HG1      LYS  22  17.202  -5.868  -4.626
  152    HD2  LYS  22           HD2      LYS  22  19.440  -6.780  -4.633
  153    HD3  LYS  22           HD1      LYS  22  19.570  -6.556  -2.888
  154    HE2  LYS  22           HE2      LYS  22  17.706  -8.131  -2.568
  155    HE3  LYS  22           HE1      LYS  22  17.635  -8.380  -4.313
  156    HZ1  LYS  22           HZ3      LYS  22  19.986  -8.980  -2.600
  157    HZ2  LYS  22           HZ1      LYS  22  19.861  -9.277  -4.262
  158    HZ3  LYS  22           HZ2      LYS  22  18.883 -10.127  -3.173
  159    H    ASP  23           HN       ASP  23  21.196  -2.933  -4.066
  160    HA   ASP  23           HA       ASP  23  21.172  -0.327  -2.813
  161    HB2  ASP  23           HB2      ASP  23  22.819  -1.389  -5.120
  162    HB3  ASP  23           HB1      ASP  23  23.060   0.167  -4.333
  163    H    THR  24           HN       THR  24  18.743  -0.540  -3.801
  164    HA   THR  24           HA       THR  24  18.773   1.043  -6.289
  165    HB   THR  24           HB       THR  24  16.668   0.100  -6.932
  166    HG1  THR  24           HG1      THR  24  16.582  -0.641  -4.276
  167   HG21  THR  24          HG23      THR  24  18.450  -2.123  -5.927
  168   HG22  THR  24          HG21      THR  24  18.643  -1.264  -7.456
  169   HG23  THR  24          HG22      THR  24  17.218  -2.267  -7.181
  170    H    SER  25           HN       SER  25  17.529   0.650  -3.070
  171    HA   SER  25           HA       SER  25  16.386   2.004  -1.657
  172    HG   SER  25           HG       SER  25  16.681   4.479  -0.833
  173    HB2  SER  25           HB2      SER  25  18.176   3.595  -2.174
  174    HB3  SER  25           HB1      SER  25  17.273   4.171  -3.575
  175    H    SER  26           HN       SER  26  15.189   1.004  -4.331
  176    HA   SER  26           HA       SER  26  12.738   2.626  -4.152
  177    HG   SER  26           HG       SER  26  12.091   1.853  -7.610
  178    HB2  SER  26           HB2      SER  26  13.863   3.080  -6.280
  179    HB3  SER  26           HB1      SER  26  13.911   1.354  -6.636
  180    H    LEU  27           HN       LEU  27  10.892   1.538  -3.812
  181    HA   LEU  27           HA       LEU  27  11.059  -1.389  -3.688
  182    HG   LEU  27           HG       LEU  27  11.297   0.478  -1.285
  183    HB2  LEU  27           HB2      LEU  27   9.090   0.528  -2.438
  184    HB3  LEU  27           HB1      LEU  27   9.009  -1.216  -2.292
  185   HD11  LEU  27          HD11      LEU  27   9.191   0.902  -0.079
  186   HD12  LEU  27          HD12      LEU  27  10.402   0.108   0.927
  187   HD13  LEU  27          HD13      LEU  27   9.061  -0.823   0.261
  188   HD21  LEU  27          HD23      LEU  27  12.010  -1.763  -1.817
  189   HD22  LEU  27          HD21      LEU  27  10.633  -2.445  -0.951
  190   HD23  LEU  27          HD22      LEU  27  11.896  -1.592  -0.065
  191    H    GLY  28           HN       GLY  28   9.839   1.103  -5.590
  192    HA2  GLY  28           HA2      GLY  28   8.736   0.850  -7.633
  193    HA3  GLY  28           HA1      GLY  28   8.314  -0.794  -7.178
  194    H    ILE  29           HN       ILE  29   7.609   1.273  -4.657
  195    HA   ILE  29           HA       ILE  29   4.768   1.050  -5.176
  196    HB   ILE  29           HB       ILE  29   6.195   2.280  -2.813
  197   HG12  ILE  29          HG12      ILE  29   4.947  -0.464  -3.083
  198   HG13  ILE  29          HG11      ILE  29   6.677  -0.142  -3.161
  199   HG21  ILE  29          HG21      ILE  29   3.918   3.098  -3.064
  200   HG22  ILE  29          HG22      ILE  29   4.045   2.031  -1.666
  201   HG23  ILE  29          HG23      ILE  29   3.320   1.441  -3.161
  202   HD11  ILE  29          HD13      ILE  29   6.630   0.684  -0.870
  203   HD12  ILE  29          HD11      ILE  29   6.020  -0.967  -0.974
  204   HD13  ILE  29          HD12      ILE  29   4.895   0.379  -0.793
  205    H    SER  30           HN       SER  30   3.876   2.516  -6.496
  206    HA   SER  30           HA       SER  30   4.696   5.332  -6.203
  207    HG   SER  30           HG       SER  30   6.081   5.060  -8.286
  208    HB2  SER  30           HB2      SER  30   3.494   3.947  -8.612
  209    HB3  SER  30           HB1      SER  30   3.924   5.655  -8.524
  210    H    ILE  31           HN       ILE  31   3.268   6.125  -4.741
  211    HA   ILE  31           HA       ILE  31   0.430   5.500  -4.998
  212    HB   ILE  31           HB       ILE  31   0.185   6.820  -2.904
  213   HG12  ILE  31          HG12      ILE  31   3.210   6.874  -2.912
  214   HG13  ILE  31          HG11      ILE  31   2.203   8.259  -3.316
  215   HG21  ILE  31          HG21      ILE  31   1.255   5.160  -1.454
  216   HG22  ILE  31          HG22      ILE  31   2.218   4.594  -2.818
  217   HG23  ILE  31          HG23      ILE  31   0.465   4.403  -2.837
  218   HD11  ILE  31          HD13      ILE  31   3.029   8.343  -1.018
  219   HD12  ILE  31          HD11      ILE  31   2.204   6.823  -0.672
  220   HD13  ILE  31          HD12      ILE  31   1.268   8.260  -1.084
  221    H    SER  32           HN       SER  32  -1.185   7.113  -5.149
  222    HA   SER  32           HA       SER  32  -0.270   9.549  -6.522
  223    HG   SER  32           HG       SER  32  -3.962   8.558  -6.431
  224    HB2  SER  32           HB2      SER  32  -2.511   9.603  -7.553
  225    HB3  SER  32           HB1      SER  32  -1.677   8.087  -7.894
  226    H    GLY  33           HN       GLY  33  -0.746  11.514  -5.727
  227    HA2  GLY  33           HA2      GLY  33  -1.612  11.831  -3.073
  228    HA3  GLY  33           HA1      GLY  33  -1.455  13.123  -4.253
  229    H    MET  34           HN       MET  34  -3.595  11.324  -2.385
  230    HA   MET  34           HA       MET  34  -5.910  11.661  -4.074
  231    HB2  MET  34           HB2      MET  34  -5.706   9.728  -2.563
  232    HB3  MET  34           HB1      MET  34  -5.703  10.812  -1.179
  233    HG2  MET  34           HG2      MET  34  -7.964  11.526  -1.710
  234    HG3  MET  34           HG1      MET  34  -7.970  10.483  -3.132
  235    HE1  MET  34           HE3      MET  34 -10.242   9.381  -2.307
  236    HE2  MET  34           HE1      MET  34 -10.241  10.408  -0.873
  237    HE3  MET  34           HE2      MET  34 -10.462   8.665  -0.710
  238    H    ARG  35           HN       ARG  35  -6.484  13.733  -4.403
  239    HA   ARG  35           HA       ARG  35  -6.195  15.824  -2.543
  240    HE   ARG  35           HE       ARG  35  -6.755  14.954  -6.582
  241    HB2  ARG  35           HB2      ARG  35  -7.382  17.181  -4.071
  242    HB3  ARG  35           HB1      ARG  35  -6.506  16.024  -5.059
  243    HG2  ARG  35           HG2      ARG  35  -9.410  15.756  -4.302
  244    HG3  ARG  35           HG1      ARG  35  -8.825  16.450  -5.815
  245    HD2  ARG  35           HD2      ARG  35  -8.431  13.626  -4.835
  246    HD3  ARG  35           HD1      ARG  35  -9.439  14.151  -6.183
  247   HH11  ARG  35          HH11      ARG  35  -8.823  12.152  -6.669
  248   HH12  ARG  35          HH12      ARG  35  -7.853  11.313  -7.834
  249   HH21  ARG  35          HH21      ARG  35  -5.475  13.860  -8.118
  250   HH22  ARG  35          HH22      ARG  35  -5.948  12.283  -8.655
  251    H    ASP  36           HN       ASP  36  -7.938  17.084  -1.557
  252    HA   ASP  36           HA       ASP  36  -9.953  15.303  -0.389
  253    HB2  ASP  36           HB2      ASP  36  -8.440  16.488   1.166
  254    HB3  ASP  36           HB1      ASP  36  -9.012  18.028   0.535
  255    H    GLN  37           HN       GLN  37 -12.127  15.777  -0.421
  256    HA   GLN  37           HA       GLN  37 -12.943  17.721  -2.445
  257    HB2  GLN  37           HB2      GLN  37 -14.491  15.511  -1.083
  258    HB3  GLN  37           HB1      GLN  37 -15.141  16.571  -2.326
  259    HG2  GLN  37           HG2      GLN  37 -13.460  15.728  -3.903
  260    HG3  GLN  37           HG1      GLN  37 -12.856  14.639  -2.655
  261   HE21  GLN  37          HE21      GLN  37 -13.314  12.827  -3.900
  262   HE22  GLN  37          HE22      GLN  37 -14.928  12.259  -4.140
  263    H    SER  38           HN       SER  38 -12.104  19.006  -0.227
  264    HA   SER  38           HA       SER  38 -12.678  20.520   1.373
  265    HG   SER  38           HG       SER  38 -12.953  21.209  -1.008
  266    HB2  SER  38           HB2      SER  38 -15.279  20.536  -0.178
  267    HB3  SER  38           HB1      SER  38 -14.779  21.762   0.987
  268    H    THR  39           HN       THR  39 -12.587  18.779   2.960
  269    HA   THR  39           HA       THR  39 -15.207  18.378   4.229
  270    HB   THR  39           HB       THR  39 -14.656  16.094   4.837
  271    HG1  THR  39           HG1      THR  39 -12.172  16.834   3.854
  272   HG21  THR  39          HG23      THR  39 -15.793  16.452   2.690
  273   HG22  THR  39          HG21      THR  39 -14.742  15.035   2.637
  274   HG23  THR  39          HG22      THR  39 -14.228  16.545   1.881
  275    H    THR  40           HN       THR  40 -15.240  18.627   6.407
  276    HA   THR  40           HA       THR  40 -12.815  19.631   7.654
  277    HB   THR  40           HB       THR  40 -14.881  20.884   8.008
  278    HG1  THR  40           HG1      THR  40 -14.548  21.181  10.157
  279   HG21  THR  40          HG23      THR  40 -16.480  19.047   7.856
  280   HG22  THR  40          HG21      THR  40 -16.705  19.945   9.356
  281   HG23  THR  40          HG22      THR  40 -15.882  18.385   9.377
  282    H    GLY  41           HN       GLY  41 -13.671  16.664   7.064
  283    HA2  GLY  41           HA2      GLY  41 -13.000  15.659   9.761
  284    HA3  GLY  41           HA1      GLY  41 -14.031  14.791   8.633
  285    H    GLU  42           HN       GLU  42 -11.607  16.242   6.903
  286    HA   GLU  42           HA       GLU  42  -9.792  15.459   5.784
  287    HB2  GLU  42           HB2      GLU  42  -9.306  14.025   8.399
  288    HB3  GLU  42           HB1      GLU  42  -8.121  14.205   7.113
  289    HG2  GLU  42           HG2      GLU  42  -8.197  16.634   7.388
  290    HG3  GLU  42           HG1      GLU  42  -9.378  16.445   8.684
  291    H    ALA  43           HN       ALA  43 -10.951  14.292   4.236
  292    HA   ALA  43           HA       ALA  43 -11.299  11.421   4.733
  293    HB1  ALA  43           HB3      ALA  43 -13.267  12.652   3.930
  294    HB2  ALA  43           HB1      ALA  43 -12.754  11.412   2.786
  295    HB3  ALA  43           HB2      ALA  43 -12.379  13.107   2.476
  296    H    THR  44           HN       THR  44  -8.686  12.398   4.374
  297    HA   THR  44           HA       THR  44  -7.897  11.863   1.638
  298    HB   THR  44           HB       THR  44  -5.590  12.251   2.464
  299    HG1  THR  44           HG1      THR  44  -5.704  11.591   4.586
  300   HG21  THR  44          HG23      THR  44  -7.598  14.358   3.275
  301   HG22  THR  44          HG21      THR  44  -6.914  14.139   1.664
  302   HG23  THR  44          HG22      THR  44  -5.878  14.634   3.002
  303    H    GLY  45           HN       GLY  45  -6.408  10.202   1.033
  304    HA2  GLY  45           HA2      GLY  45  -5.874   8.046   2.890
  305    HA3  GLY  45           HA1      GLY  45  -7.033   7.648   1.631
  306    H    ILE  46           HN       ILE  46  -4.340   6.574   2.175
  307    HA   ILE  46           HA       ILE  46  -2.966   7.352  -0.311
  308    HB   ILE  46           HB       ILE  46  -1.853   5.921   2.107
  309   HG12  ILE  46          HG12      ILE  46  -2.297   8.279   2.563
  310   HG13  ILE  46          HG11      ILE  46  -0.563   7.996   2.458
  311   HG21  ILE  46          HG21      ILE  46  -0.726   5.172   0.120
  312   HG22  ILE  46          HG22      ILE  46   0.338   6.267   1.003
  313   HG23  ILE  46          HG23      ILE  46  -0.513   6.833  -0.433
  314   HD11  ILE  46          HD13      ILE  46  -1.222  10.070   1.358
  315   HD12  ILE  46          HD11      ILE  46  -2.279   9.162   0.276
  316   HD13  ILE  46          HD12      ILE  46  -0.532   8.919   0.213
  317    H    TYR  47           HN       TYR  47  -2.771   5.919  -1.932
  318    HA   TYR  47           HA       TYR  47  -2.934   3.073  -1.436
  319    HD1  TYR  47           HD1      TYR  47  -5.648   6.109  -1.800
  320    HD2  TYR  47           HD2      TYR  47  -4.988   3.628  -5.193
  321    HE1  TYR  47           HE1      TYR  47  -6.558   7.869  -3.256
  322    HE2  TYR  47           HE2      TYR  47  -5.892   5.383  -6.659
  323    HH   TYR  47           HH       TYR  47  -6.448   8.569  -5.588
  324    HB2  TYR  47           HB2      TYR  47  -4.803   2.718  -3.012
  325    HB3  TYR  47           HB1      TYR  47  -5.296   3.638  -1.594
  326    H    VAL  48           HN       VAL  48  -1.843   1.894  -2.925
  327    HA   VAL  48           HA       VAL  48  -0.099   3.194  -4.716
  328    HB   VAL  48           HB       VAL  48  -0.898   0.278  -4.636
  329   HG11  VAL  48          HG11      VAL  48   1.438   1.632  -5.984
  330   HG12  VAL  48          HG12      VAL  48   0.085   0.827  -6.780
  331   HG13  VAL  48          HG13      VAL  48   1.228  -0.112  -5.822
  332   HG21  VAL  48          HG23      VAL  48   1.438   1.728  -3.397
  333   HG22  VAL  48          HG21      VAL  48   1.190  -0.019  -3.382
  334   HG23  VAL  48          HG22      VAL  48   0.061   1.040  -2.541
  335    H    LYS  49           HN       LYS  49  -0.523   4.058  -6.609
  336    HA   LYS  49           HA       LYS  49  -2.919   3.237  -8.076
  337    HB2  LYS  49           HB2      LYS  49  -2.740   5.607  -7.630
  338    HB3  LYS  49           HB1      LYS  49  -1.127   5.658  -8.322
  339    HG2  LYS  49           HG2      LYS  49  -3.282   4.696 -10.094
  340    HG3  LYS  49           HG1      LYS  49  -3.329   6.402  -9.643
  341    HD2  LYS  49           HD2      LYS  49  -0.938   6.570 -10.371
  342    HD3  LYS  49           HD1      LYS  49  -1.073   4.923 -10.991
  343    HE2  LYS  49           HE2      LYS  49  -2.879   5.629 -12.478
  344    HE3  LYS  49           HE1      LYS  49  -2.762   7.271 -11.847
  345    HZ1  LYS  49           HZ3      LYS  49  -0.606   5.827 -13.294
  346    HZ2  LYS  49           HZ1      LYS  49  -0.515   7.412 -12.710
  347    HZ3  LYS  49           HZ2      LYS  49  -1.596   7.031 -13.953
  348    H    SER  50           HN       SER  50   0.546   3.168  -8.241
  349    HA   SER  50           HA       SER  50   0.410   1.496 -10.601
  350    HG   SER  50           HG       SER  50   3.068   4.080 -10.398
  351    HB2  SER  50           HB2      SER  50   2.052   2.834 -11.873
  352    HB3  SER  50           HB1      SER  50   0.550   3.719 -11.607
  353    H    LEU  51           HN       LEU  51   2.516   0.530 -11.140
  354    HA   LEU  51           HA       LEU  51   4.314   0.409  -8.808
  355    HG   LEU  51           HG       LEU  51   1.775  -1.348  -8.872
  356    HB2  LEU  51           HB2      LEU  51   3.466  -1.860 -10.614
  357    HB3  LEU  51           HB1      LEU  51   4.687  -1.979  -9.362
  358   HD11  LEU  51          HD11      LEU  51   1.657  -3.612  -7.950
  359   HD12  LEU  51          HD12      LEU  51   3.320  -3.905  -8.461
  360   HD13  LEU  51          HD13      LEU  51   2.062  -3.629  -9.666
  361   HD21  LEU  51          HD23      LEU  51   3.224  -0.378  -7.186
  362   HD22  LEU  51          HD21      LEU  51   4.051  -1.922  -6.978
  363   HD23  LEU  51          HD22      LEU  51   2.357  -1.760  -6.517
  364    H    ILE  52           HN       ILE  52   6.532  -0.139  -9.277
  365    HA   ILE  52           HA       ILE  52   7.358   0.852 -11.907
  366    HB   ILE  52           HB       ILE  52   9.016   0.439  -9.416
  367   HG12  ILE  52          HG12      ILE  52   7.364   2.221  -9.118
  368   HG13  ILE  52          HG11      ILE  52   8.983   2.898  -9.244
  369   HG21  ILE  52          HG21      ILE  52  10.704   1.788 -10.604
  370   HG22  ILE  52          HG22      ILE  52   9.686   1.759 -12.043
  371   HG23  ILE  52          HG23      ILE  52  10.365   0.258 -11.412
  372   HD11  ILE  52          HD13      ILE  52   6.904   2.838 -11.419
  373   HD12  ILE  52          HD11      ILE  52   8.540   3.474 -11.589
  374   HD13  ILE  52          HD12      ILE  52   7.406   4.242 -10.478
  375    HA   PRO  53           HA       PRO  53   8.126  -3.476 -12.954
  376    HB2  PRO  53           HB2      PRO  53   9.229  -2.929 -15.411
  377    HB3  PRO  53           HB1      PRO  53   7.493  -3.059 -15.110
  378    HG2  PRO  53           HG2      PRO  53   9.207  -0.615 -15.308
  379    HG3  PRO  53           HG1      PRO  53   7.584  -0.901 -15.962
  380    HD2  PRO  53           HD2      PRO  53   7.964   0.534 -13.728
  381    HD3  PRO  53           HD1      PRO  53   6.557  -0.532 -13.918
  382    H    GLY  54           HN       GLY  54   9.799  -4.484 -12.055
  383    HA2  GLY  54           HA2      GLY  54  12.103  -5.185 -12.307
  384    HA3  GLY  54           HA1      GLY  54  12.514  -3.518 -12.681
  385    H    SER  55           HN       SER  55  10.287  -3.614 -10.183
  386    HA   SER  55           HA       SER  55  12.436  -3.229  -8.215
  387    HG   SER  55           HG       SER  55  11.210  -0.274  -8.069
  388    HB2  SER  55           HB2      SER  55   9.560  -2.280  -8.153
  389    HB3  SER  55           HB1      SER  55  10.766  -1.963  -6.906
  390    H    ALA  56           HN       ALA  56  11.241  -3.575  -5.859
  391    HA   ALA  56           HA       ALA  56  11.061  -6.397  -5.617
  392    HB1  ALA  56           HB3      ALA  56  11.973  -4.987  -3.839
  393    HB2  ALA  56           HB1      ALA  56  10.635  -5.974  -3.250
  394    HB3  ALA  56           HB2      ALA  56  10.384  -4.263  -3.595
  395    H    ALA  57           HN       ALA  57   8.665  -3.797  -5.314
  396    HA   ALA  57           HA       ALA  57   6.454  -5.342  -4.627
  397    HB1  ALA  57           HB3      ALA  57   5.103  -3.476  -5.458
  398    HB2  ALA  57           HB1      ALA  57   6.527  -2.801  -6.249
  399    HB3  ALA  57           HB2      ALA  57   6.465  -2.914  -4.490
  400    H    ALA  58           HN       ALA  58   7.754  -4.527  -7.817
  401    HA   ALA  58           HA       ALA  58   5.629  -5.705  -9.295
  402    HB1  ALA  58           HB3      ALA  58   7.062  -3.983 -10.253
  403    HB2  ALA  58           HB1      ALA  58   7.101  -5.450 -11.229
  404    HB3  ALA  58           HB2      ALA  58   8.448  -5.069 -10.156
  405    H    LEU  59           HN       LEU  59   8.963  -6.805  -8.645
  406    HA   LEU  59           HA       LEU  59   8.716  -9.297  -9.901
  407    HG   LEU  59           HG       LEU  59  10.909  -7.275  -9.838
  408    HB2  LEU  59           HB2      LEU  59  10.511  -8.407  -7.646
  409    HB3  LEU  59           HB1      LEU  59  10.667  -9.951  -8.462
  410   HD11  LEU  59          HD11      LEU  59  13.055  -9.172  -8.901
  411   HD12  LEU  59          HD12      LEU  59  12.719  -7.569  -8.247
  412   HD13  LEU  59          HD13      LEU  59  13.313  -7.741  -9.900
  413   HD21  LEU  59          HD23      LEU  59  11.851  -8.597 -11.671
  414   HD22  LEU  59          HD21      LEU  59  10.191  -9.073 -11.316
  415   HD23  LEU  59          HD22      LEU  59  11.532 -10.077 -10.766
  416    H    ASP  60           HN       ASP  60   7.463  -8.180  -6.911
  417    HA   ASP  60           HA       ASP  60   7.346 -10.588  -5.468
  418    HB2  ASP  60           HB2      ASP  60   6.914  -8.378  -4.460
  419    HB3  ASP  60           HB1      ASP  60   5.420  -8.255  -5.384
  420    H    GLY  61           HN       GLY  61   4.831  -9.014  -7.456
  421    HA2  GLY  61           HA2      GLY  61   3.551 -10.279  -9.055
  422    HA3  GLY  61           HA1      GLY  61   3.757 -11.696  -8.038
  423    H    ARG  62           HN       ARG  62   2.991 -10.841  -5.582
  424    HA   ARG  62           HA       ARG  62   0.165 -10.829  -5.804
  425    HE   ARG  62           HE       ARG  62   3.258 -11.910  -2.432
  426    HB2  ARG  62           HB2      ARG  62   2.001 -10.435  -3.442
  427    HB3  ARG  62           HB1      ARG  62   0.251 -10.508  -3.301
  428    HG2  ARG  62           HG2      ARG  62   0.247 -12.765  -4.187
  429    HG3  ARG  62           HG1      ARG  62   1.996 -12.697  -4.409
  430    HD2  ARG  62           HD2      ARG  62   0.593 -12.407  -1.757
  431    HD3  ARG  62           HD1      ARG  62   1.297 -13.909  -2.358
  432   HH11  ARG  62          HH11      ARG  62   1.416 -13.732  -0.100
  433   HH12  ARG  62          HH12      ARG  62   2.645 -13.660   1.117
  434   HH21  ARG  62          HH21      ARG  62   4.880 -11.814  -0.838
  435   HH22  ARG  62          HH22      ARG  62   4.617 -12.575   0.695
  436    H    ILE  63           HN       ILE  63   2.528  -8.319  -5.598
  437    HA   ILE  63           HA       ILE  63   0.754  -6.287  -4.621
  438    HB   ILE  63           HB       ILE  63   3.360  -5.919  -6.099
  439   HG12  ILE  63          HG12      ILE  63   3.659  -7.333  -4.104
  440   HG13  ILE  63          HG11      ILE  63   4.415  -5.757  -3.893
  441   HG21  ILE  63          HG21      ILE  63   2.029  -3.904  -6.033
  442   HG22  ILE  63          HG22      ILE  63   3.404  -3.744  -4.941
  443   HG23  ILE  63          HG23      ILE  63   1.799  -4.079  -4.294
  444   HD11  ILE  63          HD13      ILE  63   2.515  -5.031  -2.544
  445   HD12  ILE  63          HD11      ILE  63   3.283  -6.470  -1.874
  446   HD13  ILE  63          HD12      ILE  63   1.762  -6.611  -2.756
  447    H    GLU  64           HN       GLU  64  -0.743  -5.231  -5.735
  448    HA   GLU  64           HA       GLU  64  -0.581  -5.259  -8.673
  449    HB2  GLU  64           HB2      GLU  64  -2.785  -5.695  -6.793
  450    HB3  GLU  64           HB1      GLU  64  -3.176  -4.563  -8.081
  451    HG2  GLU  64           HG2      GLU  64  -3.816  -6.801  -8.712
  452    HG3  GLU  64           HG1      GLU  64  -2.502  -6.230  -9.741
  453    HA   PRO  65           HA       PRO  65  -0.389  -0.846  -8.639
  454    HB2  PRO  65           HB2      PRO  65  -1.739  -0.624 -11.178
  455    HB3  PRO  65           HB1      PRO  65  -0.010  -0.522 -10.844
  456    HG2  PRO  65           HG2      PRO  65  -1.187  -2.564 -12.248
  457    HG3  PRO  65           HG1      PRO  65   0.345  -2.714 -11.370
  458    HD2  PRO  65           HD2      PRO  65  -2.402  -3.577 -10.558
  459    HD3  PRO  65           HD1      PRO  65  -0.843  -4.397 -10.321
  460    H    ASN  66           HN       ASN  66  -2.749  -1.961  -7.334
  461    HA   ASN  66           HA       ASN  66  -4.340   0.382  -7.231
  462    HB2  ASN  66           HB2      ASN  66  -6.489  -0.712  -7.968
  463    HB3  ASN  66           HB1      ASN  66  -5.345  -0.376  -9.263
  464   HD21  ASN  66          HD21      ASN  66  -4.242  -2.090 -10.236
  465   HD22  ASN  66          HD22      ASN  66  -4.798  -3.720 -10.103
  466    H    ASP  67           HN       ASP  67  -3.506  -0.105  -5.064
  467    HA   ASP  67           HA       ASP  67  -5.449  -1.721  -3.588
  468    HB2  ASP  67           HB2      ASP  67  -2.453  -2.031  -3.304
  469    HB3  ASP  67           HB1      ASP  67  -3.639  -2.724  -2.202
  470    H    LYS  68           HN       LYS  68  -5.725  -1.101  -1.402
  471    HA   LYS  68           HA       LYS  68  -4.939   1.662  -0.921
  472    HB2  LYS  68           HB2      LYS  68  -7.288   1.062  -0.618
  473    HB3  LYS  68           HB1      LYS  68  -6.841  -0.138   0.585
  474    HG2  LYS  68           HG2      LYS  68  -6.009   1.615   2.051
  475    HG3  LYS  68           HG1      LYS  68  -6.413   2.832   0.838
  476    HD2  LYS  68           HD2      LYS  68  -8.778   2.208   1.009
  477    HD3  LYS  68           HD1      LYS  68  -8.368   0.996   2.226
  478    HE2  LYS  68           HE2      LYS  68  -7.530   2.751   3.701
  479    HE3  LYS  68           HE1      LYS  68  -7.910   3.968   2.482
  480    HZ1  LYS  68           HZ3      LYS  68  -9.865   2.224   3.882
  481    HZ2  LYS  68           HZ1      LYS  68 -10.253   3.340   2.671
  482    HZ3  LYS  68           HZ2      LYS  68  -9.632   3.878   4.149
  483    H    ILE  69           HN       ILE  69  -3.122   2.069   0.136
  484    HA   ILE  69           HA       ILE  69  -1.919   0.076   1.857
  485    HB   ILE  69           HB       ILE  69  -0.967   2.885   1.287
  486   HG12  ILE  69          HG12      ILE  69  -1.168   1.603  -0.790
  487   HG13  ILE  69          HG11      ILE  69   0.524   1.857  -0.377
  488   HG21  ILE  69          HG21      ILE  69   0.023   1.919   3.282
  489   HG22  ILE  69          HG22      ILE  69   1.220   2.021   1.991
  490   HG23  ILE  69          HG23      ILE  69   0.473   0.472   2.380
  491   HD11  ILE  69          HD13      ILE  69   0.659  -0.420   0.485
  492   HD12  ILE  69          HD11      ILE  69   0.138  -0.395  -1.200
  493   HD13  ILE  69          HD12      ILE  69  -1.039  -0.673   0.082
  494    H    LEU  70           HN       LEU  70  -1.781   0.134   4.047
  495    HA   LEU  70           HA       LEU  70  -3.178   2.347   5.402
  496    HG   LEU  70           HG       LEU  70  -4.539  -0.283   4.389
  497    HB2  LEU  70           HB2      LEU  70  -2.963  -0.527   6.304
  498    HB3  LEU  70           HB1      LEU  70  -3.826   0.754   7.133
  499   HD11  LEU  70          HD11      LEU  70  -4.884  -1.994   6.088
  500   HD12  LEU  70          HD12      LEU  70  -6.425  -1.371   5.499
  501   HD13  LEU  70          HD13      LEU  70  -5.804  -0.851   7.066
  502   HD21  LEU  70          HD23      LEU  70  -5.209   2.030   4.759
  503   HD22  LEU  70          HD21      LEU  70  -5.996   1.572   6.270
  504   HD23  LEU  70          HD22      LEU  70  -6.615   0.966   4.734
  505    H    ARG  71           HN       ARG  71  -0.924  -0.280   6.273
  506    HA   ARG  71           HA       ARG  71   0.765   1.732   7.593
  507    HE   ARG  71           HE       ARG  71  -2.904   1.115  11.114
  508    HB2  ARG  71           HB2      ARG  71   0.176  -1.006   8.719
  509    HB3  ARG  71           HB1      ARG  71   1.109   0.272   9.481
  510    HG2  ARG  71           HG2      ARG  71  -0.864   1.627   9.738
  511    HG3  ARG  71           HG1      ARG  71  -1.827   0.450   8.841
  512    HD2  ARG  71           HD2      ARG  71  -1.378  -1.224  10.577
  513    HD3  ARG  71           HD1      ARG  71  -0.438  -0.033  11.475
  514   HH11  ARG  71          HH11      ARG  71  -1.698  -1.817  12.562
  515   HH12  ARG  71          HH12      ARG  71  -2.964  -1.911  13.739
  516   HH21  ARG  71          HH21      ARG  71  -4.579   0.997  12.660
  517   HH22  ARG  71          HH22      ARG  71  -4.605  -0.313  13.791
  518    H    VAL  72           HN       VAL  72   2.963   0.961   8.047
  519    HA   VAL  72           HA       VAL  72   3.896  -1.087   6.149
  520    HB   VAL  72           HB       VAL  72   5.315   1.525   6.737
  521   HG11  VAL  72          HG11      VAL  72   5.971  -0.701   4.813
  522   HG12  VAL  72          HG12      VAL  72   6.892  -0.233   6.244
  523   HG13  VAL  72          HG13      VAL  72   6.786   0.862   4.867
  524   HG21  VAL  72          HG23      VAL  72   4.766   2.141   4.433
  525   HG22  VAL  72          HG21      VAL  72   3.313   1.896   5.402
  526   HG23  VAL  72          HG22      VAL  72   3.831   0.655   4.262
  527    H    ASP  73           HN       ASP  73   6.176  -1.825   6.752
  528    HA   ASP  73           HA       ASP  73   6.273  -3.103   9.122
  529    HB2  ASP  73           HB2      ASP  73   7.898  -3.197   7.136
  530    HB3  ASP  73           HB1      ASP  73   8.789  -1.928   7.969
  531    H    ASP  74           HN       ASP  74   5.892  -2.301  11.070
  532    HA   ASP  74           HA       ASP  74   6.068  -1.125  12.996
  533    HB2  ASP  74           HB2      ASP  74   8.857  -0.700  11.931
  534    HB3  ASP  74           HB1      ASP  74   8.352  -0.262  13.559
  535    H    VAL  75           HN       VAL  75   5.858   0.470  10.152
  536    HA   VAL  75           HA       VAL  75   5.503   3.024  11.533
  537    HB   VAL  75           HB       VAL  75   7.123   2.744   8.996
  538   HG11  VAL  75          HG11      VAL  75   7.411   5.191   9.169
  539   HG12  VAL  75          HG12      VAL  75   6.249   5.213  10.496
  540   HG13  VAL  75          HG13      VAL  75   5.735   4.723   8.881
  541   HG21  VAL  75          HG23      VAL  75   8.952   3.693  10.327
  542   HG22  VAL  75          HG21      VAL  75   8.392   2.158  10.990
  543   HG23  VAL  75          HG22      VAL  75   7.917   3.675  11.754
  544    H    ASN  76           HN       ASN  76   3.429   3.512  11.183
  545    HA   ASN  76           HA       ASN  76   1.938   2.531   8.974
  546    HB2  ASN  76           HB2      ASN  76   1.289   4.763  10.915
  547    HB3  ASN  76           HB1      ASN  76   0.145   4.030   9.795
  548   HD21  ASN  76          HD21      ASN  76  -1.203   3.327  11.429
  549   HD22  ASN  76          HD22      ASN  76  -0.789   2.018  12.477
  550    H    VAL  77           HN       VAL  77   0.776   3.981   7.407
  551    HA   VAL  77           HA       VAL  77   2.363   6.355   6.707
  552    HB   VAL  77           HB       VAL  77   2.061   5.705   4.270
  553   HG11  VAL  77          HG11      VAL  77   4.052   4.278   4.270
  554   HG12  VAL  77          HG12      VAL  77   3.856   4.010   6.002
  555   HG13  VAL  77          HG13      VAL  77   4.217   5.625   5.396
  556   HG21  VAL  77          HG23      VAL  77   1.537   3.010   5.520
  557   HG22  VAL  77          HG21      VAL  77   1.831   3.307   3.806
  558   HG23  VAL  77          HG22      VAL  77   0.390   3.966   4.581
  559    H    GLN  78           HN       GLN  78  -0.590   5.196   7.476
  560    HA   GLN  78           HA       GLN  78  -2.099   6.823   5.600
  561    HB2  GLN  78           HB2      GLN  78  -3.248   4.853   5.941
  562    HB3  GLN  78           HB1      GLN  78  -2.752   4.728   7.623
  563    HG2  GLN  78           HG2      GLN  78  -4.325   6.386   8.279
  564    HG3  GLN  78           HG1      GLN  78  -4.726   6.747   6.602
  565   HE21  GLN  78          HE21      GLN  78  -5.985   5.286   5.430
  566   HE22  GLN  78          HE22      GLN  78  -6.930   4.065   6.204
  567    H    GLY  79           HN       GLY  79  -2.147   8.932   6.021
  568    HA2  GLY  79           HA2      GLY  79  -3.377  10.505   7.543
  569    HA3  GLY  79           HA1      GLY  79  -2.434   9.782   8.836
  570    H    MET  80           HN       MET  80  -0.216   9.717   6.603
  571    HA   MET  80           HA       MET  80   0.759  12.419   7.227
  572    HB2  MET  80           HB2      MET  80   2.235   9.888   6.499
  573    HB3  MET  80           HB1      MET  80   3.012  11.457   6.648
  574    HG2  MET  80           HG2      MET  80   2.329  11.579   8.987
  575    HG3  MET  80           HG1      MET  80   1.540  10.010   8.839
  576    HE1  MET  80           HE3      MET  80   3.616   8.325   7.058
  577    HE2  MET  80           HE1      MET  80   2.754   7.765   8.492
  578    HE3  MET  80           HE2      MET  80   4.503   7.557   8.377
  579    H    ALA  81           HN       ALA  81   2.009  13.545   5.581
  580    HA   ALA  81           HA       ALA  81   0.656  13.673   3.112
  581    HB1  ALA  81           HB3      ALA  81   1.801  15.592   4.133
  582    HB2  ALA  81           HB1      ALA  81   2.323  15.315   2.471
  583    HB3  ALA  81           HB2      ALA  81   3.355  14.822   3.814
  584    H    GLN  82           HN       GLN  82   1.679  13.464   0.957
  585    HA   GLN  82           HA       GLN  82   2.565  10.868   0.478
  586    HB2  GLN  82           HB2      GLN  82   1.511  12.235  -1.245
  587    HB3  GLN  82           HB1      GLN  82   2.886  13.329  -1.247
  588    HG2  GLN  82           HG2      GLN  82   4.322  11.554  -2.078
  589    HG3  GLN  82           HG1      GLN  82   2.969  10.425  -2.037
  590   HE21  GLN  82          HE21      GLN  82   1.330  10.607  -3.562
  591   HE22  GLN  82          HE22      GLN  82   1.519  11.530  -5.010
  592    H    SER  83           HN       SER  83   4.428  13.886   0.645
  593    HA   SER  83           HA       SER  83   6.924  12.922  -0.054
  594    HG   SER  83           HG       SER  83   6.596  14.839   3.052
  595    HB2  SER  83           HB2      SER  83   7.849  14.814   1.222
  596    HB3  SER  83           HB1      SER  83   6.450  15.307   0.266
  597    H    ASP  84           HN       ASP  84   5.328  12.867   3.104
  598    HA   ASP  84           HA       ASP  84   7.531  11.857   4.558
  599    HB2  ASP  84           HB2      ASP  84   4.563  11.671   5.114
  600    HB3  ASP  84           HB1      ASP  84   5.822  11.231   6.263
  601    H    VAL  85           HN       VAL  85   4.789  10.266   2.972
  602    HA   VAL  85           HA       VAL  85   5.285   7.653   3.820
  603    HB   VAL  85           HB       VAL  85   4.112   8.516   1.172
  604   HG11  VAL  85          HG11      VAL  85   3.857   5.926   2.696
  605   HG12  VAL  85          HG12      VAL  85   4.739   6.166   1.187
  606   HG13  VAL  85          HG13      VAL  85   2.984   6.339   1.220
  607   HG21  VAL  85          HG23      VAL  85   2.950   9.536   3.060
  608   HG22  VAL  85          HG21      VAL  85   2.759   7.951   3.808
  609   HG23  VAL  85          HG22      VAL  85   1.944   8.310   2.287
  610    H    VAL  86           HN       VAL  86   6.601   9.455   1.072
  611    HA   VAL  86           HA       VAL  86   7.957   7.259  -0.101
  612    HB   VAL  86           HB       VAL  86   8.578  10.207  -0.341
  613   HG11  VAL  86          HG11      VAL  86  10.461   8.832  -1.030
  614   HG12  VAL  86          HG12      VAL  86   9.699   9.575  -2.436
  615   HG13  VAL  86          HG13      VAL  86   9.405   7.875  -2.069
  616   HG21  VAL  86          HG23      VAL  86   6.286   9.646  -1.013
  617   HG22  VAL  86          HG21      VAL  86   6.914   8.418  -2.112
  618   HG23  VAL  86          HG22      VAL  86   7.272  10.121  -2.396
  619    H    GLU  87           HN       GLU  87   8.977   9.791   2.166
  620    HA   GLU  87           HA       GLU  87  11.691   9.169   2.284
  621    HB2  GLU  87           HB2      GLU  87   9.850  10.309   4.386
  622    HB3  GLU  87           HB1      GLU  87  11.591  10.191   4.591
  623    HG2  GLU  87           HG2      GLU  87  11.951  11.652   2.702
  624    HG3  GLU  87           HG1      GLU  87  10.216  11.714   2.389
  625    H    VAL  88           HN       VAL  88   8.979   7.867   4.156
  626    HA   VAL  88           HA       VAL  88  10.462   6.245   5.899
  627    HB   VAL  88           HB       VAL  88   7.653   5.924   4.843
  628   HG11  VAL  88          HG11      VAL  88   7.296   4.356   6.710
  629   HG12  VAL  88          HG12      VAL  88   9.024   4.408   7.061
  630   HG13  VAL  88          HG13      VAL  88   8.455   3.745   5.527
  631   HG21  VAL  88          HG23      VAL  88   7.014   6.765   7.057
  632   HG22  VAL  88          HG21      VAL  88   8.014   7.924   6.180
  633   HG23  VAL  88          HG22      VAL  88   8.719   6.951   7.471
  634    H    LEU  89           HN       LEU  89   8.775   5.348   2.894
  635    HA   LEU  89           HA       LEU  89   9.520   2.695   2.772
  636    HG   LEU  89           HG       LEU  89   7.123   4.376   1.950
  637    HB2  LEU  89           HB2      LEU  89   9.131   4.633   0.489
  638    HB3  LEU  89           HB1      LEU  89   9.182   2.890   0.320
  639   HD11  LEU  89          HD11      LEU  89   6.910   3.201  -0.818
  640   HD12  LEU  89          HD12      LEU  89   6.891   4.918  -0.410
  641   HD13  LEU  89          HD13      LEU  89   5.578   3.869   0.125
  642   HD21  LEU  89          HD23      LEU  89   7.283   1.498   1.060
  643   HD22  LEU  89          HD21      LEU  89   5.936   2.236   1.929
  644   HD23  LEU  89          HD22      LEU  89   7.514   2.092   2.705
  645    H    ARG  90           HN       ARG  90  11.415   5.531   2.099
  646    HA   ARG  90           HA       ARG  90  13.528   4.008   0.808
  647    HE   ARG  90           HE       ARG  90  12.225   8.666   0.422
  648    HB2  ARG  90           HB2      ARG  90  13.312   6.937   1.515
  649    HB3  ARG  90           HB1      ARG  90  14.675   6.216   0.670
  650    HG2  ARG  90           HG2      ARG  90  13.179   5.541  -1.151
  651    HG3  ARG  90           HG1      ARG  90  11.829   6.304  -0.309
  652    HD2  ARG  90           HD2      ARG  90  14.311   7.684  -1.324
  653    HD3  ARG  90           HD1      ARG  90  12.705   7.766  -2.046
  654   HH11  ARG  90          HH11      ARG  90  14.737   9.460  -1.860
  655   HH12  ARG  90          HH12      ARG  90  14.910  11.090  -1.299
  656   HH21  ARG  90          HH21      ARG  90  12.444  10.814   1.164
  657   HH22  ARG  90          HH22      ARG  90  13.606  11.859   0.419
  658    H    ASN  91           HN       ASN  91  12.771   5.348   3.931
  659    HA   ASN  91           HA       ASN  91  15.430   5.214   4.976
  660    HB2  ASN  91           HB2      ASN  91  12.730   5.452   6.312
  661    HB3  ASN  91           HB1      ASN  91  14.250   5.453   7.200
  662   HD21  ASN  91          HD21      ASN  91  12.192   7.517   6.931
  663   HD22  ASN  91          HD22      ASN  91  13.004   8.915   6.324
  664    H    ALA  92           HN       ALA  92  13.035   2.920   4.315
  665    HA   ALA  92           HA       ALA  92  13.296   1.035   6.325
  666    HB1  ALA  92           HB3      ALA  92  11.637   0.880   4.541
  667    HB2  ALA  92           HB1      ALA  92  12.564  -0.613   4.679
  668    HB3  ALA  92           HB2      ALA  92  12.913   0.524   3.377
  669    H    GLY  93           HN       GLY  93  14.755   0.333   3.170
  670    HA2  GLY  93           HA2      GLY  93  16.767  -0.629   2.611
  671    HA3  GLY  93           HA1      GLY  93  17.435   0.204   4.008
  672    H    ASN  94           HN       ASN  94  14.817  -1.888   4.650
  673    HA   ASN  94           HA       ASN  94  16.512  -4.188   5.221
  674    HB2  ASN  94           HB2      ASN  94  15.467  -4.246   7.581
  675    HB3  ASN  94           HB1      ASN  94  16.778  -3.108   7.291
  676   HD21  ASN  94          HD21      ASN  94  13.531  -2.634   6.092
  677   HD22  ASN  94          HD22      ASN  94  13.141  -1.302   7.115
  678    HA   PRO  95           HA       PRO  95  12.949  -6.702   4.367
  679    HB2  PRO  95           HB2      PRO  95  12.985  -7.824   7.119
  680    HB3  PRO  95           HB1      PRO  95  13.047  -8.660   5.565
  681    HG2  PRO  95           HG2      PRO  95  15.226  -8.440   7.077
  682    HG3  PRO  95           HG1      PRO  95  15.323  -8.301   5.312
  683    HD2  PRO  95           HD2      PRO  95  15.406  -6.155   7.391
  684    HD3  PRO  95           HD1      PRO  95  16.317  -6.290   5.872
  685    H    VAL  96           HN       VAL  96  11.224  -5.317   4.208
  686    HA   VAL  96           HA       VAL  96   9.819  -4.624   6.703
  687    HB   VAL  96           HB       VAL  96   8.773  -2.778   5.407
  688   HG11  VAL  96          HG11      VAL  96  10.742  -1.328   5.409
  689   HG12  VAL  96          HG12      VAL  96  11.787  -2.747   5.500
  690   HG13  VAL  96          HG13      VAL  96  10.701  -2.365   6.836
  691   HG21  VAL  96          HG23      VAL  96   9.799  -2.113   3.273
  692   HG22  VAL  96          HG21      VAL  96   9.010  -3.687   3.168
  693   HG23  VAL  96          HG22      VAL  96  10.766  -3.587   3.292
  694    H    ARG  97           HN       ARG  97   7.525  -4.619   6.701
  695    HA   ARG  97           HA       ARG  97   6.345  -6.512   4.783
  696    HE   ARG  97           HE       ARG  97   4.050  -6.156   8.855
  697    HB2  ARG  97           HB2      ARG  97   6.374  -7.331   7.099
  698    HB3  ARG  97           HB1      ARG  97   5.519  -5.890   7.628
  699    HG2  ARG  97           HG2      ARG  97   3.599  -6.546   6.232
  700    HG3  ARG  97           HG1      ARG  97   4.459  -8.021   5.784
  701    HD2  ARG  97           HD2      ARG  97   2.867  -8.451   7.578
  702    HD3  ARG  97           HD1      ARG  97   4.524  -8.702   8.128
  703   HH11  ARG  97          HH11      ARG  97   2.253  -9.106   9.322
  704   HH12  ARG  97          HH12      ARG  97   1.553  -8.591  10.820
  705   HH21  ARG  97          HH21      ARG  97   3.130  -5.472  10.824
  706   HH22  ARG  97          HH22      ARG  97   2.048  -6.525  11.672
  707    H    LEU  98           HN       LEU  98   4.346  -6.031   3.870
  708    HA   LEU  98           HA       LEU  98   3.547  -3.208   4.104
  709    HG   LEU  98           HG       LEU  98   5.435  -4.693   2.001
  710    HB2  LEU  98           HB2      LEU  98   2.964  -5.073   1.813
  711    HB3  LEU  98           HB1      LEU  98   2.744  -3.335   1.854
  712   HD11  LEU  98          HD11      LEU  98   5.698  -3.970  -0.336
  713   HD12  LEU  98          HD12      LEU  98   4.010  -3.463  -0.354
  714   HD13  LEU  98          HD13      LEU  98   4.417  -5.166  -0.141
  715   HD21  LEU  98          HD23      LEU  98   6.282  -2.453   1.458
  716   HD22  LEU  98          HD21      LEU  98   5.408  -2.474   2.991
  717   HD23  LEU  98          HD22      LEU  98   4.638  -1.820   1.544
  718    H    LEU  99           HN       LEU  99   1.640  -2.783   4.996
  719    HA   LEU  99           HA       LEU  99  -0.346  -4.950   5.162
  720    HG   LEU  99           HG       LEU  99  -2.396  -3.555   6.844
  721    HB2  LEU  99           HB2      LEU  99   0.545  -4.055   7.318
  722    HB3  LEU  99           HB1      LEU  99  -0.126  -2.490   6.900
  723   HD11  LEU  99          HD11      LEU  99  -2.676  -5.723   7.930
  724   HD12  LEU  99          HD12      LEU  99  -0.925  -5.888   8.064
  725   HD13  LEU  99          HD13      LEU  99  -1.688  -5.858   6.474
  726   HD21  LEU  99          HD23      LEU  99  -0.874  -3.731   9.443
  727   HD22  LEU  99          HD21      LEU  99  -2.629  -3.656   9.279
  728   HD23  LEU  99          HD22      LEU  99  -1.638  -2.286   8.779
  729    H    LEU 100           HN       LEU 100  -1.623  -4.692   3.413
  730    HA   LEU 100           HA       LEU 100  -2.957  -2.088   3.118
  731    HG   LEU 100           HG       LEU 100  -0.441  -4.089   1.513
  732    HB2  LEU 100           HB2      LEU 100  -3.024  -2.819   0.588
  733    HB3  LEU 100           HB1      LEU 100  -1.658  -1.943   1.253
  734   HD11  LEU 100          HD11      LEU 100  -2.814  -5.237   0.053
  735   HD12  LEU 100          HD12      LEU 100  -2.321  -5.603   1.706
  736   HD13  LEU 100          HD13      LEU 100  -1.293  -6.077   0.355
  737   HD21  LEU 100          HD23      LEU 100  -0.024  -2.753  -0.441
  738   HD22  LEU 100          HD21      LEU 100  -1.439  -3.425  -1.251
  739   HD23  LEU 100          HD22      LEU 100  -0.050  -4.454  -0.904
  740    H    ILE 101           HN       ILE 101  -5.035  -2.196   2.006
  741    HA   ILE 101           HA       ILE 101  -6.385  -4.773   2.468
  742    HB   ILE 101           HB       ILE 101  -7.181  -3.124   4.038
  743   HG12  ILE 101          HG12      ILE 101  -9.222  -3.452   1.825
  744   HG13  ILE 101          HG11      ILE 101  -8.827  -4.690   3.013
  745   HG21  ILE 101          HG21      ILE 101  -7.787  -1.394   1.645
  746   HG22  ILE 101          HG22      ILE 101  -6.519  -1.116   2.839
  747   HG23  ILE 101          HG23      ILE 101  -8.215  -1.028   3.315
  748   HD11  ILE 101          HD13      ILE 101 -10.879  -3.493   3.572
  749   HD12  ILE 101          HD11      ILE 101  -9.977  -1.980   3.638
  750   HD13  ILE 101          HD12      ILE 101  -9.634  -3.263   4.798
  751    H    ARG 102           HN       ARG 102  -7.762  -5.558   0.925
  752    HA   ARG 102           HA       ARG 102  -8.219  -3.978  -1.495
  753    HE   ARG 102           HE       ARG 102  -8.401  -5.972  -5.764
  754    HB2  ARG 102           HB2      ARG 102  -6.212  -5.236  -2.000
  755    HB3  ARG 102           HB1      ARG 102  -6.959  -6.724  -1.442
  756    HG2  ARG 102           HG2      ARG 102  -6.928  -6.697  -3.840
  757    HG3  ARG 102           HG1      ARG 102  -8.595  -6.559  -3.280
  758    HD2  ARG 102           HD2      ARG 102  -8.476  -4.120  -3.617
  759    HD3  ARG 102           HD1      ARG 102  -6.836  -4.303  -4.237
  760   HH11  ARG 102          HH11      ARG 102  -8.286  -2.559  -5.063
  761   HH12  ARG 102          HH12      ARG 102  -8.954  -2.092  -6.592
  762   HH21  ARG 102          HH21      ARG 102  -9.286  -5.366  -7.774
  763   HH22  ARG 102          HH22      ARG 102  -9.525  -3.688  -8.131
  764    H    ARG 103           HN       ARG 103 -10.213  -4.233  -2.303
  765    HA   ARG 103           HA       ARG 103 -12.105  -5.862  -0.908
  766    HE   ARG 103           HE       ARG 103 -14.168  -2.421  -2.037
  767    HB2  ARG 103           HB2      ARG 103 -12.633  -3.629  -1.900
  768    HB3  ARG 103           HB1      ARG 103 -12.477  -4.346  -3.498
  769    HG2  ARG 103           HG2      ARG 103 -14.307  -5.921  -2.904
  770    HG3  ARG 103           HG1      ARG 103 -14.514  -5.034  -1.393
  771    HD2  ARG 103           HD2      ARG 103 -14.808  -3.919  -4.180
  772    HD3  ARG 103           HD1      ARG 103 -16.118  -4.279  -3.054
  773   HH11  ARG 103          HH11      ARG 103 -17.118  -2.788  -3.858
  774   HH12  ARG 103          HH12      ARG 103 -17.648  -1.165  -3.570
  775   HH21  ARG 103          HH21      ARG 103 -14.855  -0.284  -1.658
  776   HH22  ARG 103          HH22      ARG 103 -16.359   0.261  -2.321
  777    H    LEU 104           HN       LEU 104 -13.191  -7.682  -1.612
  778    HA   LEU 104           HA       LEU 104 -11.782  -9.259  -3.594
  779    HG   LEU 104           HG       LEU 104 -11.885  -9.574  -0.627
  780    HB2  LEU 104           HB2      LEU 104 -14.102  -9.958  -1.793
  781    HB3  LEU 104           HB1      LEU 104 -13.262 -11.090  -2.837
  782   HD11  LEU 104          HD11      LEU 104 -13.097 -12.334  -0.564
  783   HD12  LEU 104          HD12      LEU 104 -13.625 -10.933   0.368
  784   HD13  LEU 104          HD13      LEU 104 -12.045 -11.652   0.677
  785   HD21  LEU 104          HD23      LEU 104 -11.122 -12.039  -2.187
  786   HD22  LEU 104          HD21      LEU 104 -10.186 -11.309  -0.884
  787   HD23  LEU 104          HD22      LEU 104 -10.434 -10.429  -2.392
  788    HA   PRO 105           HA       PRO 105 -14.811  -8.453  -6.755
  789    HB2  PRO 105           HB2      PRO 105 -14.001 -10.174  -8.609
  790    HB3  PRO 105           HB1      PRO 105 -12.942  -8.846  -8.109
  791    HG2  PRO 105           HG2      PRO 105 -12.934 -11.707  -7.198
  792    HG3  PRO 105           HG1      PRO 105 -11.564 -10.722  -7.752
  793    HD2  PRO 105           HD2      PRO 105 -12.155 -11.108  -5.121
  794    HD3  PRO 105           HD1      PRO 105 -11.385  -9.627  -5.731
  795    H    LEU 106           HN       LEU 106 -16.174  -9.625  -4.893
  796    HA   LEU 106           HA       LEU 106 -17.034 -12.269  -5.261
  797    HG   LEU 106           HG       LEU 106 -16.424 -10.486  -2.863
  798    HB2  LEU 106           HB2      LEU 106 -18.526  -9.919  -4.088
  799    HB3  LEU 106           HB1      LEU 106 -19.019 -11.594  -3.937
  800   HD11  LEU 106          HD11      LEU 106 -18.998 -11.108  -1.424
  801   HD12  LEU 106          HD12      LEU 106 -18.328  -9.502  -1.704
  802   HD13  LEU 106          HD13      LEU 106 -17.476 -10.644  -0.666
  803   HD21  LEU 106          HD23      LEU 106 -16.319 -12.597  -1.644
  804   HD22  LEU 106          HD21      LEU 106 -16.355 -12.872  -3.385
  805   HD23  LEU 106          HD22      LEU 106 -17.809 -13.129  -2.423
  806    H    LEU 107           HN       LEU 107 -17.921 -13.071  -7.043
  807    HA   LEU 107           HA       LEU 107 -19.214 -11.476  -9.008
  808    HG   LEU 107           HG       LEU 107 -16.920 -13.704  -8.945
  809    HB2  LEU 107           HB2      LEU 107 -19.225 -14.477  -8.686
  810    HB3  LEU 107           HB1      LEU 107 -19.697 -13.598 -10.127
  811   HD11  LEU 107          HD11      LEU 107 -18.043 -14.868 -11.486
  812   HD12  LEU 107          HD12      LEU 107 -17.607 -15.775 -10.038
  813   HD13  LEU 107          HD13      LEU 107 -16.360 -14.941 -10.965
  814   HD21  LEU 107          HD23      LEU 107 -17.331 -11.537  -9.958
  815   HD22  LEU 107          HD21      LEU 107 -17.939 -12.314 -11.421
  816   HD23  LEU 107          HD22      LEU 107 -16.243 -12.487 -10.968
  817    H    GLU 108           HN       GLU 108 -21.284 -10.937  -9.245
  818    HA   GLU 108           HA       GLU 108 -23.498 -10.666  -8.812
  819    HB2  GLU 108           HB2      GLU 108 -23.352 -13.609  -8.127
  820    HB3  GLU 108           HB1      GLU 108 -24.823 -12.706  -8.459
  821    HG2  GLU 108           HG2      GLU 108 -24.063 -12.283 -10.734
  822    HG3  GLU 108           HG1      GLU 108 -22.573 -13.166 -10.405
  Start of MODEL   21
    1    H1   GLY   1           HT1      GLY   1  -4.403 -16.763   8.289
    2    H2   GLY   1           HT2      GLY   1  -4.138 -18.355   8.796
    3    H3   GLY   1           HT3      GLY   1  -4.745 -17.212   9.885
    4    HA2  GLY   1           HA1      GLY   1  -6.144 -18.221   7.469
    5    HA3  GLY   1           HA2      GLY   1  -6.496 -18.696   9.123
    6    H    SER   2           HN       SER   2  -6.585 -16.458  10.536
    7    HA   SER   2           HA       SER   2  -8.575 -14.778   9.155
    8    HG   SER   2           HG       SER   2  -8.445 -15.363  13.028
    9    HB2  SER   2           HB2      SER   2  -9.523 -14.426  11.503
   10    HB3  SER   2           HB1      SER   2  -9.792 -16.009  10.770
   11    H    HIS   3           HN       HIS   3  -8.717 -12.573   9.816
   12    HA   HIS   3           HA       HIS   3  -6.522 -11.516  11.410
   13    HD1  HIS   3           HD1      HIS   3  -3.694 -10.524  10.159
   14    HD2  HIS   3           HD2      HIS   3  -5.773 -13.226   7.784
   15    HE1  HIS   3           HE1      HIS   3  -1.972 -12.164   9.342
   16    HE2  HIS   3           HE2      HIS   3  -3.265 -13.831   7.965
   17    HB2  HIS   3           HB2      HIS   3  -7.008 -10.782   8.519
   18    HB3  HIS   3           HB1      HIS   3  -6.068  -9.776   9.618
   19    H    GLY   4           HN       GLY   4  -9.714 -11.555  10.584
   20    HA2  GLY   4           HA2      GLY   4 -10.988 -10.086  12.237
   21    HA3  GLY   4           HA1      GLY   4 -10.155  -8.764  11.433
   22    H    TYR   5           HN       TYR   5 -10.387  -8.969   8.905
   23    HA   TYR   5           HA       TYR   5 -13.268  -9.253   8.389
   24    HD1  TYR   5           HD1      TYR   5 -14.711  -6.971   7.924
   25    HD2  TYR   5           HD2      TYR   5 -10.638  -6.009   8.691
   26    HE1  TYR   5           HE1      TYR   5 -15.428  -5.123   9.381
   27    HE2  TYR   5           HE2      TYR   5 -11.344  -4.160  10.151
   28    HH   TYR   5           HH       TYR   5 -14.515  -3.803  11.264
   29    HB2  TYR   5           HB2      TYR   5 -11.163  -7.574   7.016
   30    HB3  TYR   5           HB1      TYR   5 -12.813  -7.746   6.428
   31    H    SER   6           HN       SER   6 -13.954 -10.813   7.081
   32    HA   SER   6           HA       SER   6 -12.046 -12.001   5.182
   33    HG   SER   6           HG       SER   6 -13.840 -14.940   5.388
   34    HB2  SER   6           HB2      SER   6 -12.292 -13.506   7.101
   35    HB3  SER   6           HB1      SER   6 -14.044 -13.497   6.897
   36    H    ASP   7           HN       ASP   7 -12.856 -11.000   3.388
   37    HA   ASP   7           HA       ASP   7 -14.232 -10.577   1.632
   38    HB2  ASP   7           HB2      ASP   7 -14.193 -13.045   1.489
   39    HB3  ASP   7           HB1      ASP   7 -15.608 -13.115   2.534
   40    H    ALA   8           HN       ALA   8 -15.019  -8.687   2.744
   41    HA   ALA   8           HA       ALA   8 -17.888  -8.898   3.341
   42    HB1  ALA   8           HB3      ALA   8 -16.673  -8.732   5.469
   43    HB2  ALA   8           HB1      ALA   8 -17.672  -7.310   5.170
   44    HB3  ALA   8           HB2      ALA   8 -15.928  -7.231   4.918
   45    H    SER   9           HN       SER   9 -18.904  -7.777   1.820
   46    HA   SER   9           HA       SER   9 -19.449  -6.167   0.310
   47    HG   SER   9           HG       SER   9 -19.737  -3.882   0.119
   48    HB2  SER   9           HB2      SER   9 -19.512  -4.771   2.353
   49    HB3  SER   9           HB1      SER   9 -17.807  -4.378   2.123
   50    H    GLY  10           HN       GLY  10 -16.795  -7.651   0.156
   51    HA2  GLY  10           HA2      GLY  10 -15.299  -7.801  -1.621
   52    HA3  GLY  10           HA1      GLY  10 -15.823  -6.214  -2.164
   53    H    PHE  11           HN       PHE  11 -14.629  -7.044   1.055
   54    HA   PHE  11           HA       PHE  11 -12.149  -5.579   0.489
   55    HD1  PHE  11           HD2      PHE  11 -11.953  -2.909   0.632
   56    HD2  PHE  11           HD1      PHE  11 -15.830  -4.022   1.991
   57    HE1  PHE  11           HE2      PHE  11 -12.922  -1.011  -0.594
   58    HE2  PHE  11           HE1      PHE  11 -16.807  -2.125   0.764
   59    HZ   PHE  11           HZ       PHE  11 -15.357  -0.611  -0.517
   60    HB2  PHE  11           HB2      PHE  11 -13.959  -5.090   2.864
   61    HB3  PHE  11           HB1      PHE  11 -12.352  -4.399   2.661
   62    H    SER  12           HN       SER  12 -10.359  -6.382   1.446
   63    HA   SER  12           HA       SER  12 -10.520  -8.166   3.706
   64    HG   SER  12           HG       SER  12  -8.423  -9.906   2.983
   65    HB2  SER  12           HB2      SER  12 -11.030  -9.728   1.905
   66    HB3  SER  12           HB1      SER  12  -9.604  -9.201   1.012
   67    H    LEU  13           HN       LEU  13  -8.635  -8.255   4.835
   68    HA   LEU  13           HA       LEU  13  -6.594  -6.366   4.124
   69    HG   LEU  13           HG       LEU  13  -8.552  -6.643   6.479
   70    HB2  LEU  13           HB2      LEU  13  -6.695  -8.334   6.413
   71    HB3  LEU  13           HB1      LEU  13  -5.566  -7.002   6.255
   72   HD11  LEU  13          HD11      LEU  13  -7.667  -7.657   8.515
   73   HD12  LEU  13          HD12      LEU  13  -8.138  -5.979   8.789
   74   HD13  LEU  13          HD13      LEU  13  -6.434  -6.399   8.611
   75   HD21  LEU  13          HD23      LEU  13  -7.488  -4.786   5.392
   76   HD22  LEU  13          HD21      LEU  13  -6.225  -4.735   6.622
   77   HD23  LEU  13          HD22      LEU  13  -7.886  -4.317   7.045
   78    H    TYR  14           HN       TYR  14  -4.771  -6.745   3.056
   79    HA   TYR  14           HA       TYR  14  -3.841  -9.529   2.812
   80    HD1  TYR  14           HD2      TYR  14  -3.749 -11.007   0.160
   81    HD2  TYR  14           HD1      TYR  14  -6.465  -7.753   0.579
   82    HE1  TYR  14           HE2      TYR  14  -5.560 -12.402  -0.743
   83    HE2  TYR  14           HE1      TYR  14  -8.280  -9.144  -0.320
   84    HH   TYR  14           HH       TYR  14  -8.547 -11.133  -1.733
   85    HB2  TYR  14           HB2      TYR  14  -4.076  -7.388   0.712
   86    HB3  TYR  14           HB1      TYR  14  -2.942  -8.722   0.525
   87    H    SER  15           HN       SER  15  -1.776  -9.896   3.341
   88    HA   SER  15           HA       SER  15  -0.005  -7.563   3.674
   89    HG   SER  15           HG       SER  15  -0.790 -10.729   4.807
   90    HB2  SER  15           HB2      SER  15   1.062  -8.762   5.550
   91    HB3  SER  15           HB1      SER  15  -0.654  -8.481   5.849
   92    H    VAL  16           HN       VAL  16   2.048  -7.690   2.898
   93    HA   VAL  16           HA       VAL  16   2.903 -10.233   1.689
   94    HB   VAL  16           HB       VAL  16   3.382  -7.562   0.376
   95   HG11  VAL  16          HG11      VAL  16   4.943  -9.357  -0.190
   96   HG12  VAL  16          HG12      VAL  16   3.938  -8.918  -1.570
   97   HG13  VAL  16          HG13      VAL  16   3.591 -10.386  -0.658
   98   HG21  VAL  16          HG23      VAL  16   1.600  -8.111  -1.198
   99   HG22  VAL  16          HG21      VAL  16   0.973  -7.975   0.444
  100   HG23  VAL  16          HG22      VAL  16   1.223  -9.566  -0.275
  101    H    GLU  17           HN       GLU  17   5.128 -10.621   1.694
  102    HA   GLU  17           HA       GLU  17   6.647  -8.891   3.515
  103    HB2  GLU  17           HB2      GLU  17   7.104 -11.761   2.688
  104    HB3  GLU  17           HB1      GLU  17   8.156 -10.851   3.764
  105    HG2  GLU  17           HG2      GLU  17   6.284 -10.581   5.333
  106    HG3  GLU  17           HG1      GLU  17   5.273 -11.555   4.265
  107    H    LEU  18           HN       LEU  18   7.952  -7.484   2.571
  108    HA   LEU  18           HA       LEU  18   9.326  -8.275   0.089
  109    HG   LEU  18           HG       LEU  18   7.550  -5.398  -1.352
  110    HB2  LEU  18           HB2      LEU  18   8.152  -5.688   0.987
  111    HB3  LEU  18           HB1      LEU  18   9.583  -5.636  -0.023
  112   HD11  LEU  18          HD11      LEU  18   8.944  -8.033  -1.804
  113   HD12  LEU  18          HD12      LEU  18   9.489  -6.455  -2.374
  114   HD13  LEU  18          HD13      LEU  18   7.993  -7.149  -2.998
  115   HD21  LEU  18          HD23      LEU  18   6.069  -6.700   0.141
  116   HD22  LEU  18          HD21      LEU  18   6.846  -8.178  -0.424
  117   HD23  LEU  18          HD22      LEU  18   5.934  -7.173  -1.551
  118    H    PHE  19           HN       PHE  19  11.459  -7.142  -0.228
  119    HA   PHE  19           HA       PHE  19  12.853  -6.268   2.131
  120    HD1  PHE  19           HD2      PHE  19  11.594  -9.952   0.954
  121    HD2  PHE  19           HD1      PHE  19  15.611  -8.862   0.067
  122    HE1  PHE  19           HE2      PHE  19  11.661 -11.652  -0.824
  123    HE2  PHE  19           HE1      PHE  19  15.683 -10.556  -1.714
  124    HZ   PHE  19           HZ       PHE  19  13.712 -11.985  -2.132
  125    HB2  PHE  19           HB2      PHE  19  14.568  -8.072   2.043
  126    HB3  PHE  19           HB1      PHE  19  12.979  -8.646   2.537
  127    H    ARG  20           HN       ARG  20  14.453  -4.889   1.585
  128    HA   ARG  20           HA       ARG  20  15.256  -4.879  -1.254
  129    HE   ARG  20           HE       ARG  20  13.738  -0.704  -1.461
  130    HB2  ARG  20           HB2      ARG  20  14.070  -2.831  -0.311
  131    HB3  ARG  20           HB1      ARG  20  15.525  -2.547   0.637
  132    HG2  ARG  20           HG2      ARG  20  16.781  -2.636  -1.585
  133    HG3  ARG  20           HG1      ARG  20  15.196  -2.482  -2.342
  134    HD2  ARG  20           HD2      ARG  20  16.377  -0.552  -0.348
  135    HD3  ARG  20           HD1      ARG  20  16.344  -0.319  -2.094
  136   HH11  ARG  20          HH11      ARG  20  16.213   1.428  -0.252
  137   HH12  ARG  20          HH12      ARG  20  15.109   2.707   0.128
  138   HH21  ARG  20          HH21      ARG  20  12.277   0.982  -0.972
  139   HH22  ARG  20          HH22      ARG  20  12.872   2.452  -0.281
  140    H    GLU  21           HN       GLU  21  17.313  -5.188  -1.792
  141    HA   GLU  21           HA       GLU  21  19.380  -4.937   0.277
  142    HB2  GLU  21           HB2      GLU  21  20.431  -7.025  -0.518
  143    HB3  GLU  21           HB1      GLU  21  18.834  -7.301   0.162
  144    HG2  GLU  21           HG2      GLU  21  17.897  -7.402  -2.098
  145    HG3  GLU  21           HG1      GLU  21  19.509  -7.153  -2.768
  146    H    LYS  22           HN       LYS  22  18.317  -3.777  -2.491
  147    HA   LYS  22           HA       LYS  22  20.982  -3.536  -3.723
  148    HB2  LYS  22           HB2      LYS  22  18.273  -3.127  -5.004
  149    HB3  LYS  22           HB1      LYS  22  19.826  -3.017  -5.818
  150    HG2  LYS  22           HG2      LYS  22  18.747  -5.511  -4.522
  151    HG3  LYS  22           HG1      LYS  22  18.642  -5.138  -6.244
  152    HD2  LYS  22           HD2      LYS  22  21.087  -5.067  -6.374
  153    HD3  LYS  22           HD1      LYS  22  21.190  -5.440  -4.651
  154    HE2  LYS  22           HE2      LYS  22  20.050  -7.576  -5.060
  155    HE3  LYS  22           HE1      LYS  22  19.977  -7.200  -6.781
  156    HZ1  LYS  22           HZ3      LYS  22  21.823  -8.669  -6.274
  157    HZ2  LYS  22           HZ1      LYS  22  22.463  -7.537  -5.190
  158    HZ3  LYS  22           HZ2      LYS  22  22.393  -7.181  -6.841
  159    H    ASP  23           HN       ASP  23  21.414  -1.430  -4.789
  160    HA   ASP  23           HA       ASP  23  20.684   0.730  -2.996
  161    HB2  ASP  23           HB2      ASP  23  22.571   0.720  -5.363
  162    HB3  ASP  23           HB1      ASP  23  22.404   2.016  -4.180
  163    H    THR  24           HN       THR  24  18.500  -0.133  -4.456
  164    HA   THR  24           HA       THR  24  18.136   1.656  -6.711
  165    HB   THR  24           HB       THR  24  15.922   0.634  -6.937
  166    HG1  THR  24           HG1      THR  24  15.766  -1.324  -5.358
  167   HG21  THR  24          HG23      THR  24  17.815  -0.501  -7.969
  168   HG22  THR  24          HG21      THR  24  16.637  -1.678  -7.387
  169   HG23  THR  24          HG22      THR  24  18.118  -1.387  -6.475
  170    H    SER  25           HN       SER  25  17.723   1.774  -3.372
  171    HA   SER  25           HA       SER  25  16.648   3.155  -1.922
  172    HG   SER  25           HG       SER  25  17.592   5.268  -5.040
  173    HB2  SER  25           HB2      SER  25  16.657   5.514  -2.503
  174    HB3  SER  25           HB1      SER  25  18.141   4.760  -3.084
  175    H    SER  26           HN       SER  26  14.976   1.564  -3.822
  176    HA   SER  26           HA       SER  26  12.457   2.773  -3.127
  177    HG   SER  26           HG       SER  26  14.117   1.858  -5.986
  178    HB2  SER  26           HB2      SER  26  11.579   2.846  -5.434
  179    HB3  SER  26           HB1      SER  26  12.930   3.957  -5.216
  180    H    LEU  27           HN       LEU  27  10.668   1.351  -3.394
  181    HA   LEU  27           HA       LEU  27  11.483  -1.463  -3.657
  182    HG   LEU  27           HG       LEU  27  11.492  -0.277  -0.991
  183    HB2  LEU  27           HB2      LEU  27   9.249  -0.165  -2.107
  184    HB3  LEU  27           HB1      LEU  27   9.346  -1.897  -2.360
  185   HD11  LEU  27          HD11      LEU  27   9.441  -0.201   0.313
  186   HD12  LEU  27          HD12      LEU  27  10.645  -1.226   1.095
  187   HD13  LEU  27          HD13      LEU  27   9.301  -1.957   0.217
  188   HD21  LEU  27          HD23      LEU  27  12.311  -2.329  -1.984
  189   HD22  LEU  27          HD21      LEU  27  11.019  -3.245  -1.210
  190   HD23  LEU  27          HD22      LEU  27  12.267  -2.479  -0.227
  191    H    GLY  28           HN       GLY  28   9.705   0.988  -5.155
  192    HA2  GLY  28           HA2      GLY  28   8.831   0.679  -7.353
  193    HA3  GLY  28           HA1      GLY  28   8.490  -0.995  -6.951
  194    H    ILE  29           HN       ILE  29   7.644   1.346  -4.590
  195    HA   ILE  29           HA       ILE  29   4.814   0.872  -5.172
  196    HB   ILE  29           HB       ILE  29   6.108   2.055  -2.708
  197   HG12  ILE  29          HG12      ILE  29   4.847  -0.665  -3.123
  198   HG13  ILE  29          HG11      ILE  29   6.581  -0.364  -3.107
  199   HG21  ILE  29          HG21      ILE  29   3.900   1.793  -1.674
  200   HG22  ILE  29          HG22      ILE  29   3.243   1.259  -3.221
  201   HG23  ILE  29          HG23      ILE  29   3.851   2.905  -3.042
  202   HD11  ILE  29          HD13      ILE  29   6.409   0.415  -0.791
  203   HD12  ILE  29          HD11      ILE  29   5.844  -1.244  -0.982
  204   HD13  ILE  29          HD12      ILE  29   4.680   0.070  -0.815
  205    H    SER  30           HN       SER  30   3.848   2.343  -6.411
  206    HA   SER  30           HA       SER  30   4.695   5.153  -6.179
  207    HG   SER  30           HG       SER  30   2.896   6.068  -8.196
  208    HB2  SER  30           HB2      SER  30   5.022   4.206  -8.420
  209    HB3  SER  30           HB1      SER  30   3.317   3.762  -8.489
  210    H    ILE  31           HN       ILE  31   3.395   6.044  -4.693
  211    HA   ILE  31           HA       ILE  31   0.540   5.456  -4.697
  212    HB   ILE  31           HB       ILE  31   0.491   6.909  -2.665
  213   HG12  ILE  31          HG12      ILE  31   3.504   6.859  -2.939
  214   HG13  ILE  31          HG11      ILE  31   2.500   8.259  -3.301
  215   HG21  ILE  31          HG21      ILE  31   1.649   5.294  -1.214
  216   HG22  ILE  31          HG22      ILE  31   2.438   4.605  -2.634
  217   HG23  ILE  31          HG23      ILE  31   0.686   4.500  -2.460
  218   HD11  ILE  31          HD13      ILE  31   2.736   6.922  -0.616
  219   HD12  ILE  31          HD11      ILE  31   1.774   8.353  -0.986
  220   HD13  ILE  31          HD12      ILE  31   3.533   8.419  -1.101
  221    H    SER  32           HN       SER  32  -0.994   7.292  -4.495
  222    HA   SER  32           HA       SER  32  -0.130   9.789  -5.719
  223    HG   SER  32           HG       SER  32  -2.811  10.248  -7.115
  224    HB2  SER  32           HB2      SER  32  -0.723   8.404  -7.648
  225    HB3  SER  32           HB1      SER  32  -2.295   8.052  -6.932
  226    H    GLY  33           HN       GLY  33  -1.727  11.492  -5.546
  227    HA2  GLY  33           HA2      GLY  33  -3.641  10.971  -3.356
  228    HA3  GLY  33           HA1      GLY  33  -2.791  12.493  -3.574
  229    H    MET  34           HN       MET  34  -5.573  10.685  -4.315
  230    HA   MET  34           HA       MET  34  -6.428  11.976  -6.669
  231    HB2  MET  34           HB2      MET  34  -7.384   9.856  -5.767
  232    HB3  MET  34           HB1      MET  34  -8.150  10.787  -4.487
  233    HG2  MET  34           HG2      MET  34  -9.377  12.064  -6.219
  234    HG3  MET  34           HG1      MET  34  -8.685  10.997  -7.440
  235    HE1  MET  34           HE3      MET  34  -9.190   8.375  -7.563
  236    HE2  MET  34           HE1      MET  34 -10.224   7.529  -6.410
  237    HE3  MET  34           HE2      MET  34  -8.683   8.204  -5.883
  238    H    ARG  35           HN       ARG  35  -7.592  13.806  -7.027
  239    HA   ARG  35           HA       ARG  35  -8.298  15.439  -4.681
  240    HE   ARG  35           HE       ARG  35  -6.449  18.318  -4.302
  241    HB2  ARG  35           HB2      ARG  35  -7.140  16.503  -7.263
  242    HB3  ARG  35           HB1      ARG  35  -7.543  17.436  -5.828
  243    HG2  ARG  35           HG2      ARG  35  -5.429  15.296  -5.961
  244    HG3  ARG  35           HG1      ARG  35  -5.130  17.031  -6.063
  245    HD2  ARG  35           HD2      ARG  35  -6.399  15.605  -3.726
  246    HD3  ARG  35           HD1      ARG  35  -4.723  16.145  -3.806
  247   HH11  ARG  35          HH11      ARG  35  -5.401  16.232  -1.715
  248   HH12  ARG  35          HH12      ARG  35  -5.646  17.422  -0.482
  249   HH21  ARG  35          HH21      ARG  35  -6.770  19.893  -2.687
  250   HH22  ARG  35          HH22      ARG  35  -6.424  19.505  -1.035
  251    H    ASP  36           HN       ASP  36 -10.121  13.783  -5.906
  252    HA   ASP  36           HA       ASP  36 -11.784  15.646  -7.471
  253    HB2  ASP  36           HB2      ASP  36 -11.201  13.658  -8.751
  254    HB3  ASP  36           HB1      ASP  36 -11.787  12.620  -7.455
  255    H    GLN  37           HN       GLN  37 -13.865  16.038  -6.849
  256    HA   GLN  37           HA       GLN  37 -14.587  15.127  -4.162
  257    HB2  GLN  37           HB2      GLN  37 -15.656  17.375  -5.874
  258    HB3  GLN  37           HB1      GLN  37 -16.299  16.953  -4.293
  259    HG2  GLN  37           HG2      GLN  37 -14.136  17.442  -3.278
  260    HG3  GLN  37           HG1      GLN  37 -13.485  17.860  -4.862
  261   HE21  GLN  37          HE21      GLN  37 -13.757  19.468  -2.430
  262   HE22  GLN  37          HE22      GLN  37 -14.683  20.855  -2.881
  263    H    SER  38           HN       SER  38 -15.775  13.342  -4.101
  264    HA   SER  38           HA       SER  38 -17.868  12.973  -6.142
  265    HG   SER  38           HG       SER  38 -18.756  10.794  -5.834
  266    HB2  SER  38           HB2      SER  38 -16.162  11.218  -6.212
  267    HB3  SER  38           HB1      SER  38 -16.420  10.880  -4.500
  268    H    THR  39           HN       THR  39 -19.936  12.808  -5.517
  269    HA   THR  39           HA       THR  39 -20.671  13.486  -2.860
  270    HB   THR  39           HB       THR  39 -22.995  13.115  -3.601
  271    HG1  THR  39           HG1      THR  39 -21.759  12.215  -6.012
  272   HG21  THR  39          HG23      THR  39 -21.938  15.256  -4.092
  273   HG22  THR  39          HG21      THR  39 -23.024  14.796  -5.403
  274   HG23  THR  39          HG22      THR  39 -21.282  14.607  -5.594
  275    H    THR  40           HN       THR  40 -21.241  12.265  -1.179
  276    HA   THR  40           HA       THR  40 -21.204  10.432   0.177
  277    HB   THR  40           HB       THR  40 -23.546  10.477  -0.609
  278    HG1  THR  40           HG1      THR  40 -23.386   7.813  -0.467
  279   HG21  THR  40          HG23      THR  40 -23.218  10.058  -2.984
  280   HG22  THR  40          HG21      THR  40 -24.289   8.840  -2.294
  281   HG23  THR  40          HG22      THR  40 -22.606   8.442  -2.635
  282    H    GLY  41           HN       GLY  41 -19.083  10.450  -1.729
  283    HA2  GLY  41           HA2      GLY  41 -18.662   7.536  -2.017
  284    HA3  GLY  41           HA1      GLY  41 -18.110   8.685  -3.225
  285    H    GLU  42           HN       GLU  42 -16.289   6.984  -2.238
  286    HA   GLU  42           HA       GLU  42 -14.877   8.271  -0.042
  287    HB2  GLU  42           HB2      GLU  42 -14.191   5.803  -1.649
  288    HB3  GLU  42           HB1      GLU  42 -13.311   6.373  -0.237
  289    HG2  GLU  42           HG2      GLU  42 -15.346   6.071   1.116
  290    HG3  GLU  42           HG1      GLU  42 -16.168   5.425  -0.303
  291    H    ALA  43           HN       ALA  43 -12.695   8.990  -0.209
  292    HA   ALA  43           HA       ALA  43 -11.389   9.222  -2.730
  293    HB1  ALA  43           HB3      ALA  43 -13.097  10.984  -2.963
  294    HB2  ALA  43           HB1      ALA  43 -11.461  11.640  -2.929
  295    HB3  ALA  43           HB2      ALA  43 -12.485  11.751  -1.498
  296    H    THR  44           HN       THR  44  -9.713  11.283  -2.239
  297    HA   THR  44           HA       THR  44  -7.683  11.667  -1.270
  298    HB   THR  44           HB       THR  44  -7.735  12.253   1.104
  299    HG1  THR  44           HG1      THR  44  -9.032  10.913   2.176
  300   HG21  THR  44          HG23      THR  44 -10.220  13.151  -0.359
  301   HG22  THR  44          HG21      THR  44  -8.615  13.865  -0.514
  302   HG23  THR  44          HG22      THR  44  -9.482  13.966   1.019
  303    H    GLY  45           HN       GLY  45  -6.607  10.895   1.200
  304    HA2  GLY  45           HA2      GLY  45  -5.692   9.104   2.349
  305    HA3  GLY  45           HA1      GLY  45  -6.776   8.032   1.474
  306    H    ILE  46           HN       ILE  46  -4.011   7.566   2.049
  307    HA   ILE  46           HA       ILE  46  -2.553   7.986  -0.416
  308    HB   ILE  46           HB       ILE  46  -1.774   6.316   1.977
  309   HG12  ILE  46          HG12      ILE  46  -2.156   8.641   2.640
  310   HG13  ILE  46          HG11      ILE  46  -0.436   8.264   2.675
  311   HG21  ILE  46          HG21      ILE  46  -0.144   7.434  -0.298
  312   HG22  ILE  46          HG22      ILE  46  -0.520   5.736  -0.008
  313   HG23  ILE  46          HG23      ILE  46   0.516   6.614   1.116
  314   HD11  ILE  46          HD13      ILE  46  -0.766  10.450   1.745
  315   HD12  ILE  46          HD11      ILE  46  -1.896   9.814   0.549
  316   HD13  ILE  46          HD12      ILE  46  -0.193   9.365   0.479
  317    H    TYR  47           HN       TYR  47  -2.927   6.747  -2.133
  318    HA   TYR  47           HA       TYR  47  -3.309   3.863  -1.717
  319    HD1  TYR  47           HD1      TYR  47  -5.540   7.322  -2.566
  320    HD2  TYR  47           HD2      TYR  47  -4.511   4.611  -5.681
  321    HE1  TYR  47           HE1      TYR  47  -5.878   9.106  -4.222
  322    HE2  TYR  47           HE2      TYR  47  -4.845   6.388  -7.345
  323    HH   TYR  47           HH       TYR  47  -6.017   8.493  -7.584
  324    HB2  TYR  47           HB2      TYR  47  -5.007   3.799  -3.466
  325    HB3  TYR  47           HB1      TYR  47  -5.501   4.896  -2.182
  326    H    VAL  48           HN       VAL  48  -2.318   2.530  -3.172
  327    HA   VAL  48           HA       VAL  48  -0.250   3.703  -4.800
  328    HB   VAL  48           HB       VAL  48  -1.049   0.813  -4.419
  329   HG11  VAL  48          HG11      VAL  48   0.065   1.092  -6.552
  330   HG12  VAL  48          HG12      VAL  48   1.138   0.280  -5.414
  331   HG13  VAL  48          HG13      VAL  48   1.371   1.990  -5.779
  332   HG21  VAL  48          HG23      VAL  48  -0.217   1.867  -2.383
  333   HG22  VAL  48          HG21      VAL  48   1.225   2.408  -3.244
  334   HG23  VAL  48          HG22      VAL  48   0.937   0.684  -2.999
  335    H    LYS  49           HN       LYS  49  -0.708   4.494  -6.740
  336    HA   LYS  49           HA       LYS  49  -2.977   3.525  -8.252
  337    HB2  LYS  49           HB2      LYS  49  -2.490   5.934  -8.139
  338    HB3  LYS  49           HB1      LYS  49  -0.943   5.658  -8.929
  339    HG2  LYS  49           HG2      LYS  49  -2.098   4.866 -10.927
  340    HG3  LYS  49           HG1      LYS  49  -3.652   5.127 -10.134
  341    HD2  LYS  49           HD2      LYS  49  -3.209   6.994 -11.578
  342    HD3  LYS  49           HD1      LYS  49  -3.063   7.533  -9.905
  343    HE2  LYS  49           HE2      LYS  49  -0.645   7.387 -10.039
  344    HE3  LYS  49           HE1      LYS  49  -0.753   6.751 -11.680
  345    HZ1  LYS  49           HZ3      LYS  49  -1.649   9.447 -10.813
  346    HZ2  LYS  49           HZ1      LYS  49  -1.743   8.837 -12.388
  347    HZ3  LYS  49           HZ2      LYS  49  -0.234   9.109 -11.676
  348    H    SER  50           HN       SER  50   0.534   3.360  -8.406
  349    HA   SER  50           HA       SER  50   0.315   1.208 -10.343
  350    HG   SER  50           HG       SER  50   1.656   4.775 -11.109
  351    HB2  SER  50           HB2      SER  50   1.941   2.218 -11.896
  352    HB3  SER  50           HB1      SER  50   0.473   3.185 -11.775
  353    H    LEU  51           HN       LEU  51   2.710   0.530 -10.953
  354    HA   LEU  51           HA       LEU  51   4.395   0.637  -8.549
  355    HG   LEU  51           HG       LEU  51   1.943  -1.133  -8.431
  356    HB2  LEU  51           HB2      LEU  51   3.691  -1.856 -10.102
  357    HB3  LEU  51           HB1      LEU  51   4.866  -1.774  -8.804
  358   HD11  LEU  51          HD11      LEU  51   1.749  -3.355  -7.423
  359   HD12  LEU  51          HD12      LEU  51   3.406  -3.715  -7.904
  360   HD13  LEU  51          HD13      LEU  51   2.170  -3.450  -9.133
  361   HD21  LEU  51          HD23      LEU  51   2.471  -1.442  -6.062
  362   HD22  LEU  51          HD21      LEU  51   3.434  -0.147  -6.775
  363   HD23  LEU  51          HD22      LEU  51   4.162  -1.725  -6.476
  364    H    ILE  52           HN       ILE  52   6.641  -0.029  -8.968
  365    HA   ILE  52           HA       ILE  52   7.488   0.888 -11.611
  366    HB   ILE  52           HB       ILE  52   9.140   0.431  -9.129
  367   HG12  ILE  52          HG12      ILE  52   8.051   2.975 -10.359
  368   HG13  ILE  52          HG11      ILE  52   7.515   2.246  -8.849
  369   HG21  ILE  52          HG21      ILE  52  10.870   1.699 -10.325
  370   HG22  ILE  52          HG22      ILE  52   9.833   1.756 -11.751
  371   HG23  ILE  52          HG23      ILE  52  10.449   0.209 -11.170
  372   HD11  ILE  52          HD13      ILE  52  10.244   3.378  -9.397
  373   HD12  ILE  52          HD11      ILE  52   9.723   2.635  -7.886
  374   HD13  ILE  52          HD12      ILE  52   8.971   4.132  -8.439
  375    HA   PRO  53           HA       PRO  53   8.033  -3.516 -12.596
  376    HB2  PRO  53           HB2      PRO  53   9.123  -2.331 -15.086
  377    HB3  PRO  53           HB1      PRO  53   7.863  -3.552 -14.879
  378    HG2  PRO  53           HG2      PRO  53   7.250  -1.056 -15.597
  379    HG3  PRO  53           HG1      PRO  53   6.212  -1.975 -14.491
  380    HD2  PRO  53           HD2      PRO  53   8.179   0.195 -13.884
  381    HD3  PRO  53           HD1      PRO  53   6.581  -0.108 -13.175
  382    H    GLY  54           HN       GLY  54   9.747  -4.678 -11.989
  383    HA2  GLY  54           HA2      GLY  54  12.031  -5.351 -12.328
  384    HA3  GLY  54           HA1      GLY  54  12.438  -3.670 -12.634
  385    H    SER  55           HN       SER  55  10.395  -3.533 -10.107
  386    HA   SER  55           HA       SER  55  12.608  -3.373  -8.205
  387    HG   SER  55           HG       SER  55  10.447  -0.648  -8.856
  388    HB2  SER  55           HB2      SER  55   9.749  -2.408  -7.965
  389    HB3  SER  55           HB1      SER  55  11.025  -2.133  -6.780
  390    H    ALA  56           HN       ALA  56  11.675  -3.842  -5.817
  391    HA   ALA  56           HA       ALA  56  11.409  -6.651  -5.672
  392    HB1  ALA  56           HB3      ALA  56  10.921  -4.600  -3.514
  393    HB2  ALA  56           HB1      ALA  56  12.480  -5.317  -3.918
  394    HB3  ALA  56           HB2      ALA  56  11.187  -6.326  -3.270
  395    H    ALA  57           HN       ALA  57   9.101  -4.074  -4.810
  396    HA   ALA  57           HA       ALA  57   6.927  -5.682  -4.184
  397    HB1  ALA  57           HB3      ALA  57   5.547  -3.712  -4.566
  398    HB2  ALA  57           HB1      ALA  57   6.875  -2.935  -5.426
  399    HB3  ALA  57           HB2      ALA  57   7.026  -3.287  -3.705
  400    H    ALA  58           HN       ALA  58   8.119  -4.626  -7.310
  401    HA   ALA  58           HA       ALA  58   5.814  -5.372  -8.807
  402    HB1  ALA  58           HB3      ALA  58   7.367  -3.738  -9.678
  403    HB2  ALA  58           HB1      ALA  58   7.283  -5.120 -10.770
  404    HB3  ALA  58           HB2      ALA  58   8.664  -4.933  -9.688
  405    H    LEU  59           HN       LEU  59   8.984  -6.929  -8.326
  406    HA   LEU  59           HA       LEU  59   8.455  -9.221  -9.852
  407    HG   LEU  59           HG       LEU  59  10.908  -7.479  -9.506
  408    HB2  LEU  59           HB2      LEU  59  10.307  -8.822  -7.505
  409    HB3  LEU  59           HB1      LEU  59  10.292 -10.261  -8.505
  410   HD11  LEU  59          HD11      LEU  59  12.750  -9.786  -8.900
  411   HD12  LEU  59          HD12      LEU  59  12.635  -8.282  -7.987
  412   HD13  LEU  59          HD13      LEU  59  13.219  -8.261  -9.651
  413   HD21  LEU  59          HD23      LEU  59  11.105 -10.180 -10.834
  414   HD22  LEU  59          HD21      LEU  59  11.679  -8.659 -11.518
  415   HD23  LEU  59          HD22      LEU  59   9.957  -8.900 -11.228
  416    H    ASP  60           HN       ASP  60   7.364  -8.289  -6.730
  417    HA   ASP  60           HA       ASP  60   6.942 -10.793  -5.545
  418    HB2  ASP  60           HB2      ASP  60   6.765  -8.535  -4.423
  419    HB3  ASP  60           HB1      ASP  60   5.183  -8.366  -5.176
  420    H    GLY  61           HN       GLY  61   4.633  -8.754  -7.354
  421    HA2  GLY  61           HA2      GLY  61   3.137  -9.595  -8.990
  422    HA3  GLY  61           HA1      GLY  61   3.338 -11.202  -8.310
  423    H    ARG  62           HN       ARG  62   2.774 -10.779  -5.654
  424    HA   ARG  62           HA       ARG  62  -0.006 -10.895  -5.589
  425    HE   ARG  62           HE       ARG  62   0.153 -12.136  -1.636
  426    HB2  ARG  62           HB2      ARG  62   1.869 -10.186  -3.324
  427    HB3  ARG  62           HB1      ARG  62   0.208 -10.735  -3.147
  428    HG2  ARG  62           HG2      ARG  62   0.759 -12.890  -4.040
  429    HG3  ARG  62           HG1      ARG  62   2.391 -12.353  -4.443
  430    HD2  ARG  62           HD2      ARG  62   2.384 -13.693  -2.406
  431    HD3  ARG  62           HD1      ARG  62   2.878 -12.032  -2.074
  432   HH11  ARG  62          HH11      ARG  62   3.009 -13.656  -0.340
  433   HH12  ARG  62          HH12      ARG  62   2.333 -13.871   1.240
  434   HH21  ARG  62          HH21      ARG  62  -0.744 -12.415   0.438
  435   HH22  ARG  62          HH22      ARG  62   0.200 -13.165   1.682
  436    H    ILE  63           HN       ILE  63   2.167  -8.175  -5.027
  437    HA   ILE  63           HA       ILE  63   0.172  -6.355  -4.158
  438    HB   ILE  63           HB       ILE  63   2.828  -5.730  -5.457
  439   HG12  ILE  63          HG12      ILE  63   2.153  -5.918  -2.514
  440   HG13  ILE  63          HG11      ILE  63   2.942  -7.203  -3.422
  441   HG21  ILE  63          HG21      ILE  63   2.624  -3.584  -4.269
  442   HG22  ILE  63          HG22      ILE  63   1.013  -4.052  -3.728
  443   HG23  ILE  63          HG23      ILE  63   1.333  -3.821  -5.447
  444   HD11  ILE  63          HD13      ILE  63   4.523  -5.860  -2.131
  445   HD12  ILE  63          HD11      ILE  63   4.034  -4.425  -3.035
  446   HD13  ILE  63          HD12      ILE  63   4.833  -5.761  -3.865
  447    H    GLU  64           HN       GLU  64  -1.521  -5.850  -5.391
  448    HA   GLU  64           HA       GLU  64  -1.105  -5.421  -8.270
  449    HB2  GLU  64           HB2      GLU  64  -2.774  -7.152  -7.536
  450    HB3  GLU  64           HB1      GLU  64  -3.719  -5.856  -6.817
  451    HG2  GLU  64           HG2      GLU  64  -3.983  -4.824  -9.010
  452    HG3  GLU  64           HG1      GLU  64  -3.024  -6.114  -9.734
  453    HA   PRO  65           HA       PRO  65  -1.549  -1.031  -7.742
  454    HB2  PRO  65           HB2      PRO  65  -2.851  -0.518 -10.147
  455    HB3  PRO  65           HB1      PRO  65  -1.102  -0.602  -9.929
  456    HG2  PRO  65           HG2      PRO  65  -2.992  -2.689 -10.927
  457    HG3  PRO  65           HG1      PRO  65  -1.353  -2.298 -11.484
  458    HD2  PRO  65           HD2      PRO  65  -1.809  -4.432  -9.945
  459    HD3  PRO  65           HD1      PRO  65  -0.350  -3.442  -9.721
  460    H    ASN  66           HN       ASN  66  -3.332   0.680  -8.019
  461    HA   ASN  66           HA       ASN  66  -5.349   1.478  -7.338
  462    HB2  ASN  66           HB2      ASN  66  -6.022   0.130  -9.403
  463    HB3  ASN  66           HB1      ASN  66  -6.537  -1.131  -8.288
  464   HD21  ASN  66          HD21      ASN  66  -8.125   0.387 -10.161
  465   HD22  ASN  66          HD22      ASN  66  -9.336   1.198  -9.235
  466    H    ASP  67           HN       ASP  67  -3.825   0.356  -5.362
  467    HA   ASP  67           HA       ASP  67  -5.824  -0.981  -3.655
  468    HB2  ASP  67           HB2      ASP  67  -3.952  -2.029  -2.450
  469    HB3  ASP  67           HB1      ASP  67  -3.946  -2.470  -4.155
  470    H    LYS  68           HN       LYS  68  -5.418  -0.595  -1.271
  471    HA   LYS  68           HA       LYS  68  -4.595   2.207  -0.867
  472    HB2  LYS  68           HB2      LYS  68  -6.998   1.939  -0.601
  473    HB3  LYS  68           HB1      LYS  68  -6.751   0.630   0.545
  474    HG2  LYS  68           HG2      LYS  68  -5.738   2.167   2.123
  475    HG3  LYS  68           HG1      LYS  68  -5.905   3.489   0.965
  476    HD2  LYS  68           HD2      LYS  68  -8.326   3.269   1.036
  477    HD3  LYS  68           HD1      LYS  68  -8.185   1.899   2.139
  478    HE2  LYS  68           HE2      LYS  68  -7.172   3.330   3.819
  479    HE3  LYS  68           HE1      LYS  68  -7.234   4.702   2.713
  480    HZ1  LYS  68           HZ3      LYS  68  -9.588   3.233   3.775
  481    HZ2  LYS  68           HZ1      LYS  68  -9.644   4.557   2.722
  482    HZ3  LYS  68           HZ2      LYS  68  -9.058   4.751   4.298
  483    H    ILE  69           HN       ILE  69  -2.907   2.507   0.417
  484    HA   ILE  69           HA       ILE  69  -1.777   0.295   1.883
  485    HB   ILE  69           HB       ILE  69  -0.861   3.170   1.745
  486   HG12  ILE  69          HG12      ILE  69  -0.883   2.078  -0.461
  487   HG13  ILE  69          HG11      ILE  69   0.760   2.384   0.089
  488   HG21  ILE  69          HG21      ILE  69   1.294   2.294   2.523
  489   HG22  ILE  69          HG22      ILE  69   0.575   0.692   2.689
  490   HG23  ILE  69          HG23      ILE  69   0.010   2.021   3.701
  491   HD11  ILE  69          HD13      ILE  69   0.607   0.212  -0.950
  492   HD12  ILE  69          HD11      ILE  69  -0.681  -0.256   0.160
  493   HD13  ILE  69          HD12      ILE  69   0.947   0.035   0.770
  494    H    LEU  70           HN       LEU  70  -1.681   0.016   4.054
  495    HA   LEU  70           HA       LEU  70  -3.333   1.821   5.683
  496    HG   LEU  70           HG       LEU  70  -4.276  -0.802   4.445
  497    HB2  LEU  70           HB2      LEU  70  -2.493  -1.036   6.191
  498    HB3  LEU  70           HB1      LEU  70  -3.486  -0.071   7.265
  499   HD11  LEU  70          HD11      LEU  70  -4.105  -2.808   5.805
  500   HD12  LEU  70          HD12      LEU  70  -5.793  -2.419   5.480
  501   HD13  LEU  70          HD13      LEU  70  -5.095  -2.061   7.059
  502   HD21  LEU  70          HD23      LEU  70  -5.841   0.374   6.741
  503   HD22  LEU  70          HD21      LEU  70  -6.502  -0.087   5.173
  504   HD23  LEU  70          HD22      LEU  70  -5.332   1.227   5.284
  505    H    ARG  71           HN       ARG  71  -0.596  -0.373   6.338
  506    HA   ARG  71           HA       ARG  71   0.941   1.830   7.431
  507    HE   ARG  71           HE       ARG  71  -1.652   0.591  10.628
  508    HB2  ARG  71           HB2      ARG  71   1.302   0.678   9.595
  509    HB3  ARG  71           HB1      ARG  71  -0.362   1.191   9.360
  510    HG2  ARG  71           HG2      ARG  71  -0.950  -1.107   8.700
  511    HG3  ARG  71           HG1      ARG  71   0.714  -1.600   9.025
  512    HD2  ARG  71           HD2      ARG  71  -0.781  -2.112  10.904
  513    HD3  ARG  71           HD1      ARG  71   0.475  -0.959  11.353
  514   HH11  ARG  71          HH11      ARG  71  -1.147  -1.976  12.930
  515   HH12  ARG  71          HH12      ARG  71  -2.328  -1.380  14.048
  516   HH21  ARG  71          HH21      ARG  71  -3.207   1.384  12.096
  517   HH22  ARG  71          HH22      ARG  71  -3.499   0.528  13.574
  518    H    VAL  72           HN       VAL  72   3.087   1.539   7.268
  519    HA   VAL  72           HA       VAL  72   4.023  -0.836   5.883
  520    HB   VAL  72           HB       VAL  72   5.792   1.435   6.741
  521   HG11  VAL  72          HG11      VAL  72   6.925  -0.412   5.731
  522   HG12  VAL  72          HG12      VAL  72   6.890   0.909   4.564
  523   HG13  VAL  72          HG13      VAL  72   5.780  -0.450   4.390
  524   HG21  VAL  72          HG23      VAL  72   3.953   1.451   4.349
  525   HG22  VAL  72          HG21      VAL  72   5.215   2.638   4.684
  526   HG23  VAL  72          HG22      VAL  72   3.830   2.495   5.767
  527    H    ASP  73           HN       ASP  73   6.337  -1.573   6.629
  528    HA   ASP  73           HA       ASP  73   6.160  -2.940   9.001
  529    HB2  ASP  73           HB2      ASP  73   7.839  -3.293   7.162
  530    HB3  ASP  73           HB1      ASP  73   8.749  -1.936   7.813
  531    H    ASP  74           HN       ASP  74   5.875  -2.177  10.987
  532    HA   ASP  74           HA       ASP  74   6.058  -0.946  12.886
  533    HB2  ASP  74           HB2      ASP  74   8.839  -0.527  11.783
  534    HB3  ASP  74           HB1      ASP  74   8.342  -0.041  13.402
  535    H    VAL  75           HN       VAL  75   5.211   0.395  10.327
  536    HA   VAL  75           HA       VAL  75   5.336   3.127  11.361
  537    HB   VAL  75           HB       VAL  75   5.974   2.440   8.485
  538   HG11  VAL  75          HG11      VAL  75   6.351   4.860   8.224
  539   HG12  VAL  75          HG12      VAL  75   5.758   5.112   9.867
  540   HG13  VAL  75          HG13      VAL  75   4.677   4.479   8.625
  541   HG21  VAL  75          HG23      VAL  75   7.716   3.602  10.658
  542   HG22  VAL  75          HG21      VAL  75   8.176   3.422   8.965
  543   HG23  VAL  75          HG22      VAL  75   7.859   1.994   9.949
  544    H    ASN  76           HN       ASN  76   3.534   4.370  10.893
  545    HA   ASN  76           HA       ASN  76   1.344   2.968   9.499
  546    HB2  ASN  76           HB2      ASN  76   0.929   3.232  11.908
  547    HB3  ASN  76           HB1      ASN  76   1.166   4.971  11.763
  548   HD21  ASN  76          HD21      ASN  76  -0.927   2.290  11.032
  549   HD22  ASN  76          HD22      ASN  76  -2.328   3.228  10.653
  550    H    VAL  77           HN       VAL  77   0.355   3.984   7.834
  551    HA   VAL  77           HA       VAL  77   1.113   6.792   7.335
  552    HB   VAL  77           HB       VAL  77   0.983   6.316   4.918
  553   HG11  VAL  77          HG11      VAL  77   3.145   6.259   5.993
  554   HG12  VAL  77          HG12      VAL  77   3.067   4.998   4.764
  555   HG13  VAL  77          HG13      VAL  77   2.900   4.580   6.470
  556   HG21  VAL  77          HG23      VAL  77   0.655   3.451   5.802
  557   HG22  VAL  77          HG21      VAL  77   0.946   3.983   4.145
  558   HG23  VAL  77          HG22      VAL  77  -0.549   4.433   4.966
  559    H    GLN  78           HN       GLN  78  -1.224   5.938   8.761
  560    HA   GLN  78           HA       GLN  78  -3.401   6.393   6.860
  561    HB2  GLN  78           HB2      GLN  78  -3.400   5.546   9.758
  562    HB3  GLN  78           HB1      GLN  78  -4.864   5.874   8.842
  563    HG2  GLN  78           HG2      GLN  78  -2.820   3.789   8.116
  564    HG3  GLN  78           HG1      GLN  78  -4.312   3.476   9.002
  565   HE21  GLN  78          HE21      GLN  78  -2.919   4.314   5.928
  566   HE22  GLN  78          HE22      GLN  78  -4.332   4.018   4.979
  567    H    GLY  79           HN       GLY  79  -1.737   8.601   7.283
  568    HA2  GLY  79           HA2      GLY  79  -3.418  10.693   7.606
  569    HA3  GLY  79           HA1      GLY  79  -2.969  10.317   9.261
  570    H    MET  80           HN       MET  80  -0.851  10.043   6.443
  571    HA   MET  80           HA       MET  80   0.665  12.359   7.450
  572    HB2  MET  80           HB2      MET  80   1.808   9.742   6.458
  573    HB3  MET  80           HB1      MET  80   2.756  11.174   6.837
  574    HG2  MET  80           HG2      MET  80   1.780  11.031   9.167
  575    HG3  MET  80           HG1      MET  80   1.193   9.431   8.714
  576    HE1  MET  80           HE3      MET  80   4.591   7.601   7.884
  577    HE2  MET  80           HE1      MET  80   3.763   8.636   6.720
  578    HE3  MET  80           HE2      MET  80   2.834   7.545   7.748
  579    H    ALA  81           HN       ALA  81   2.039  13.400   5.848
  580    HA   ALA  81           HA       ALA  81   0.675  13.874   3.427
  581    HB1  ALA  81           HB3      ALA  81   2.088  15.556   4.504
  582    HB2  ALA  81           HB1      ALA  81   2.575  15.280   2.832
  583    HB3  ALA  81           HB2      ALA  81   3.517  14.583   4.151
  584    H    GLN  82           HN       GLN  82   1.308  13.446   1.266
  585    HA   GLN  82           HA       GLN  82   1.980  10.822   0.701
  586    HB2  GLN  82           HB2      GLN  82   0.851  12.385  -0.863
  587    HB3  GLN  82           HB1      GLN  82   2.387  13.202  -1.118
  588    HG2  GLN  82           HG2      GLN  82   3.334  11.191  -2.074
  589    HG3  GLN  82           HG1      GLN  82   1.843  10.309  -1.747
  590   HE21  GLN  82          HE21      GLN  82   3.212  10.788  -4.274
  591   HE22  GLN  82          HE22      GLN  82   2.066  11.581  -5.295
  592    H    SER  83           HN       SER  83   4.082  13.683   0.344
  593    HA   SER  83           HA       SER  83   6.388  12.392  -0.474
  594    HG   SER  83           HG       SER  83   6.791  15.548  -1.124
  595    HB2  SER  83           HB2      SER  83   6.151  14.860   1.261
  596    HB3  SER  83           HB1      SER  83   7.610  14.355   0.409
  597    H    ASP  84           HN       ASP  84   5.137  12.839   2.793
  598    HA   ASP  84           HA       ASP  84   7.432  11.976   4.182
  599    HB2  ASP  84           HB2      ASP  84   5.533  13.181   5.235
  600    HB3  ASP  84           HB1      ASP  84   4.541  11.739   5.043
  601    H    VAL  85           HN       VAL  85   4.612  10.224   2.952
  602    HA   VAL  85           HA       VAL  85   5.208   7.716   4.059
  603    HB   VAL  85           HB       VAL  85   3.793   8.266   1.445
  604   HG11  VAL  85          HG11      VAL  85   2.680   6.113   1.881
  605   HG12  VAL  85          HG12      VAL  85   3.712   5.882   3.290
  606   HG13  VAL  85          HG13      VAL  85   4.423   5.935   1.678
  607   HG21  VAL  85          HG23      VAL  85   2.790   9.515   3.285
  608   HG22  VAL  85          HG21      VAL  85   2.677   8.037   4.238
  609   HG23  VAL  85          HG22      VAL  85   1.731   8.208   2.760
  610    H    VAL  86           HN       VAL  86   6.172   9.203   0.992
  611    HA   VAL  86           HA       VAL  86   7.461   6.956  -0.108
  612    HB   VAL  86           HB       VAL  86   8.140   9.864  -0.575
  613   HG11  VAL  86          HG11      VAL  86   8.954   9.063  -2.758
  614   HG12  VAL  86          HG12      VAL  86   8.644   7.404  -2.244
  615   HG13  VAL  86          HG13      VAL  86   9.858   8.374  -1.408
  616   HG21  VAL  86          HG23      VAL  86   5.774   9.465  -0.958
  617   HG22  VAL  86          HG21      VAL  86   6.156   8.086  -1.989
  618   HG23  VAL  86          HG22      VAL  86   6.609   9.715  -2.491
  619    H    GLU  87           HN       GLU  87   8.617   9.548   1.996
  620    HA   GLU  87           HA       GLU  87  11.348   8.998   1.914
  621    HB2  GLU  87           HB2      GLU  87   9.633  10.123   4.127
  622    HB3  GLU  87           HB1      GLU  87  11.387  10.048   4.212
  623    HG2  GLU  87           HG2      GLU  87  11.546  11.457   2.224
  624    HG3  GLU  87           HG1      GLU  87   9.788  11.535   2.142
  625    H    VAL  88           HN       VAL  88   8.861   7.742   4.122
  626    HA   VAL  88           HA       VAL  88  10.514   6.182   5.733
  627    HB   VAL  88           HB       VAL  88   7.634   5.751   4.940
  628   HG11  VAL  88          HG11      VAL  88   8.584   3.624   5.631
  629   HG12  VAL  88          HG12      VAL  88   7.489   4.237   6.872
  630   HG13  VAL  88          HG13      VAL  88   9.233   4.369   7.094
  631   HG21  VAL  88          HG23      VAL  88   8.934   6.960   7.378
  632   HG22  VAL  88          HG21      VAL  88   7.210   6.621   7.229
  633   HG23  VAL  88          HG22      VAL  88   7.973   7.797   6.159
  634    H    LEU  89           HN       LEU  89   8.597   5.135   2.915
  635    HA   LEU  89           HA       LEU  89   9.402   2.501   2.819
  636    HG   LEU  89           HG       LEU  89   6.898   4.060   2.136
  637    HB2  LEU  89           HB2      LEU  89   8.779   4.351   0.516
  638    HB3  LEU  89           HB1      LEU  89   8.882   2.606   0.388
  639   HD11  LEU  89          HD11      LEU  89   6.466   4.542  -0.206
  640   HD12  LEU  89          HD12      LEU  89   5.241   3.448   0.439
  641   HD13  LEU  89          HD13      LEU  89   6.532   2.822  -0.587
  642   HD21  LEU  89          HD23      LEU  89   7.440   1.802   2.895
  643   HD22  LEU  89          HD21      LEU  89   7.083   1.172   1.286
  644   HD23  LEU  89          HD22      LEU  89   5.796   1.885   2.260
  645    H    ARG  90           HN       ARG  90  11.108   5.363   1.739
  646    HA   ARG  90           HA       ARG  90  13.147   3.871   0.351
  647    HE   ARG  90           HE       ARG  90  11.799   8.497   0.044
  648    HB2  ARG  90           HB2      ARG  90  12.928   6.787   1.101
  649    HB3  ARG  90           HB1      ARG  90  14.274   6.111   0.195
  650    HG2  ARG  90           HG2      ARG  90  12.700   5.387  -1.555
  651    HG3  ARG  90           HG1      ARG  90  11.388   6.155  -0.659
  652    HD2  ARG  90           HD2      ARG  90  13.829   7.545  -1.759
  653    HD3  ARG  90           HD1      ARG  90  12.213   7.592  -2.461
  654   HH11  ARG  90          HH11      ARG  90  14.075   9.381  -2.445
  655   HH12  ARG  90          HH12      ARG  90  14.180  11.033  -1.940
  656   HH21  ARG  90          HH21      ARG  90  11.932  10.672   0.712
  657   HH22  ARG  90          HH22      ARG  90  12.964  11.768  -0.145
  658    H    ASN  91           HN       ASN  91  12.687   5.218   3.540
  659    HA   ASN  91           HA       ASN  91  15.407   5.124   4.352
  660    HB2  ASN  91           HB2      ASN  91  12.865   5.083   5.994
  661    HB3  ASN  91           HB1      ASN  91  14.483   5.285   6.659
  662   HD21  ASN  91          HD21      ASN  91  15.345   6.886   4.342
  663   HD22  ASN  91          HD22      ASN  91  14.638   8.444   4.569
  664    H    ALA  92           HN       ALA  92  12.944   2.753   4.002
  665    HA   ALA  92           HA       ALA  92  13.731   0.820   5.854
  666    HB1  ALA  92           HB3      ALA  92  12.602  -0.793   4.387
  667    HB2  ALA  92           HB1      ALA  92  12.528   0.428   3.117
  668    HB3  ALA  92           HB2      ALA  92  11.645   0.670   4.625
  669    H    GLY  93           HN       GLY  93  14.225   0.135   2.422
  670    HA2  GLY  93           HA2      GLY  93  16.019  -0.733   1.284
  671    HA3  GLY  93           HA1      GLY  93  17.046   0.071   2.460
  672    H    ASN  94           HN       ASN  94  14.720  -2.125   3.681
  673    HA   ASN  94           HA       ASN  94  16.564  -4.383   3.712
  674    HB2  ASN  94           HB2      ASN  94  16.259  -2.575   5.917
  675    HB3  ASN  94           HB1      ASN  94  15.575  -4.132   6.372
  676   HD21  ASN  94          HD21      ASN  94  18.137  -3.915   4.041
  677   HD22  ASN  94          HD22      ASN  94  19.379  -4.573   5.044
  678    HA   PRO  95           HA       PRO  95  12.928  -6.963   3.787
  679    HB2  PRO  95           HB2      PRO  95  13.491  -8.019   6.502
  680    HB3  PRO  95           HB1      PRO  95  13.278  -8.889   4.978
  681    HG2  PRO  95           HG2      PRO  95  15.694  -8.622   6.064
  682    HG3  PRO  95           HG1      PRO  95  15.467  -8.517   4.307
  683    HD2  PRO  95           HD2      PRO  95  15.877  -6.323   6.301
  684    HD3  PRO  95           HD1      PRO  95  16.536  -6.493   4.661
  685    H    VAL  96           HN       VAL  96  11.232  -5.550   3.910
  686    HA   VAL  96           HA       VAL  96  10.206  -4.955   6.610
  687    HB   VAL  96           HB       VAL  96   9.167  -2.918   5.654
  688   HG11  VAL  96          HG11      VAL  96  11.212  -1.593   5.557
  689   HG12  VAL  96          HG12      VAL  96  12.162  -3.060   5.318
  690   HG13  VAL  96          HG13      VAL  96  11.306  -2.801   6.839
  691   HG21  VAL  96          HG23      VAL  96   9.054  -3.605   3.324
  692   HG22  VAL  96          HG21      VAL  96  10.814  -3.599   3.221
  693   HG23  VAL  96          HG22      VAL  96   9.940  -2.090   3.477
  694    H    ARG  97           HN       ARG  97   7.897  -4.787   6.817
  695    HA   ARG  97           HA       ARG  97   6.491  -6.603   4.999
  696    HE   ARG  97           HE       ARG  97   2.548  -8.794   7.040
  697    HB2  ARG  97           HB2      ARG  97   6.562  -7.153   7.432
  698    HB3  ARG  97           HB1      ARG  97   5.685  -5.665   7.760
  699    HG2  ARG  97           HG2      ARG  97   3.788  -6.489   6.468
  700    HG3  ARG  97           HG1      ARG  97   4.669  -7.979   6.118
  701    HD2  ARG  97           HD2      ARG  97   4.805  -8.405   8.562
  702    HD3  ARG  97           HD1      ARG  97   3.802  -6.982   8.831
  703   HH11  ARG  97          HH11      ARG  97   3.253  -8.266  10.412
  704   HH12  ARG  97          HH12      ARG  97   1.900  -9.191  10.973
  705   HH21  ARG  97          HH21      ARG  97   0.762 -10.011   7.771
  706   HH22  ARG  97          HH22      ARG  97   0.482 -10.181   9.471
  707    H    LEU  98           HN       LEU  98   4.588  -6.025   4.006
  708    HA   LEU  98           HA       LEU  98   3.854  -3.175   4.188
  709    HG   LEU  98           HG       LEU  98   5.846  -4.885   2.149
  710    HB2  LEU  98           HB2      LEU  98   3.390  -4.884   1.765
  711    HB3  LEU  98           HB1      LEU  98   3.399  -3.136   1.881
  712   HD11  LEU  98          HD11      LEU  98   6.439  -4.051  -0.068
  713   HD12  LEU  98          HD12      LEU  98   4.898  -3.200  -0.166
  714   HD13  LEU  98          HD13      LEU  98   4.931  -4.962  -0.110
  715   HD21  LEU  98          HD23      LEU  98   7.054  -2.748   1.897
  716   HD22  LEU  98          HD21      LEU  98   6.079  -2.808   3.366
  717   HD23  LEU  98          HD22      LEU  98   5.513  -1.892   1.969
  718    H    LEU  99           HN       LEU  99   1.976  -2.984   5.254
  719    HA   LEU  99           HA       LEU  99  -0.050  -5.082   4.925
  720    HG   LEU  99           HG       LEU  99  -2.220  -3.692   6.657
  721    HB2  LEU  99           HB2      LEU  99   0.641  -4.485   7.228
  722    HB3  LEU  99           HB1      LEU  99   0.078  -2.847   6.951
  723   HD11  LEU  99          HD11      LEU  99  -1.016  -6.356   7.395
  724   HD12  LEU  99          HD12      LEU  99  -1.715  -5.921   5.835
  725   HD13  LEU  99          HD13      LEU  99  -2.740  -6.007   7.268
  726   HD21  LEU  99          HD23      LEU  99  -0.821  -4.459   9.212
  727   HD22  LEU  99          HD21      LEU  99  -2.573  -4.378   9.024
  728   HD23  LEU  99          HD22      LEU  99  -1.599  -2.921   8.835
  729    H    LEU 100           HN       LEU 100  -1.266  -4.655   3.182
  730    HA   LEU 100           HA       LEU 100  -2.562  -2.022   3.056
  731    HG   LEU 100           HG       LEU 100   0.024  -3.889   1.456
  732    HB2  LEU 100           HB2      LEU 100  -2.466  -2.501   0.462
  733    HB3  LEU 100           HB1      LEU 100  -1.161  -1.682   1.296
  734   HD11  LEU 100          HD11      LEU 100  -0.686  -5.687  -0.027
  735   HD12  LEU 100          HD12      LEU 100  -2.135  -4.775  -0.452
  736   HD13  LEU 100          HD13      LEU 100  -1.908  -5.352   1.199
  737   HD21  LEU 100          HD23      LEU 100   0.708  -3.908  -0.918
  738   HD22  LEU 100          HD21      LEU 100   0.666  -2.287  -0.225
  739   HD23  LEU 100          HD22      LEU 100  -0.637  -2.826  -1.285
  740    H    ILE 101           HN       ILE 101  -4.625  -1.996   1.995
  741    HA   ILE 101           HA       ILE 101  -5.984  -4.589   2.196
  742    HB   ILE 101           HB       ILE 101  -6.893  -2.839   3.629
  743   HG12  ILE 101          HG12      ILE 101  -8.754  -3.437   1.318
  744   HG13  ILE 101          HG11      ILE 101  -8.401  -4.547   2.637
  745   HG21  ILE 101          HG21      ILE 101  -6.228  -0.900   2.309
  746   HG22  ILE 101          HG22      ILE 101  -7.950  -0.847   2.689
  747   HG23  ILE 101          HG23      ILE 101  -7.418  -1.322   1.076
  748   HD11  ILE 101          HD13      ILE 101  -9.749  -1.868   2.878
  749   HD12  ILE 101          HD11      ILE 101  -9.366  -2.945   4.222
  750   HD13  ILE 101          HD12      ILE 101 -10.523  -3.450   2.989
  751    H    ARG 102           HN       ARG 102  -7.046  -5.484   0.526
  752    HA   ARG 102           HA       ARG 102  -7.011  -4.032  -2.040
  753    HE   ARG 102           HE       ARG 102  -5.675  -6.379  -4.908
  754    HB2  ARG 102           HB2      ARG 102  -6.545  -6.938  -1.417
  755    HB3  ARG 102           HB1      ARG 102  -7.016  -6.412  -3.025
  756    HG2  ARG 102           HG2      ARG 102  -4.602  -5.350  -1.583
  757    HG3  ARG 102           HG1      ARG 102  -4.559  -6.739  -2.671
  758    HD2  ARG 102           HD2      ARG 102  -5.392  -3.926  -3.371
  759    HD3  ARG 102           HD1      ARG 102  -3.904  -4.733  -3.860
  760   HH11  ARG 102          HH11      ARG 102  -5.666  -2.895  -4.876
  761   HH12  ARG 102          HH12      ARG 102  -6.543  -2.752  -6.363
  762   HH21  ARG 102          HH21      ARG 102  -6.829  -6.199  -6.863
  763   HH22  ARG 102          HH22      ARG 102  -7.203  -4.630  -7.492
  764    H    ARG 103           HN       ARG 103  -8.911  -3.729  -3.020
  765    HA   ARG 103           HA       ARG 103 -11.291  -4.824  -1.775
  766    HE   ARG 103           HE       ARG 103 -12.075  -1.783  -5.308
  767    HB2  ARG 103           HB2      ARG 103 -11.272  -2.452  -2.331
  768    HB3  ARG 103           HB1      ARG 103 -10.951  -2.825  -4.019
  769    HG2  ARG 103           HG2      ARG 103 -13.125  -3.895  -4.216
  770    HG3  ARG 103           HG1      ARG 103 -13.446  -3.576  -2.511
  771    HD2  ARG 103           HD2      ARG 103 -14.543  -1.943  -3.983
  772    HD3  ARG 103           HD1      ARG 103 -13.365  -1.190  -2.909
  773   HH11  ARG 103          HH11      ARG 103 -14.634   0.277  -4.145
  774   HH12  ARG 103          HH12      ARG 103 -14.359   1.507  -5.333
  775   HH21  ARG 103          HH21      ARG 103 -11.706  -0.166  -6.876
  776   HH22  ARG 103          HH22      ARG 103 -12.696   1.255  -6.884
  777    H    LEU 104           HN       LEU 104 -12.181  -6.648  -2.431
  778    HA   LEU 104           HA       LEU 104 -11.435  -7.832  -4.964
  779    HG   LEU 104           HG       LEU 104 -11.080  -8.597  -1.908
  780    HB2  LEU 104           HB2      LEU 104 -13.358  -8.857  -2.874
  781    HB3  LEU 104           HB1      LEU 104 -12.662  -9.779  -4.194
  782   HD11  LEU 104          HD11      LEU 104 -12.574 -10.365  -1.140
  783   HD12  LEU 104          HD12      LEU 104 -10.891 -10.894  -1.104
  784   HD13  LEU 104          HD13      LEU 104 -11.960 -11.439  -2.396
  785   HD21  LEU 104          HD23      LEU 104  -9.271 -10.007  -2.754
  786   HD22  LEU 104          HD21      LEU 104  -9.789  -8.835  -3.967
  787   HD23  LEU 104          HD22      LEU 104 -10.294 -10.521  -4.095
  788    HA   PRO 105           HA       PRO 105 -15.116  -6.506  -7.060
  789    HB2  PRO 105           HB2      PRO 105 -15.064  -8.098  -9.202
  790    HB3  PRO 105           HB1      PRO 105 -13.806  -6.882  -8.940
  791    HG2  PRO 105           HG2      PRO 105 -13.729  -9.829  -8.440
  792    HG3  PRO 105           HG1      PRO 105 -12.480  -8.778  -9.131
  793    HD2  PRO 105           HD2      PRO 105 -12.551  -9.620  -6.498
  794    HD3  PRO 105           HD1      PRO 105 -11.693  -8.178  -7.074
  795    H    LEU 106           HN       LEU 106 -17.227  -7.220  -7.764
  796    HA   LEU 106           HA       LEU 106 -18.101  -9.649  -6.355
  797    HG   LEU 106           HG       LEU 106 -20.155  -7.132  -4.619
  798    HB2  LEU 106           HB2      LEU 106 -19.528  -7.089  -7.014
  799    HB3  LEU 106           HB1      LEU 106 -20.394  -8.537  -6.539
  800   HD11  LEU 106          HD11      LEU 106 -18.199  -9.411  -4.433
  801   HD12  LEU 106          HD12      LEU 106 -19.945  -9.526  -4.225
  802   HD13  LEU 106          HD13      LEU 106 -18.981  -8.598  -3.077
  803   HD21  LEU 106          HD23      LEU 106 -17.183  -7.186  -5.097
  804   HD22  LEU 106          HD21      LEU 106 -18.013  -6.399  -3.754
  805   HD23  LEU 106          HD22      LEU 106 -18.243  -5.810  -5.400
  806    H    LEU 107           HN       LEU 107 -18.353 -11.318  -7.677
  807    HA   LEU 107           HA       LEU 107 -19.253 -10.851 -10.428
  808    HG   LEU 107           HG       LEU 107 -16.210 -12.967 -10.851
  809    HB2  LEU 107           HB2      LEU 107 -17.903 -13.196  -9.101
  810    HB3  LEU 107           HB1      LEU 107 -18.606 -13.300 -10.704
  811   HD11  LEU 107          HD11      LEU 107 -17.748 -11.960 -12.528
  812   HD12  LEU 107          HD12      LEU 107 -16.187 -11.148 -12.395
  813   HD13  LEU 107          HD13      LEU 107 -17.619 -10.433 -11.656
  814   HD21  LEU 107          HD23      LEU 107 -15.133 -10.950 -10.051
  815   HD22  LEU 107          HD21      LEU 107 -15.891 -11.806  -8.709
  816   HD23  LEU 107          HD22      LEU 107 -16.659 -10.369  -9.386
  817    H    GLU 108           HN       GLU 108 -21.442 -10.691 -10.330
  818    HA   GLU 108           HA       GLU 108 -22.915 -12.860  -8.994
  819    HB2  GLU 108           HB2      GLU 108 -23.468 -10.589  -8.233
  820    HB3  GLU 108           HB1      GLU 108 -23.881 -10.133  -9.879
  821    HG2  GLU 108           HG2      GLU 108 -25.702 -11.755  -9.878
  822    HG3  GLU 108           HG1      GLU 108 -25.286 -12.224  -8.230
  Start of MODEL   22
    1    H1   GLY   1           HT1      GLY   1 -10.686  -3.014  15.466
    2    H2   GLY   1           HT2      GLY   1  -9.324  -2.696  14.515
    3    H3   GLY   1           HT3      GLY   1  -9.891  -1.525  15.596
    4    HA2  GLY   1           HA1      GLY   1  -7.923  -2.610  16.476
    5    HA3  GLY   1           HA2      GLY   1  -9.336  -2.914  17.475
    6    H    SER   2           HN       SER   2 -10.563  -4.846  15.783
    7    HA   SER   2           HA       SER   2  -8.702  -7.091  16.182
    8    HG   SER   2           HG       SER   2 -11.131  -7.912  18.385
    9    HB2  SER   2           HB2      SER   2 -11.727  -7.069  16.144
   10    HB3  SER   2           HB1      SER   2 -10.728  -8.507  16.348
   11    H    HIS   3           HN       HIS   3  -9.307  -9.029  14.725
   12    HA   HIS   3           HA       HIS   3  -9.938  -8.098  12.010
   13    HD1  HIS   3           HD1      HIS   3  -7.212  -7.453  10.110
   14    HD2  HIS   3           HD2      HIS   3  -6.523  -7.701  14.200
   15    HE1  HIS   3           HE1      HIS   3  -5.641  -5.564  10.641
   16    HE2  HIS   3           HE2      HIS   3  -5.272  -5.705  13.130
   17    HB2  HIS   3           HB2      HIS   3  -7.659  -9.938  12.770
   18    HB3  HIS   3           HB1      HIS   3  -8.146  -9.554  11.123
   19    H    GLY   4           HN       GLY   4 -11.480  -9.261  11.075
   20    HA2  GLY   4           HA2      GLY   4 -11.677 -12.118  11.498
   21    HA3  GLY   4           HA1      GLY   4 -13.010 -11.190  12.170
   22    H    TYR   5           HN       TYR   5 -11.197 -10.637   9.180
   23    HA   TYR   5           HA       TYR   5 -13.739 -10.728   7.719
   24    HD1  TYR   5           HD1      TYR   5 -14.491  -8.167   6.736
   25    HD2  TYR   5           HD2      TYR   5 -10.709  -7.992   8.681
   26    HE1  TYR   5           HE1      TYR   5 -15.161  -6.074   7.840
   27    HE2  TYR   5           HE2      TYR   5 -11.370  -5.899   9.789
   28    HH   TYR   5           HH       TYR   5 -14.546  -4.795   9.896
   29    HB2  TYR   5           HB2      TYR   5 -11.068  -9.549   6.923
   30    HB3  TYR   5           HB1      TYR   5 -12.531  -9.500   5.944
   31    H    SER   6           HN       SER   6 -13.838 -13.015   7.603
   32    HA   SER   6           HA       SER   6 -11.741 -14.413   6.156
   33    HG   SER   6           HG       SER   6 -13.655 -17.407   6.781
   34    HB2  SER   6           HB2      SER   6 -12.792 -15.516   8.085
   35    HB3  SER   6           HB1      SER   6 -14.363 -15.424   7.289
   36    H    ASP   7           HN       ASP   7 -11.965 -13.298   4.151
   37    HA   ASP   7           HA       ASP   7 -12.674 -13.051   2.007
   38    HB2  ASP   7           HB2      ASP   7 -12.529 -15.510   2.007
   39    HB3  ASP   7           HB1      ASP   7 -14.192 -15.607   2.577
   40    H    ALA   8           HN       ALA   8 -13.853 -11.201   2.061
   41    HA   ALA   8           HA       ALA   8 -16.769 -11.522   2.314
   42    HB1  ALA   8           HB3      ALA   8 -15.168  -9.160   3.289
   43    HB2  ALA   8           HB1      ALA   8 -15.877 -10.410   4.311
   44    HB3  ALA   8           HB2      ALA   8 -16.920  -9.341   3.374
   45    H    SER   9           HN       SER   9 -16.986 -11.665   0.068
   46    HA   SER   9           HA       SER   9 -17.273 -10.918  -2.059
   47    HG   SER   9           HG       SER   9 -19.565  -8.614  -0.582
   48    HB2  SER   9           HB2      SER   9 -17.401  -8.248  -0.639
   49    HB3  SER   9           HB1      SER   9 -17.887  -8.521  -2.312
   50    H    GLY  10           HN       GLY  10 -14.523 -11.034  -0.856
   51    HA2  GLY  10           HA2      GLY  10 -12.544 -10.915  -2.194
   52    HA3  GLY  10           HA1      GLY  10 -13.206  -9.495  -2.987
   53    H    PHE  11           HN       PHE  11 -13.971  -8.031  -0.714
   54    HA   PHE  11           HA       PHE  11 -11.594  -6.699  -0.090
   55    HD1  PHE  11           HD1      PHE  11 -15.184  -6.170  -1.106
   56    HD2  PHE  11           HD2      PHE  11 -12.230  -3.743   0.762
   57    HE1  PHE  11           HE1      PHE  11 -15.636  -4.377  -2.730
   58    HE2  PHE  11           HE2      PHE  11 -12.677  -1.946  -0.857
   59    HZ   PHE  11           HZ       PHE  11 -14.374  -2.256  -2.601
   60    HB2  PHE  11           HB2      PHE  11 -14.339  -6.669   1.138
   61    HB3  PHE  11           HB1      PHE  11 -13.029  -5.720   1.832
   62    H    SER  12           HN       SER  12  -9.998  -7.168   1.251
   63    HA   SER  12           HA       SER  12 -10.463  -8.378   3.807
   64    HG   SER  12           HG       SER  12  -8.272 -11.191   3.322
   65    HB2  SER  12           HB2      SER  12 -10.488 -10.391   2.411
   66    HB3  SER  12           HB1      SER  12  -8.925  -9.947   1.725
   67    H    LEU  13           HN       LEU  13  -8.564  -8.478   5.124
   68    HA   LEU  13           HA       LEU  13  -6.583  -6.465   4.355
   69    HG   LEU  13           HG       LEU  13  -9.071  -6.593   6.358
   70    HB2  LEU  13           HB2      LEU  13  -6.939  -7.744   7.063
   71    HB3  LEU  13           HB1      LEU  13  -6.092  -6.257   6.683
   72   HD11  LEU  13          HD11      LEU  13  -8.467  -6.886   8.700
   73   HD12  LEU  13          HD12      LEU  13  -9.285  -5.343   8.447
   74   HD13  LEU  13          HD13      LEU  13  -7.534  -5.390   8.658
   75   HD21  LEU  13          HD23      LEU  13  -9.006  -4.112   6.377
   76   HD22  LEU  13          HD21      LEU  13  -8.169  -4.829   5.000
   77   HD23  LEU  13          HD22      LEU  13  -7.243  -4.196   6.360
   78    H    TYR  14           HN       TYR  14  -4.954  -7.411   3.232
   79    HA   TYR  14           HA       TYR  14  -3.682  -9.762   4.468
   80    HD1  TYR  14           HD1      TYR  14  -5.921  -8.341   1.297
   81    HD2  TYR  14           HD2      TYR  14  -1.898  -9.548   0.579
   82    HE1  TYR  14           HE1      TYR  14  -5.884  -6.999  -0.757
   83    HE2  TYR  14           HE2      TYR  14  -1.856  -8.203  -1.475
   84    HH   TYR  14           HH       TYR  14  -3.483  -7.293  -3.110
   85    HB2  TYR  14           HB2      TYR  14  -3.141 -10.620   2.259
   86    HB3  TYR  14           HB1      TYR  14  -4.878 -10.382   2.400
   87    H    SER  15           HN       SER  15  -1.400  -9.935   4.247
   88    HA   SER  15           HA       SER  15  -0.085  -7.380   3.595
   89    HG   SER  15           HG       SER  15   1.838  -6.935   5.917
   90    HB2  SER  15           HB2      SER  15  -0.086  -7.745   6.010
   91    HB3  SER  15           HB1      SER  15   0.637  -9.338   5.787
   92    H    VAL  16           HN       VAL  16   2.097  -7.498   2.854
   93    HA   VAL  16           HA       VAL  16   2.897 -10.100   1.735
   94    HB   VAL  16           HB       VAL  16   3.146  -7.483   0.248
   95   HG11  VAL  16          HG11      VAL  16   4.827  -9.141  -0.340
   96   HG12  VAL  16          HG12      VAL  16   3.684  -8.916  -1.664
   97   HG13  VAL  16          HG13      VAL  16   3.565 -10.338  -0.628
   98   HG21  VAL  16          HG23      VAL  16   0.790  -8.082   0.475
   99   HG22  VAL  16          HG21      VAL  16   1.131  -9.690  -0.165
  100   HG23  VAL  16          HG22      VAL  16   1.337  -8.270  -1.191
  101    H    GLU  17           HN       GLU  17   5.058 -10.547   1.863
  102    HA   GLU  17           HA       GLU  17   6.663  -8.718   3.450
  103    HB2  GLU  17           HB2      GLU  17   7.243 -11.521   2.479
  104    HB3  GLU  17           HB1      GLU  17   8.273 -10.593   3.561
  105    HG2  GLU  17           HG2      GLU  17   6.491 -10.544   5.225
  106    HG3  GLU  17           HG1      GLU  17   5.449 -11.464   4.140
  107    H    LEU  18           HN       LEU  18   7.834  -7.219   2.494
  108    HA   LEU  18           HA       LEU  18   9.194  -7.866  -0.040
  109    HG   LEU  18           HG       LEU  18   7.188  -5.323  -1.723
  110    HB2  LEU  18           HB2      LEU  18   7.474  -5.593   0.676
  111    HB3  LEU  18           HB1      LEU  18   8.986  -5.137  -0.081
  112   HD11  LEU  18          HD11      LEU  18   9.468  -5.806  -2.425
  113   HD12  LEU  18          HD12      LEU  18   8.311  -6.802  -3.308
  114   HD13  LEU  18          HD13      LEU  18   9.253  -7.502  -1.991
  115   HD21  LEU  18          HD23      LEU  18   5.844  -7.015  -0.559
  116   HD22  LEU  18          HD21      LEU  18   7.064  -8.230  -0.936
  117   HD23  LEU  18          HD22      LEU  18   6.159  -7.458  -2.237
  118    H    PHE  19           HN       PHE  19  11.322  -7.912   0.231
  119    HA   PHE  19           HA       PHE  19  12.513  -6.259   2.354
  120    HD1  PHE  19           HD2      PHE  19  11.694 -10.132   1.432
  121    HD2  PHE  19           HD1      PHE  19  15.313  -8.454  -0.052
  122    HE1  PHE  19           HE2      PHE  19  11.770 -11.854  -0.322
  123    HE2  PHE  19           HE1      PHE  19  15.395 -10.174  -1.810
  124    HZ   PHE  19           HZ       PHE  19  13.615 -11.881  -1.942
  125    HB2  PHE  19           HB2      PHE  19  14.468  -7.851   2.119
  126    HB3  PHE  19           HB1      PHE  19  12.987  -8.558   2.754
  127    H    ARG  20           HN       ARG  20  13.966  -4.702   1.872
  128    HA   ARG  20           HA       ARG  20  14.722  -4.447  -0.965
  129    HE   ARG  20           HE       ARG  20  15.633  -0.247   0.895
  130    HB2  ARG  20           HB2      ARG  20  13.382  -2.601   0.242
  131    HB3  ARG  20           HB1      ARG  20  14.898  -2.220   1.048
  132    HG2  ARG  20           HG2      ARG  20  15.953  -1.869  -1.145
  133    HG3  ARG  20           HG1      ARG  20  14.404  -2.193  -1.924
  134    HD2  ARG  20           HD2      ARG  20  14.648   0.168  -1.802
  135    HD3  ARG  20           HD1      ARG  20  13.447  -0.292  -0.596
  136   HH11  ARG  20          HH11      ARG  20  14.532   2.016  -1.514
  137   HH12  ARG  20          HH12      ARG  20  15.294   3.380  -0.767
  138   HH21  ARG  20          HH21      ARG  20  16.641   1.539   1.886
  139   HH22  ARG  20          HH22      ARG  20  16.492   3.108   1.169
  140    H    GLU  21           HN       GLU  21  16.637  -5.426  -1.221
  141    HA   GLU  21           HA       GLU  21  18.838  -4.563   0.529
  142    HB2  GLU  21           HB2      GLU  21  19.833  -6.853   0.174
  143    HB3  GLU  21           HB1      GLU  21  18.396  -6.805   1.186
  144    HG2  GLU  21           HG2      GLU  21  17.048  -7.494  -0.766
  145    HG3  GLU  21           HG1      GLU  21  18.536  -7.639  -1.702
  146    H    LYS  22           HN       LYS  22  17.607  -4.529  -2.520
  147    HA   LYS  22           HA       LYS  22  20.085  -4.872  -3.974
  148    HB2  LYS  22           HB2      LYS  22  17.290  -4.088  -4.777
  149    HB3  LYS  22           HB1      LYS  22  18.633  -3.999  -5.907
  150    HG2  LYS  22           HG2      LYS  22  17.530  -6.058  -6.286
  151    HG3  LYS  22           HG1      LYS  22  19.047  -6.430  -5.468
  152    HD2  LYS  22           HD2      LYS  22  17.838  -6.609  -3.336
  153    HD3  LYS  22           HD1      LYS  22  16.324  -6.263  -4.175
  154    HE2  LYS  22           HE2      LYS  22  18.132  -8.624  -4.687
  155    HE3  LYS  22           HE1      LYS  22  16.615  -8.663  -3.789
  156    HZ1  LYS  22           HZ3      LYS  22  16.318  -9.414  -6.064
  157    HZ2  LYS  22           HZ1      LYS  22  16.909  -7.943  -6.656
  158    HZ3  LYS  22           HZ2      LYS  22  15.453  -7.985  -5.796
  159    H    ASP  23           HN       ASP  23  20.957  -3.171  -5.364
  160    HA   ASP  23           HA       ASP  23  21.175  -0.685  -3.906
  161    HB2  ASP  23           HB2      ASP  23  22.508  -1.583  -6.471
  162    HB3  ASP  23           HB1      ASP  23  22.917  -0.131  -5.562
  163    H    THR  24           HN       THR  24  18.604  -1.200  -5.076
  164    HA   THR  24           HA       THR  24  18.436   0.602  -7.360
  165    HB   THR  24           HB       THR  24  16.108  -0.053  -7.524
  166    HG1  THR  24           HG1      THR  24  16.561  -0.912  -4.930
  167   HG21  THR  24          HG23      THR  24  17.842  -2.464  -6.968
  168   HG22  THR  24          HG21      THR  24  17.802  -1.562  -8.484
  169   HG23  THR  24          HG22      THR  24  16.371  -2.438  -7.942
  170    H    SER  25           HN       SER  25  17.913   0.580  -3.958
  171    HA   SER  25           HA       SER  25  17.202   2.132  -2.462
  172    HG   SER  25           HG       SER  25  19.849   3.799  -4.128
  173    HB2  SER  25           HB2      SER  25  17.850   4.040  -4.721
  174    HB3  SER  25           HB1      SER  25  17.600   4.501  -3.038
  175    H    SER  26           HN       SER  26  15.268   0.959  -4.422
  176    HA   SER  26           HA       SER  26  13.071   2.767  -3.803
  177    HG   SER  26           HG       SER  26  14.282   4.061  -5.295
  178    HB2  SER  26           HB2      SER  26  13.634   1.802  -6.617
  179    HB3  SER  26           HB1      SER  26  12.183   2.667  -6.108
  180    H    LEU  27           HN       LEU  27  10.962   1.761  -4.024
  181    HA   LEU  27           HA       LEU  27  11.116  -1.176  -3.834
  182    HG   LEU  27           HG       LEU  27  11.476   0.367  -1.303
  183    HB2  LEU  27           HB2      LEU  27   9.300   0.777  -2.430
  184    HB3  LEU  27           HB1      LEU  27   9.012  -0.950  -2.447
  185   HD11  LEU  27          HD11      LEU  27   9.089  -0.825   0.100
  186   HD12  LEU  27          HD12      LEU  27   9.455   0.896  -0.023
  187   HD13  LEU  27          HD13      LEU  27  10.536  -0.174   0.871
  188   HD21  LEU  27          HD23      LEU  27  11.888  -1.853  -0.334
  189   HD22  LEU  27          HD21      LEU  27  11.908  -1.888  -2.096
  190   HD23  LEU  27          HD22      LEU  27  10.502  -2.488  -1.219
  191    H    GLY  28           HN       GLY  28  10.214   1.185  -5.874
  192    HA2  GLY  28           HA2      GLY  28   8.917   1.175  -7.770
  193    HA3  GLY  28           HA1      GLY  28   8.622  -0.531  -7.475
  194    H    ILE  29           HN       ILE  29   7.826   1.756  -5.002
  195    HA   ILE  29           HA       ILE  29   4.988   1.169  -5.416
  196    HB   ILE  29           HB       ILE  29   6.331   2.468  -3.040
  197   HG12  ILE  29          HG12      ILE  29   5.336  -0.374  -3.360
  198   HG13  ILE  29          HG11      ILE  29   7.029   0.106  -3.430
  199   HG21  ILE  29          HG21      ILE  29   4.219   2.010  -1.886
  200   HG22  ILE  29          HG22      ILE  29   3.541   1.376  -3.385
  201   HG23  ILE  29          HG23      ILE  29   3.985   3.079  -3.269
  202   HD11  ILE  29          HD13      ILE  29   6.483  -0.813  -1.261
  203   HD12  ILE  29          HD11      ILE  29   5.200   0.378  -1.055
  204   HD13  ILE  29          HD12      ILE  29   6.883   0.899  -1.118
  205    H    SER  30           HN       SER  30   3.952   2.597  -6.670
  206    HA   SER  30           HA       SER  30   4.673   5.441  -6.450
  207    HG   SER  30           HG       SER  30   4.297   6.395  -9.285
  208    HB2  SER  30           HB2      SER  30   4.897   4.479  -8.708
  209    HB3  SER  30           HB1      SER  30   3.199   4.010  -8.674
  210    H    ILE  31           HN       ILE  31   3.420   6.190  -4.807
  211    HA   ILE  31           HA       ILE  31   0.628   5.461  -4.602
  212    HB   ILE  31           HB       ILE  31   0.591   7.002  -2.664
  213   HG12  ILE  31          HG12      ILE  31   3.542   7.355  -3.244
  214   HG13  ILE  31          HG11      ILE  31   2.313   8.579  -3.543
  215   HG21  ILE  31          HG21      ILE  31   2.090   5.663  -1.243
  216   HG22  ILE  31          HG22      ILE  31   2.841   4.993  -2.691
  217   HG23  ILE  31          HG23      ILE  31   1.143   4.664  -2.345
  218   HD11  ILE  31          HD13      ILE  31   3.504   9.025  -1.484
  219   HD12  ILE  31          HD11      ILE  31   3.059   7.437  -0.861
  220   HD13  ILE  31          HD12      ILE  31   1.813   8.650  -1.152
  221    H    SER  32           HN       SER  32  -1.084   7.076  -4.493
  222    HA   SER  32           HA       SER  32  -0.562   9.529  -6.009
  223    HG   SER  32           HG       SER  32  -3.323   9.786  -6.944
  224    HB2  SER  32           HB2      SER  32  -1.333   7.890  -7.654
  225    HB3  SER  32           HB1      SER  32  -2.753   7.544  -6.664
  226    H    GLY  33           HN       GLY  33  -2.100  11.200  -5.692
  227    HA2  GLY  33           HA2      GLY  33  -3.516  10.948  -3.135
  228    HA3  GLY  33           HA1      GLY  33  -3.074  12.454  -3.926
  229    H    MET  34           HN       MET  34  -5.675  11.244  -2.883
  230    HA   MET  34           HA       MET  34  -7.281  11.135  -5.303
  231    HB2  MET  34           HB2      MET  34  -7.703   9.585  -3.396
  232    HB3  MET  34           HB1      MET  34  -8.168  10.971  -2.418
  233    HG2  MET  34           HG2      MET  34 -10.002  11.445  -3.957
  234    HG3  MET  34           HG1      MET  34  -9.536  10.058  -4.939
  235    HE1  MET  34           HE3      MET  34  -9.623  10.449  -1.012
  236    HE2  MET  34           HE1      MET  34 -11.214   9.782  -0.648
  237    HE3  MET  34           HE2      MET  34 -11.076  11.286  -1.559
  238    H    ARG  35           HN       ARG  35  -8.124  12.889  -6.192
  239    HA   ARG  35           HA       ARG  35  -8.300  15.343  -4.612
  240    HE   ARG  35           HE       ARG  35  -7.027  14.016  -8.592
  241    HB2  ARG  35           HB2      ARG  35  -8.381  14.825  -7.582
  242    HB3  ARG  35           HB1      ARG  35  -8.733  16.398  -6.883
  243    HG2  ARG  35           HG2      ARG  35  -6.492  16.506  -7.532
  244    HG3  ARG  35           HG1      ARG  35  -6.444  16.253  -5.787
  245    HD2  ARG  35           HD2      ARG  35  -4.804  14.850  -6.919
  246    HD3  ARG  35           HD1      ARG  35  -6.045  13.868  -6.141
  247   HH11  ARG  35          HH11      ARG  35  -3.751  13.447  -7.545
  248   HH12  ARG  35          HH12      ARG  35  -3.342  12.482  -8.924
  249   HH21  ARG  35          HH21      ARG  35  -6.496  12.748 -10.409
  250   HH22  ARG  35          HH22      ARG  35  -4.902  12.086 -10.554
  251    H    ASP  36           HN       ASP  36 -10.166  14.934  -3.423
  252    HA   ASP  36           HA       ASP  36 -12.653  14.624  -4.959
  253    HB2  ASP  36           HB2      ASP  36 -13.685  13.969  -2.814
  254    HB3  ASP  36           HB1      ASP  36 -12.318  12.936  -3.224
  255    H    GLN  37           HN       GLN  37 -14.018  16.277  -5.147
  256    HA   GLN  37           HA       GLN  37 -13.455  18.716  -3.626
  257    HB2  GLN  37           HB2      GLN  37 -15.156  18.303  -6.089
  258    HB3  GLN  37           HB1      GLN  37 -14.833  19.852  -5.322
  259    HG2  GLN  37           HG2      GLN  37 -12.427  19.529  -5.781
  260    HG3  GLN  37           HG1      GLN  37 -12.823  18.043  -6.643
  261   HE21  GLN  37          HE21      GLN  37 -12.971  21.511  -6.676
  262   HE22  GLN  37          HE22      GLN  37 -13.399  21.683  -8.341
  263    H    SER  38           HN       SER  38 -15.056  16.233  -2.793
  264    HA   SER  38           HA       SER  38 -17.131  17.710  -1.439
  265    HG   SER  38           HG       SER  38 -17.892  17.218  -4.573
  266    HB2  SER  38           HB2      SER  38 -17.861  15.468  -3.338
  267    HB3  SER  38           HB1      SER  38 -18.968  16.230  -2.196
  268    H    THR  39           HN       THR  39 -17.417  16.924   0.547
  269    HA   THR  39           HA       THR  39 -16.122  14.386   1.217
  270    HB   THR  39           HB       THR  39 -16.336  15.124   3.568
  271    HG1  THR  39           HG1      THR  39 -17.052  17.303   3.918
  272   HG21  THR  39          HG23      THR  39 -14.318  15.689   2.308
  273   HG22  THR  39          HG21      THR  39 -14.721  16.968   3.453
  274   HG23  THR  39          HG22      THR  39 -15.079  17.175   1.740
  275    H    THR  40           HN       THR  40 -17.180  12.696   2.190
  276    HA   THR  40           HA       THR  40 -19.882  12.880   3.106
  277    HB   THR  40           HB       THR  40 -20.371  12.868   0.724
  278    HG1  THR  40           HG1      THR  40 -21.918  11.406   0.958
  279   HG21  THR  40          HG23      THR  40 -19.744  10.957  -0.689
  280   HG22  THR  40          HG21      THR  40 -18.795  10.292   0.640
  281   HG23  THR  40          HG22      THR  40 -18.327  11.824  -0.098
  282    H    GLY  41           HN       GLY  41 -16.968  11.664   3.389
  283    HA2  GLY  41           HA2      GLY  41 -17.358   9.827   5.314
  284    HA3  GLY  41           HA1      GLY  41 -17.597   8.872   3.858
  285    H    GLU  42           HN       GLU  42 -15.740   9.556   2.146
  286    HA   GLU  42           HA       GLU  42 -13.236   8.977   3.564
  287    HB2  GLU  42           HB2      GLU  42 -13.948   8.586   0.651
  288    HB3  GLU  42           HB1      GLU  42 -12.426   8.127   1.402
  289    HG2  GLU  42           HG2      GLU  42 -13.599   6.538   2.829
  290    HG3  GLU  42           HG1      GLU  42 -15.133   7.008   2.096
  291    H    ALA  43           HN       ALA  43 -11.681  10.456   3.665
  292    HA   ALA  43           HA       ALA  43 -11.732  12.682   1.734
  293    HB1  ALA  43           HB3      ALA  43 -12.507  13.431   3.927
  294    HB2  ALA  43           HB1      ALA  43 -10.965  14.175   3.503
  295    HB3  ALA  43           HB2      ALA  43 -11.013  12.844   4.659
  296    H    THR  44           HN       THR  44 -10.084  12.282   0.400
  297    HA   THR  44           HA       THR  44  -8.007  11.821  -0.395
  298    HB   THR  44           HB       THR  44  -6.130  12.838   0.728
  299    HG1  THR  44           HG1      THR  44  -6.564  12.161   2.868
  300   HG21  THR  44          HG23      THR  44  -8.632  14.487   1.110
  301   HG22  THR  44          HG21      THR  44  -7.687  14.360  -0.374
  302   HG23  THR  44          HG22      THR  44  -6.985  15.118   1.056
  303    H    GLY  45           HN       GLY  45  -5.655  10.973   0.601
  304    HA2  GLY  45           HA2      GLY  45  -5.217   9.216   2.510
  305    HA3  GLY  45           HA1      GLY  45  -6.350   8.289   1.537
  306    H    ILE  46           HN       ILE  46  -3.904   7.243   1.979
  307    HA   ILE  46           HA       ILE  46  -2.367   7.764  -0.474
  308    HB   ILE  46           HB       ILE  46  -1.504   6.273   2.008
  309   HG12  ILE  46          HG12      ILE  46  -1.813   8.666   2.451
  310   HG13  ILE  46          HG11      ILE  46  -0.106   8.238   2.478
  311   HG21  ILE  46          HG21      ILE  46   0.750   6.429   1.025
  312   HG22  ILE  46          HG22      ILE  46   0.044   7.127  -0.433
  313   HG23  ILE  46          HG23      ILE  46  -0.358   5.476   0.037
  314   HD11  ILE  46          HD13      ILE  46  -1.558   9.583   0.210
  315   HD12  ILE  46          HD11      ILE  46   0.151   9.149   0.226
  316   HD13  ILE  46          HD12      ILE  46  -0.462  10.356   1.356
  317    H    TYR  47           HN       TYR  47  -2.369   6.306  -2.058
  318    HA   TYR  47           HA       TYR  47  -2.737   3.489  -1.496
  319    HD1  TYR  47           HD1      TYR  47  -5.140   6.754  -2.062
  320    HD2  TYR  47           HD2      TYR  47  -4.769   3.985  -5.269
  321    HE1  TYR  47           HE1      TYR  47  -5.870   8.493  -3.639
  322    HE2  TYR  47           HE2      TYR  47  -5.497   5.716  -6.856
  323    HH   TYR  47           HH       TYR  47  -5.640   8.988  -6.072
  324    HB2  TYR  47           HB2      TYR  47  -4.629   3.221  -3.037
  325    HB3  TYR  47           HB1      TYR  47  -5.053   4.269  -1.688
  326    H    VAL  48           HN       VAL  48  -1.834   2.179  -3.025
  327    HA   VAL  48           HA       VAL  48  -0.027   3.398  -4.877
  328    HB   VAL  48           HB       VAL  48  -0.754   0.487  -4.517
  329   HG11  VAL  48          HG11      VAL  48   1.587   1.731  -5.954
  330   HG12  VAL  48          HG12      VAL  48   0.213   0.936  -6.719
  331   HG13  VAL  48          HG13      VAL  48   1.319   0.005  -5.707
  332   HG21  VAL  48          HG23      VAL  48   1.573   2.075  -3.438
  333   HG22  VAL  48          HG21      VAL  48   1.318   0.342  -3.232
  334   HG23  VAL  48          HG22      VAL  48   0.196   1.491  -2.503
  335    H    LYS  49           HN       LYS  49  -0.587   4.135  -6.808
  336    HA   LYS  49           HA       LYS  49  -2.894   2.938  -8.175
  337    HB2  LYS  49           HB2      LYS  49  -3.078   5.332  -7.798
  338    HB3  LYS  49           HB1      LYS  49  -1.528   5.605  -8.580
  339    HG2  LYS  49           HG2      LYS  49  -2.424   4.904 -10.704
  340    HG3  LYS  49           HG1      LYS  49  -3.958   4.469  -9.949
  341    HD2  LYS  49           HD2      LYS  49  -2.813   7.256  -9.906
  342    HD3  LYS  49           HD1      LYS  49  -3.935   6.684 -11.142
  343    HE2  LYS  49           HE2      LYS  49  -5.564   6.155  -9.357
  344    HE3  LYS  49           HE1      LYS  49  -4.449   6.838  -8.174
  345    HZ1  LYS  49           HZ3      LYS  49  -5.670   8.313 -10.444
  346    HZ2  LYS  49           HZ1      LYS  49  -4.611   8.967  -9.297
  347    HZ3  LYS  49           HZ2      LYS  49  -6.144   8.431  -8.825
  348    H    SER  50           HN       SER  50   0.526   3.411  -8.379
  349    HA   SER  50           HA       SER  50   0.570   1.833 -10.843
  350    HG   SER  50           HG       SER  50   3.051   3.939 -12.391
  351    HB2  SER  50           HB2      SER  50   0.770   4.171 -11.565
  352    HB3  SER  50           HB1      SER  50   2.131   4.400 -10.468
  353    H    LEU  51           HN       LEU  51   2.796   1.027 -11.335
  354    HA   LEU  51           HA       LEU  51   4.475   0.749  -8.947
  355    HG   LEU  51           HG       LEU  51   1.917  -0.856  -8.844
  356    HB2  LEU  51           HB2      LEU  51   3.482  -1.517 -10.676
  357    HB3  LEU  51           HB1      LEU  51   4.753  -1.674  -9.480
  358   HD11  LEU  51          HD11      LEU  51   2.001  -3.145  -9.681
  359   HD12  LEU  51          HD12      LEU  51   1.659  -3.112  -7.951
  360   HD13  LEU  51          HD13      LEU  51   3.274  -3.530  -8.523
  361   HD21  LEU  51          HD23      LEU  51   4.220  -1.662  -7.069
  362   HD22  LEU  51          HD21      LEU  51   2.579  -1.302  -6.533
  363   HD23  LEU  51          HD22      LEU  51   3.571  -0.032  -7.248
  364    H    ILE  52           HN       ILE  52   6.640  -0.169  -9.478
  365    HA   ILE  52           HA       ILE  52   7.514   0.811 -12.111
  366    HB   ILE  52           HB       ILE  52   9.145   0.440  -9.596
  367   HG12  ILE  52          HG12      ILE  52   7.567   2.294  -9.381
  368   HG13  ILE  52          HG11      ILE  52   9.210   2.907  -9.535
  369   HG21  ILE  52          HG21      ILE  52  10.899   1.649 -10.821
  370   HG22  ILE  52          HG22      ILE  52   9.886   1.628 -12.265
  371   HG23  ILE  52          HG23      ILE  52  10.484   0.116 -11.585
  372   HD11  ILE  52          HD13      ILE  52   7.147   2.807 -11.725
  373   HD12  ILE  52          HD11      ILE  52   8.793   3.420 -11.886
  374   HD13  ILE  52          HD12      ILE  52   7.647   4.238 -10.824
  375    HA   PRO  53           HA       PRO  53   7.931  -3.665 -12.904
  376    HB2  PRO  53           HB2      PRO  53   9.041  -2.520 -15.419
  377    HB3  PRO  53           HB1      PRO  53   7.838  -3.796 -15.197
  378    HG2  PRO  53           HG2      PRO  53   7.102  -1.358 -15.971
  379    HG3  PRO  53           HG1      PRO  53   6.112  -2.290 -14.831
  380    HD2  PRO  53           HD2      PRO  53   7.949   0.008 -14.313
  381    HD3  PRO  53           HD1      PRO  53   6.398  -0.392 -13.549
  382    H    GLY  54           HN       GLY  54   9.626  -4.897 -12.383
  383    HA2  GLY  54           HA2      GLY  54  11.893  -5.597 -12.616
  384    HA3  GLY  54           HA1      GLY  54  12.333  -3.938 -12.990
  385    H    SER  55           HN       SER  55  10.296  -3.588 -10.509
  386    HA   SER  55           HA       SER  55  12.488  -3.409  -8.590
  387    HG   SER  55           HG       SER  55  11.034  -1.003  -6.815
  388    HB2  SER  55           HB2      SER  55  11.052  -1.435  -8.897
  389    HB3  SER  55           HB1      SER  55   9.646  -2.379  -8.410
  390    H    ALA  56           HN       ALA  56  11.914  -3.947  -6.266
  391    HA   ALA  56           HA       ALA  56  11.474  -6.664  -5.978
  392    HB1  ALA  56           HB3      ALA  56  11.062  -4.515  -3.903
  393    HB2  ALA  56           HB1      ALA  56  12.595  -5.293  -4.299
  394    HB3  ALA  56           HB2      ALA  56  11.287  -6.235  -3.583
  395    H    ALA  57           HN       ALA  57   9.194  -4.063  -5.085
  396    HA   ALA  57           HA       ALA  57   7.041  -5.615  -4.342
  397    HB1  ALA  57           HB3      ALA  57   6.914  -2.974  -5.791
  398    HB2  ALA  57           HB1      ALA  57   7.161  -3.180  -4.058
  399    HB3  ALA  57           HB2      ALA  57   5.642  -3.687  -4.799
  400    H    ALA  58           HN       ALA  58   7.903  -4.502  -7.598
  401    HA   ALA  58           HA       ALA  58   5.613  -5.552  -8.890
  402    HB1  ALA  58           HB3      ALA  58   8.323  -4.919 -10.052
  403    HB2  ALA  58           HB1      ALA  58   6.991  -3.778  -9.859
  404    HB3  ALA  58           HB2      ALA  58   6.828  -5.147 -10.960
  405    H    LEU  59           HN       LEU  59   8.771  -6.902  -8.131
  406    HA   LEU  59           HA       LEU  59   8.658  -9.158  -9.807
  407    HG   LEU  59           HG       LEU  59  10.924  -7.453  -9.313
  408    HB2  LEU  59           HB2      LEU  59  10.117  -8.614  -7.234
  409    HB3  LEU  59           HB1      LEU  59  10.278 -10.135  -8.090
  410   HD11  LEU  59          HD11      LEU  59  12.769  -9.483  -8.065
  411   HD12  LEU  59          HD12      LEU  59  12.408  -7.877  -7.433
  412   HD13  LEU  59          HD13      LEU  59  13.271  -8.050  -8.961
  413   HD21  LEU  59          HD23      LEU  59  12.096  -8.809 -10.983
  414   HD22  LEU  59          HD21      LEU  59  10.377  -9.192 -10.928
  415   HD23  LEU  59          HD22      LEU  59  11.546 -10.276 -10.175
  416    H    ASP  60           HN       ASP  60   7.427  -8.591  -6.555
  417    HA   ASP  60           HA       ASP  60   6.795 -11.250  -5.911
  418    HB2  ASP  60           HB2      ASP  60   5.610  -8.631  -4.990
  419    HB3  ASP  60           HB1      ASP  60   5.117 -10.187  -4.330
  420    H    GLY  61           HN       GLY  61   4.870  -8.713  -7.478
  421    HA2  GLY  61           HA2      GLY  61   3.202  -9.001  -9.076
  422    HA3  GLY  61           HA1      GLY  61   3.295 -10.738  -8.824
  423    H    ARG  62           HN       ARG  62   3.003 -10.365  -5.880
  424    HA   ARG  62           HA       ARG  62   0.221 -10.710  -5.710
  425    HE   ARG  62           HE       ARG  62   0.376 -12.109  -1.934
  426    HB2  ARG  62           HB2      ARG  62   2.230 -10.058  -3.549
  427    HB3  ARG  62           HB1      ARG  62   0.577 -10.579  -3.253
  428    HG2  ARG  62           HG2      ARG  62   1.036 -12.705  -4.347
  429    HG3  ARG  62           HG1      ARG  62   2.688 -12.181  -4.684
  430    HD2  ARG  62           HD2      ARG  62   2.564 -13.647  -2.717
  431    HD3  ARG  62           HD1      ARG  62   3.157 -12.037  -2.311
  432   HH11  ARG  62          HH11      ARG  62   3.301 -13.406  -0.547
  433   HH12  ARG  62          HH12      ARG  62   2.641 -13.527   1.049
  434   HH21  ARG  62          HH21      ARG  62  -0.496 -12.265   0.167
  435   HH22  ARG  62          HH22      ARG  62   0.484 -12.882   1.455
  436    H    ILE  63           HN       ILE  63   2.139  -7.884  -5.797
  437    HA   ILE  63           HA       ILE  63   0.223  -6.189  -4.454
  438    HB   ILE  63           HB       ILE  63   2.728  -5.538  -6.012
  439   HG12  ILE  63          HG12      ILE  63   3.455  -4.781  -3.676
  440   HG13  ILE  63          HG11      ILE  63   2.051  -5.655  -3.074
  441   HG21  ILE  63          HG21      ILE  63   1.184  -3.695  -6.255
  442   HG22  ILE  63          HG22      ILE  63   2.474  -3.244  -5.140
  443   HG23  ILE  63          HG23      ILE  63   0.884  -3.681  -4.517
  444   HD11  ILE  63          HD13      ILE  63   2.922  -7.727  -3.930
  445   HD12  ILE  63          HD11      ILE  63   4.140  -6.941  -2.927
  446   HD13  ILE  63          HD12      ILE  63   4.275  -6.884  -4.684
  447    H    GLU  64           HN       GLU  64  -1.670  -5.940  -5.470
  448    HA   GLU  64           HA       GLU  64  -1.751  -5.640  -8.372
  449    HB2  GLU  64           HB2      GLU  64  -3.340  -7.141  -7.064
  450    HB3  GLU  64           HB1      GLU  64  -4.091  -5.669  -6.467
  451    HG2  GLU  64           HG2      GLU  64  -5.420  -6.333  -8.263
  452    HG3  GLU  64           HG1      GLU  64  -4.418  -5.033  -8.906
  453    HA   PRO  65           HA       PRO  65  -1.830  -1.191  -8.322
  454    HB2  PRO  65           HB2      PRO  65  -3.869  -1.554 -10.472
  455    HB3  PRO  65           HB1      PRO  65  -2.413  -0.551 -10.460
  456    HG2  PRO  65           HG2      PRO  65  -2.458  -2.838 -11.810
  457    HG3  PRO  65           HG1      PRO  65  -1.012  -2.349 -10.906
  458    HD2  PRO  65           HD2      PRO  65  -3.071  -4.399 -10.227
  459    HD3  PRO  65           HD1      PRO  65  -1.322  -4.409  -9.921
  460    H    ASN  66           HN       ASN  66  -3.286   0.577  -7.909
  461    HA   ASN  66           HA       ASN  66  -4.985   1.581  -6.785
  462    HB2  ASN  66           HB2      ASN  66  -6.656  -0.666  -7.935
  463    HB3  ASN  66           HB1      ASN  66  -7.264   0.859  -7.295
  464   HD21  ASN  66          HD21      ASN  66  -6.922   2.762  -8.462
  465   HD22  ASN  66          HD22      ASN  66  -6.521   2.738 -10.142
  466    H    ASP  67           HN       ASP  67  -3.406  -0.013  -5.234
  467    HA   ASP  67           HA       ASP  67  -5.174  -1.598  -3.536
  468    HB2  ASP  67           HB2      ASP  67  -3.082  -2.657  -4.074
  469    HB3  ASP  67           HB1      ASP  67  -2.175  -1.236  -3.562
  470    H    LYS  68           HN       LYS  68  -5.600  -1.133  -1.406
  471    HA   LYS  68           HA       LYS  68  -5.214   1.642  -0.625
  472    HB2  LYS  68           HB2      LYS  68  -7.453   0.679  -0.471
  473    HB3  LYS  68           HB1      LYS  68  -6.856  -0.581   0.597
  474    HG2  LYS  68           HG2      LYS  68  -7.912   0.975   1.989
  475    HG3  LYS  68           HG1      LYS  68  -6.183   1.279   2.180
  476    HD2  LYS  68           HD2      LYS  68  -6.381   3.098   0.495
  477    HD3  LYS  68           HD1      LYS  68  -8.127   2.836   0.483
  478    HE2  LYS  68           HE2      LYS  68  -7.651   4.667   1.945
  479    HE3  LYS  68           HE1      LYS  68  -8.150   3.286   2.922
  480    HZ1  LYS  68           HZ3      LYS  68  -5.822   2.834   3.398
  481    HZ2  LYS  68           HZ1      LYS  68  -6.240   4.398   3.888
  482    HZ3  LYS  68           HZ2      LYS  68  -5.349   4.166   2.470
  483    H    ILE  69           HN       ILE  69  -3.205   1.935   0.226
  484    HA   ILE  69           HA       ILE  69  -1.924   0.001   1.906
  485    HB   ILE  69           HB       ILE  69  -1.215   2.918   1.565
  486   HG12  ILE  69          HG12      ILE  69  -1.289   1.765  -0.609
  487   HG13  ILE  69          HG11      ILE  69   0.363   2.175  -0.158
  488   HG21  ILE  69          HG21      ILE  69   0.423   0.561   2.495
  489   HG22  ILE  69          HG22      ILE  69  -0.170   1.883   3.501
  490   HG23  ILE  69          HG23      ILE  69   1.029   2.198   2.247
  491   HD11  ILE  69          HD13      ILE  69  -0.889  -0.543   0.163
  492   HD12  ILE  69          HD11      ILE  69   0.789  -0.110   0.490
  493   HD13  ILE  69          HD12      ILE  69   0.169  -0.056  -1.160
  494    H    LEU  70           HN       LEU  70  -1.897  -0.151   4.092
  495    HA   LEU  70           HA       LEU  70  -3.526   1.808   5.567
  496    HG   LEU  70           HG       LEU  70  -4.515  -0.965   4.470
  497    HB2  LEU  70           HB2      LEU  70  -2.856  -1.044   6.294
  498    HB3  LEU  70           HB1      LEU  70  -3.855   0.042   7.241
  499   HD11  LEU  70          HD11      LEU  70  -5.663  -1.706   7.158
  500   HD12  LEU  70          HD12      LEU  70  -4.634  -2.725   6.153
  501   HD13  LEU  70          HD13      LEU  70  -6.243  -2.274   5.592
  502   HD21  LEU  70          HD23      LEU  70  -6.139   0.683   6.407
  503   HD22  LEU  70          HD21      LEU  70  -6.704   0.048   4.862
  504   HD23  LEU  70          HD22      LEU  70  -5.425   1.261   4.902
  505    H    ARG  71           HN       ARG  71  -0.729  -0.353   6.104
  506    HA   ARG  71           HA       ARG  71   0.761   1.816   7.272
  507    HE   ARG  71           HE       ARG  71   1.719  -0.434  10.823
  508    HB2  ARG  71           HB2      ARG  71   1.076   0.774   9.459
  509    HB3  ARG  71           HB1      ARG  71  -0.620   1.138   9.173
  510    HG2  ARG  71           HG2      ARG  71  -1.109  -1.156   8.728
  511    HG3  ARG  71           HG1      ARG  71   0.604  -1.578   8.754
  512    HD2  ARG  71           HD2      ARG  71  -1.016  -0.557  11.084
  513    HD3  ARG  71           HD1      ARG  71  -0.487  -2.221  10.836
  514   HH11  ARG  71          HH11      ARG  71  -0.537  -2.026  12.949
  515   HH12  ARG  71          HH12      ARG  71   0.536  -2.012  14.307
  516   HH21  ARG  71          HH21      ARG  71   3.139  -0.416  12.604
  517   HH22  ARG  71          HH22      ARG  71   2.627  -1.096  14.112
  518    H    VAL  72           HN       VAL  72   2.906   1.511   7.177
  519    HA   VAL  72           HA       VAL  72   3.870  -0.879   5.832
  520    HB   VAL  72           HB       VAL  72   5.527   1.498   6.674
  521   HG11  VAL  72          HG11      VAL  72   5.807  -0.535   4.468
  522   HG12  VAL  72          HG12      VAL  72   6.827  -0.363   5.898
  523   HG13  VAL  72          HG13      VAL  72   6.836   0.886   4.654
  524   HG21  VAL  72          HG23      VAL  72   5.034   2.555   4.552
  525   HG22  VAL  72          HG21      VAL  72   3.542   2.298   5.457
  526   HG23  VAL  72          HG22      VAL  72   3.954   1.231   4.116
  527    H    ASP  73           HN       ASP  73   6.157  -1.628   6.658
  528    HA   ASP  73           HA       ASP  73   5.933  -2.976   9.013
  529    HB2  ASP  73           HB2      ASP  73   7.731  -3.224   7.256
  530    HB3  ASP  73           HB1      ASP  73   8.560  -1.871   8.017
  531    H    ASP  74           HN       ASP  74   5.464  -2.216  10.963
  532    HA   ASP  74           HA       ASP  74   5.476  -0.990  12.876
  533    HB2  ASP  74           HB2      ASP  74   8.360  -0.653  12.047
  534    HB3  ASP  74           HB1      ASP  74   7.728  -0.172  13.619
  535    H    VAL  75           HN       VAL  75   4.759   0.407  10.390
  536    HA   VAL  75           HA       VAL  75   4.957   3.121  11.430
  537    HB   VAL  75           HB       VAL  75   5.787   2.420   8.606
  538   HG11  VAL  75          HG11      VAL  75   4.463   4.442   8.590
  539   HG12  VAL  75          HG12      VAL  75   6.161   4.847   8.339
  540   HG13  VAL  75          HG13      VAL  75   5.415   5.112   9.914
  541   HG21  VAL  75          HG23      VAL  75   7.929   3.451   9.239
  542   HG22  VAL  75          HG21      VAL  75   7.560   2.034  10.223
  543   HG23  VAL  75          HG22      VAL  75   7.333   3.652  10.886
  544    H    ASN  76           HN       ASN  76   3.139   4.305  11.067
  545    HA   ASN  76           HA       ASN  76   0.997   2.982   9.551
  546    HB2  ASN  76           HB2      ASN  76   0.780   5.196  11.604
  547    HB3  ASN  76           HB1      ASN  76  -0.559   4.326  10.861
  548   HD21  ASN  76          HD21      ASN  76  -0.975   2.203  11.473
  549   HD22  ASN  76          HD22      ASN  76  -0.321   1.522  12.920
  550    H    VAL  77           HN       VAL  77   0.138   3.897   7.761
  551    HA   VAL  77           HA       VAL  77   1.138   6.574   7.027
  552    HB   VAL  77           HB       VAL  77   0.808   5.938   4.681
  553   HG11  VAL  77          HG11      VAL  77   3.000   5.604   5.534
  554   HG12  VAL  77          HG12      VAL  77   2.602   4.183   4.570
  555   HG13  VAL  77          HG13      VAL  77   2.532   4.103   6.331
  556   HG21  VAL  77          HG23      VAL  77  -1.016   4.330   5.028
  557   HG22  VAL  77          HG21      VAL  77   0.129   3.205   5.757
  558   HG23  VAL  77          HG22      VAL  77   0.291   3.650   4.059
  559    H    GLN  78           HN       GLN  78  -1.289   5.864   8.597
  560    HA   GLN  78           HA       GLN  78  -3.439   6.679   6.798
  561    HB2  GLN  78           HB2      GLN  78  -3.393   5.645   9.625
  562    HB3  GLN  78           HB1      GLN  78  -4.848   6.319   8.904
  563    HG2  GLN  78           HG2      GLN  78  -3.312   4.031   7.707
  564    HG3  GLN  78           HG1      GLN  78  -4.660   3.827   8.826
  565   HE21  GLN  78          HE21      GLN  78  -4.399   2.982   6.048
  566   HE22  GLN  78          HE22      GLN  78  -5.711   3.713   5.197
  567    H    GLY  79           HN       GLY  79  -1.323   8.559   7.532
  568    HA2  GLY  79           HA2      GLY  79  -2.829  10.862   7.928
  569    HA3  GLY  79           HA1      GLY  79  -2.260  10.365   9.513
  570    H    MET  80           HN       MET  80  -0.522   9.996   6.463
  571    HA   MET  80           HA       MET  80   1.385  12.049   7.367
  572    HB2  MET  80           HB2      MET  80   2.096   9.379   6.137
  573    HB3  MET  80           HB1      MET  80   3.236  10.649   6.558
  574    HG2  MET  80           HG2      MET  80   2.419  10.423   8.933
  575    HG3  MET  80           HG1      MET  80   1.575   8.969   8.408
  576    HE1  MET  80           HE3      MET  80   3.707   7.970   6.180
  577    HE2  MET  80           HE1      MET  80   2.904   6.853   7.283
  578    HE3  MET  80           HE2      MET  80   4.659   6.819   7.117
  579    H    ALA  81           HN       ALA  81   2.297  13.320   5.796
  580    HA   ALA  81           HA       ALA  81   0.845  13.746   3.435
  581    HB1  ALA  81           HB3      ALA  81   2.600  15.331   2.841
  582    HB2  ALA  81           HB1      ALA  81   3.639  14.666   4.102
  583    HB3  ALA  81           HB2      ALA  81   2.146  15.497   4.537
  584    H    GLN  82           HN       GLN  82   1.697  13.681   1.212
  585    HA   GLN  82           HA       GLN  82   2.371  11.119   0.402
  586    HB2  GLN  82           HB2      GLN  82   1.375  12.800  -1.087
  587    HB3  GLN  82           HB1      GLN  82   2.875  13.716  -1.065
  588    HG2  GLN  82           HG2      GLN  82   4.033  11.913  -2.182
  589    HG3  GLN  82           HG1      GLN  82   2.581  10.916  -2.126
  590   HE21  GLN  82          HE21      GLN  82   0.859  11.393  -3.488
  591   HE22  GLN  82          HE22      GLN  82   1.031  12.425  -4.863
  592    H    SER  83           HN       SER  83   4.535  13.960   0.321
  593    HA   SER  83           HA       SER  83   6.871  12.607  -0.325
  594    HG   SER  83           HG       SER  83   6.502  16.164  -0.520
  595    HB2  SER  83           HB2      SER  83   6.562  15.114   1.343
  596    HB3  SER  83           HB1      SER  83   8.063  14.567   0.597
  597    H    ASP  84           HN       ASP  84   5.221  12.841   2.724
  598    HA   ASP  84           HA       ASP  84   7.418  12.135   4.383
  599    HB2  ASP  84           HB2      ASP  84   5.328  13.232   5.197
  600    HB3  ASP  84           HB1      ASP  84   4.472  11.717   4.927
  601    H    VAL  85           HN       VAL  85   4.649  10.225   3.182
  602    HA   VAL  85           HA       VAL  85   5.425   7.756   4.197
  603    HB   VAL  85           HB       VAL  85   3.996   8.190   1.571
  604   HG11  VAL  85          HG11      VAL  85   4.720   5.898   1.915
  605   HG12  VAL  85          HG12      VAL  85   2.967   6.015   2.071
  606   HG13  VAL  85          HG13      VAL  85   3.974   5.882   3.513
  607   HG21  VAL  85          HG23      VAL  85   2.880   8.070   4.371
  608   HG22  VAL  85          HG21      VAL  85   1.920   8.067   2.892
  609   HG23  VAL  85          HG22      VAL  85   2.896   9.475   3.306
  610    H    VAL  86           HN       VAL  86   6.347   9.361   1.188
  611    HA   VAL  86           HA       VAL  86   7.688   7.241  -0.037
  612    HB   VAL  86           HB       VAL  86   8.375  10.182  -0.193
  613   HG11  VAL  86          HG11      VAL  86   9.354   9.603  -2.377
  614   HG12  VAL  86          HG12      VAL  86   9.048   7.898  -2.044
  615   HG13  VAL  86          HG13      VAL  86  10.179   8.804  -1.039
  616   HG21  VAL  86          HG23      VAL  86   6.026   9.666  -0.762
  617   HG22  VAL  86          HG21      VAL  86   6.596   8.536  -1.988
  618   HG23  VAL  86          HG22      VAL  86   6.949  10.258  -2.142
  619    H    GLU  87           HN       GLU  87   9.053   9.872   1.950
  620    HA   GLU  87           HA       GLU  87  11.677   9.103   2.052
  621    HB2  GLU  87           HB2      GLU  87   9.973  10.311   4.232
  622    HB3  GLU  87           HB1      GLU  87  11.721  10.155   4.345
  623    HG2  GLU  87           HG2      GLU  87  10.238  11.708   2.237
  624    HG3  GLU  87           HG1      GLU  87  11.028  12.395   3.655
  625    H    VAL  88           HN       VAL  88   9.007   7.873   4.022
  626    HA   VAL  88           HA       VAL  88  10.444   6.264   5.783
  627    HB   VAL  88           HB       VAL  88   7.694   5.874   4.601
  628   HG11  VAL  88          HG11      VAL  88   9.006   4.345   6.845
  629   HG12  VAL  88          HG12      VAL  88   8.529   3.700   5.273
  630   HG13  VAL  88          HG13      VAL  88   7.298   4.255   6.412
  631   HG21  VAL  88          HG23      VAL  88   6.937   6.658   6.792
  632   HG22  VAL  88          HG21      VAL  88   7.964   7.853   6.000
  633   HG23  VAL  88          HG22      VAL  88   8.614   6.856   7.302
  634    H    LEU  89           HN       LEU  89   9.003   5.395   2.651
  635    HA   LEU  89           HA       LEU  89   9.843   2.751   2.561
  636    HG   LEU  89           HG       LEU  89   7.463   4.565   1.550
  637    HB2  LEU  89           HB2      LEU  89   9.554   4.656   0.233
  638    HB3  LEU  89           HB1      LEU  89   9.553   2.906   0.134
  639   HD11  LEU  89          HD11      LEU  89   6.001   3.910  -0.295
  640   HD12  LEU  89          HD12      LEU  89   7.358   3.114  -1.091
  641   HD13  LEU  89          HD13      LEU  89   7.371   4.863  -0.863
  642   HD21  LEU  89          HD23      LEU  89   7.749   2.363   2.552
  643   HD22  LEU  89          HD21      LEU  89   7.585   1.608   0.966
  644   HD23  LEU  89          HD22      LEU  89   6.219   2.464   1.682
  645    H    ARG  90           HN       ARG  90  11.601   5.698   1.988
  646    HA   ARG  90           HA       ARG  90  13.840   4.429   0.696
  647    HE   ARG  90           HE       ARG  90  11.185   7.417  -1.821
  648    HB2  ARG  90           HB2      ARG  90  13.845   7.157   1.973
  649    HB3  ARG  90           HB1      ARG  90  14.842   6.579   0.649
  650    HG2  ARG  90           HG2      ARG  90  11.867   6.991   0.495
  651    HG3  ARG  90           HG1      ARG  90  13.073   8.153  -0.052
  652    HD2  ARG  90           HD2      ARG  90  13.920   6.531  -1.664
  653    HD3  ARG  90           HD1      ARG  90  12.745   5.343  -1.097
  654   HH11  ARG  90          HH11      ARG  90  13.747   5.705  -3.452
  655   HH12  ARG  90          HH12      ARG  90  13.100   5.987  -5.034
  656   HH21  ARG  90          HH21      ARG  90  10.330   7.793  -3.902
  657   HH22  ARG  90          HH22      ARG  90  11.160   7.173  -5.290
  658    H    ASN  91           HN       ASN  91  12.913   5.305   3.939
  659    HA   ASN  91           HA       ASN  91  15.518   5.011   5.086
  660    HB2  ASN  91           HB2      ASN  91  12.792   5.000   6.400
  661    HB3  ASN  91           HB1      ASN  91  14.332   5.130   7.244
  662   HD21  ASN  91          HD21      ASN  91  12.024   6.959   7.083
  663   HD22  ASN  91          HD22      ASN  91  12.671   8.467   6.538
  664    H    ALA  92           HN       ALA  92  13.055   2.858   4.118
  665    HA   ALA  92           HA       ALA  92  13.287   0.746   5.895
  666    HB1  ALA  92           HB3      ALA  92  12.464  -0.677   4.108
  667    HB2  ALA  92           HB1      ALA  92  12.866   0.559   2.916
  668    HB3  ALA  92           HB2      ALA  92  11.608   0.864   4.113
  669    H    GLY  93           HN       GLY  93  14.596   0.148   2.679
  670    HA2  GLY  93           HA2      GLY  93  16.558  -0.832   1.994
  671    HA3  GLY  93           HA1      GLY  93  17.318  -0.013   3.348
  672    H    ASN  94           HN       ASN  94  14.738  -2.094   4.159
  673    HA   ASN  94           HA       ASN  94  16.460  -4.403   4.590
  674    HB2  ASN  94           HB2      ASN  94  15.552  -4.456   7.027
  675    HB3  ASN  94           HB1      ASN  94  16.894  -3.384   6.649
  676   HD21  ASN  94          HD21      ASN  94  13.587  -2.764   5.700
  677   HD22  ASN  94          HD22      ASN  94  13.340  -1.412   6.745
  678    HA   PRO  95           HA       PRO  95  12.789  -6.839   4.012
  679    HB2  PRO  95           HB2      PRO  95  13.025  -8.105   6.679
  680    HB3  PRO  95           HB1      PRO  95  13.025  -8.850   5.079
  681    HG2  PRO  95           HG2      PRO  95  15.271  -8.667   6.508
  682    HG3  PRO  95           HG1      PRO  95  15.283  -8.453   4.747
  683    HD2  PRO  95           HD2      PRO  95  15.402  -6.387   6.911
  684    HD3  PRO  95           HD1      PRO  95  16.287  -6.460   5.373
  685    H    VAL  96           HN       VAL  96  11.197  -5.258   4.089
  686    HA   VAL  96           HA       VAL  96   9.976  -4.709   6.705
  687    HB   VAL  96           HB       VAL  96   8.842  -2.816   5.568
  688   HG11  VAL  96          HG11      VAL  96  11.850  -2.830   5.349
  689   HG12  VAL  96          HG12      VAL  96  10.912  -2.447   6.792
  690   HG13  VAL  96          HG13      VAL  96  10.829  -1.393   5.381
  691   HG21  VAL  96          HG23      VAL  96   9.605  -2.117   3.354
  692   HG22  VAL  96          HG21      VAL  96   8.852  -3.710   3.295
  693   HG23  VAL  96          HG22      VAL  96  10.609  -3.561   3.237
  694    H    ARG  97           HN       ARG  97   7.676  -4.655   6.879
  695    HA   ARG  97           HA       ARG  97   6.367  -6.616   5.137
  696    HE   ARG  97           HE       ARG  97   2.323  -8.632   7.283
  697    HB2  ARG  97           HB2      ARG  97   6.452  -7.123   7.563
  698    HB3  ARG  97           HB1      ARG  97   5.561  -5.643   7.887
  699    HG2  ARG  97           HG2      ARG  97   3.652  -6.506   6.645
  700    HG3  ARG  97           HG1      ARG  97   4.547  -7.985   6.287
  701    HD2  ARG  97           HD2      ARG  97   4.689  -8.483   8.671
  702    HD3  ARG  97           HD1      ARG  97   3.829  -6.990   9.043
  703   HH11  ARG  97          HH11      ARG  97   3.270  -8.276  10.616
  704   HH12  ARG  97          HH12      ARG  97   1.868  -9.083  11.235
  705   HH21  ARG  97          HH21      ARG  97   0.473  -9.696   8.089
  706   HH22  ARG  97          HH22      ARG  97   0.279  -9.891   9.799
  707    H    LEU  98           HN       LEU  98   4.437  -6.152   4.130
  708    HA   LEU  98           HA       LEU  98   3.630  -3.317   4.176
  709    HG   LEU  98           HG       LEU  98   5.706  -4.773   2.293
  710    HB2  LEU  98           HB2      LEU  98   3.256  -5.257   1.902
  711    HB3  LEU  98           HB1      LEU  98   2.994  -3.525   1.875
  712   HD11  LEU  98          HD11      LEU  98   4.851  -5.440   0.118
  713   HD12  LEU  98          HD12      LEU  98   6.134  -4.243  -0.060
  714   HD13  LEU  98          HD13      LEU  98   4.449  -3.764  -0.254
  715   HD21  LEU  98          HD23      LEU  98   6.508  -2.548   1.668
  716   HD22  LEU  98          HD21      LEU  98   5.486  -2.486   3.105
  717   HD23  LEU  98          HD22      LEU  98   4.842  -1.983   1.541
  718    H    LEU  99           HN       LEU  99   1.869  -3.224   5.479
  719    HA   LEU  99           HA       LEU  99  -0.181  -5.299   5.238
  720    HG   LEU  99           HG       LEU  99  -2.309  -3.979   6.995
  721    HB2  LEU  99           HB2      LEU  99   0.614  -4.565   7.493
  722    HB3  LEU  99           HB1      LEU  99  -0.059  -2.978   7.167
  723   HD11  LEU  99          HD11      LEU  99  -0.913  -6.520   7.821
  724   HD12  LEU  99          HD12      LEU  99  -1.682  -6.211   6.265
  725   HD13  LEU  99          HD13      LEU  99  -2.658  -6.289   7.732
  726   HD21  LEU  99          HD23      LEU  99  -0.797  -4.550   9.539
  727   HD22  LEU  99          HD21      LEU  99  -2.555  -4.541   9.396
  728   HD23  LEU  99          HD22      LEU  99  -1.640  -3.062   9.112
  729    H    LEU 100           HN       LEU 100  -1.657  -4.990   3.708
  730    HA   LEU 100           HA       LEU 100  -2.915  -2.364   3.480
  731    HG   LEU 100           HG       LEU 100  -0.359  -4.252   1.902
  732    HB2  LEU 100           HB2      LEU 100  -2.832  -2.855   0.890
  733    HB3  LEU 100           HB1      LEU 100  -1.532  -2.008   1.706
  734   HD11  LEU 100          HD11      LEU 100  -2.302  -5.670   1.500
  735   HD12  LEU 100          HD12      LEU 100  -1.021  -5.985   0.329
  736   HD13  LEU 100          HD13      LEU 100  -2.431  -5.035  -0.140
  737   HD21  LEU 100          HD23      LEU 100   0.510  -4.152  -0.365
  738   HD22  LEU 100          HD21      LEU 100   0.292  -2.527   0.288
  739   HD23  LEU 100          HD22      LEU 100  -0.871  -3.177  -0.867
  740    H    ILE 101           HN       ILE 101  -4.872  -2.444   2.062
  741    HA   ILE 101           HA       ILE 101  -6.209  -5.063   2.253
  742    HB   ILE 101           HB       ILE 101  -7.201  -3.662   3.915
  743   HG12  ILE 101          HG12      ILE 101  -8.930  -3.715   1.429
  744   HG13  ILE 101          HG11      ILE 101  -8.802  -4.986   2.639
  745   HG21  ILE 101          HG21      ILE 101  -7.634  -1.569   1.796
  746   HG22  ILE 101          HG22      ILE 101  -6.343  -1.528   2.996
  747   HG23  ILE 101          HG23      ILE 101  -8.028  -1.444   3.510
  748   HD11  ILE 101          HD13      ILE 101  -9.933  -2.231   3.076
  749   HD12  ILE 101          HD11      ILE 101  -9.799  -3.497   4.298
  750   HD13  ILE 101          HD12      ILE 101 -10.852  -3.727   2.903
  751    H    ARG 102           HN       ARG 102  -7.353  -5.747   0.501
  752    HA   ARG 102           HA       ARG 102  -8.170  -4.008  -1.607
  753    HE   ARG 102           HE       ARG 102  -7.222  -4.292  -6.245
  754    HB2  ARG 102           HB2      ARG 102  -5.785  -4.040  -2.121
  755    HB3  ARG 102           HB1      ARG 102  -5.789  -5.796  -2.119
  756    HG2  ARG 102           HG2      ARG 102  -5.776  -5.025  -4.379
  757    HG3  ARG 102           HG1      ARG 102  -7.345  -5.755  -4.042
  758    HD2  ARG 102           HD2      ARG 102  -8.313  -3.537  -3.714
  759    HD3  ARG 102           HD1      ARG 102  -6.741  -2.799  -4.017
  760   HH11  ARG 102          HH11      ARG 102  -8.951  -1.778  -4.560
  761   HH12  ARG 102          HH12      ARG 102  -9.724  -1.176  -5.988
  762   HH21  ARG 102          HH21      ARG 102  -8.235  -3.506  -8.129
  763   HH22  ARG 102          HH22      ARG 102  -9.320  -2.161  -8.017
  764    H    ARG 103           HN       ARG 103  -9.541  -5.007  -3.065
  765    HA   ARG 103           HA       ARG 103 -10.871  -7.307  -2.161
  766    HE   ARG 103           HE       ARG 103 -13.722  -5.155  -4.457
  767    HB2  ARG 103           HB2      ARG 103 -11.962  -5.581  -3.523
  768    HB3  ARG 103           HB1      ARG 103 -10.948  -6.013  -4.893
  769    HG2  ARG 103           HG2      ARG 103 -11.954  -8.309  -4.787
  770    HG3  ARG 103           HG1      ARG 103 -13.092  -7.673  -3.599
  771    HD2  ARG 103           HD2      ARG 103 -12.718  -6.646  -6.411
  772    HD3  ARG 103           HD1      ARG 103 -14.040  -7.675  -5.859
  773   HH11  ARG 103          HH11      ARG 103 -15.332  -6.923  -6.992
  774   HH12  ARG 103          HH12      ARG 103 -16.673  -5.832  -7.077
  775   HH21  ARG 103          HH21      ARG 103 -15.483  -3.710  -4.565
  776   HH22  ARG 103          HH22      ARG 103 -16.757  -4.003  -5.701
  777    H    LEU 104           HN       LEU 104 -10.933  -9.402  -2.895
  778    HA   LEU 104           HA       LEU 104  -8.606 -10.255  -4.487
  779    HG   LEU 104           HG       LEU 104  -8.850  -9.893  -1.582
  780    HB2  LEU 104           HB2      LEU 104 -10.209 -11.970  -2.600
  781    HB3  LEU 104           HB1      LEU 104  -8.633 -12.310  -3.287
  782   HD11  LEU 104          HD11      LEU 104 -10.149 -11.409  -0.263
  783   HD12  LEU 104          HD12      LEU 104  -8.540 -11.291   0.452
  784   HD13  LEU 104          HD13      LEU 104  -8.978 -12.705  -0.507
  785   HD21  LEU 104          HD23      LEU 104  -6.742 -10.517  -2.634
  786   HD22  LEU 104          HD21      LEU 104  -6.809 -12.098  -1.856
  787   HD23  LEU 104          HD22      LEU 104  -6.628 -10.642  -0.879
  788    HA   PRO 105           HA       PRO 105 -11.478 -11.894  -7.450
  789    HB2  PRO 105           HB2      PRO 105  -9.899 -13.551  -8.825
  790    HB3  PRO 105           HB1      PRO 105  -9.622 -11.805  -8.845
  791    HG2  PRO 105           HG2      PRO 105  -8.218 -13.927  -7.272
  792    HG3  PRO 105           HG1      PRO 105  -7.532 -12.535  -8.132
  793    HD2  PRO 105           HD2      PRO 105  -8.010 -12.605  -5.421
  794    HD3  PRO 105           HD1      PRO 105  -7.927 -11.117  -6.382
  795    H    LEU 106           HN       LEU 106 -12.558 -13.840  -8.120
  796    HA   LEU 106           HA       LEU 106 -12.121 -16.207  -6.455
  797    HG   LEU 106           HG       LEU 106 -13.312 -13.943  -4.886
  798    HB2  LEU 106           HB2      LEU 106 -14.753 -14.762  -6.753
  799    HB3  LEU 106           HB1      LEU 106 -14.600 -16.385  -6.110
  800   HD11  LEU 106          HD11      LEU 106 -15.039 -14.135  -3.160
  801   HD12  LEU 106          HD12      LEU 106 -15.815 -15.421  -4.082
  802   HD13  LEU 106          HD13      LEU 106 -15.735 -13.788  -4.743
  803   HD21  LEU 106          HD23      LEU 106 -13.646 -16.760  -3.856
  804   HD22  LEU 106          HD21      LEU 106 -12.937 -15.409  -2.969
  805   HD23  LEU 106          HD22      LEU 106 -12.139 -16.033  -4.413
  806    H    LEU 107           HN       LEU 107 -11.863 -17.855  -7.788
  807    HA   LEU 107           HA       LEU 107 -12.647 -17.779 -10.519
  808    HG   LEU 107           HG       LEU 107  -9.984 -18.348  -8.967
  809    HB2  LEU 107           HB2      LEU 107 -11.706 -20.106  -8.846
  810    HB3  LEU 107           HB1      LEU 107 -11.831 -20.099 -10.594
  811   HD11  LEU 107          HD11      LEU 107  -8.209 -19.735  -9.926
  812   HD12  LEU 107          HD12      LEU 107  -9.428 -20.766 -10.675
  813   HD13  LEU 107          HD13      LEU 107  -9.307 -20.677  -8.918
  814   HD21  LEU 107          HD23      LEU 107 -10.679 -17.252 -11.021
  815   HD22  LEU 107          HD21      LEU 107 -10.263 -18.690 -11.952
  816   HD23  LEU 107          HD22      LEU 107  -8.998 -17.769 -11.139
  817    H    GLU 108           HN       GLU 108 -14.727 -17.862 -11.084
  818    HA   GLU 108           HA       GLU 108 -16.301 -20.157 -10.240
  819    HB2  GLU 108           HB2      GLU 108 -18.289 -18.634  -9.805
  820    HB3  GLU 108           HB1      GLU 108 -17.032 -18.649  -8.577
  821    HG2  GLU 108           HG2      GLU 108 -16.132 -16.563  -9.468
  822    HG3  GLU 108           HG1      GLU 108 -17.391 -16.547 -10.702
  Start of MODEL   23
    1    H1   GLY   1           HT1      GLY   1 -10.150  -1.948  19.691
    2    H2   GLY   1           HT2      GLY   1 -11.356  -0.781  19.481
    3    H3   GLY   1           HT3      GLY   1 -10.096  -0.905  18.360
    4    HA2  GLY   1           HA1      GLY   1 -10.856  -3.092  17.685
    5    HA3  GLY   1           HA2      GLY   1 -12.153  -2.985  18.866
    6    H    SER   2           HN       SER   2 -11.113  -2.181  15.705
    7    HA   SER   2           HA       SER   2 -13.773  -1.220  15.060
    8    HG   SER   2           HG       SER   2 -13.499   0.707  16.288
    9    HB2  SER   2           HB2      SER   2 -11.317   0.468  14.521
   10    HB3  SER   2           HB1      SER   2 -12.938   0.806  13.916
   11    H    HIS   3           HN       HIS   3 -10.479  -1.546  13.731
   12    HA   HIS   3           HA       HIS   3 -11.585  -2.443  11.190
   13    HD1  HIS   3           HD1      HIS   3  -8.997   0.417  12.856
   14    HD2  HIS   3           HD2      HIS   3 -10.565  -0.224   9.062
   15    HE1  HIS   3           HE1      HIS   3  -9.505   2.705  11.944
   16    HE2  HIS   3           HE2      HIS   3 -10.389   2.297   9.619
   17    HB2  HIS   3           HB2      HIS   3  -8.713  -1.982  12.025
   18    HB3  HIS   3           HB1      HIS   3  -9.257  -2.351  10.391
   19    H    GLY   4           HN       GLY   4 -12.400  -4.482  11.626
   20    HA2  GLY   4           HA2      GLY   4 -10.367  -6.566  11.872
   21    HA3  GLY   4           HA1      GLY   4 -11.635  -6.547  13.089
   22    H    TYR   5           HN       TYR   5 -10.939  -6.974   9.676
   23    HA   TYR   5           HA       TYR   5 -13.580  -8.232   9.334
   24    HD1  TYR   5           HD1      TYR   5 -15.347  -6.621   7.781
   25    HD2  TYR   5           HD2      TYR   5 -11.473  -4.866   7.888
   26    HE1  TYR   5           HE1      TYR   5 -16.367  -4.403   8.078
   27    HE2  TYR   5           HE2      TYR   5 -12.482  -2.643   8.185
   28    HH   TYR   5           HH       TYR   5 -14.617  -1.515   7.743
   29    HB2  TYR   5           HB2      TYR   5 -11.731  -7.125   7.210
   30    HB3  TYR   5           HB1      TYR   5 -13.324  -7.819   6.933
   31    H    SER   6           HN       SER   6 -13.617 -10.085   7.794
   32    HA   SER   6           HA       SER   6 -11.122 -11.564   7.554
   33    HG   SER   6           HG       SER   6 -12.217 -12.633  10.801
   34    HB2  SER   6           HB2      SER   6 -13.520 -12.684   9.027
   35    HB3  SER   6           HB1      SER   6 -12.070 -13.592   8.598
   36    H    ASP   7           HN       ASP   7 -11.419 -11.267   5.322
   37    HA   ASP   7           HA       ASP   7 -12.135 -11.768   3.224
   38    HB2  ASP   7           HB2      ASP   7 -13.151 -14.258   4.610
   39    HB3  ASP   7           HB1      ASP   7 -12.981 -14.065   2.868
   40    H    ALA   8           HN       ALA   8 -13.629 -10.045   3.129
   41    HA   ALA   8           HA       ALA   8 -16.439 -10.920   3.247
   42    HB1  ALA   8           HB3      ALA   8 -15.407  -8.192   4.011
   43    HB2  ALA   8           HB1      ALA   8 -15.952  -9.437   5.135
   44    HB3  ALA   8           HB2      ALA   8 -17.094  -8.705   4.009
   45    H    SER   9           HN       SER   9 -16.835 -11.222   1.122
   46    HA   SER   9           HA       SER   9 -17.206 -10.766  -1.073
   47    HG   SER   9           HG       SER   9 -17.532  -8.980  -2.553
   48    HB2  SER   9           HB2      SER   9 -18.592  -8.961  -0.090
   49    HB3  SER   9           HB1      SER   9 -17.197  -7.884  -0.148
   50    H    GLY  10           HN       GLY  10 -14.444 -10.893  -0.063
   51    HA2  GLY  10           HA2      GLY  10 -12.499 -10.953  -1.420
   52    HA3  GLY  10           HA1      GLY  10 -13.169  -9.651  -2.393
   53    H    PHE  11           HN       PHE  11 -13.770  -7.738  -0.580
   54    HA   PHE  11           HA       PHE  11 -11.336  -6.477  -0.107
   55    HD1  PHE  11           HD2      PHE  11 -11.349  -3.676   0.215
   56    HD2  PHE  11           HD1      PHE  11 -14.944  -5.404  -1.267
   57    HE1  PHE  11           HE2      PHE  11 -11.377  -2.038  -1.623
   58    HE2  PHE  11           HE1      PHE  11 -14.977  -3.771  -3.107
   59    HZ   PHE  11           HZ       PHE  11 -13.179  -2.070  -3.273
   60    HB2  PHE  11           HB2      PHE  11 -14.133  -6.030   0.834
   61    HB3  PHE  11           HB1      PHE  11 -12.834  -5.137   1.618
   62    H    SER  12           HN       SER  12  -9.784  -7.312   1.134
   63    HA   SER  12           HA       SER  12 -10.424  -7.859   3.932
   64    HG   SER  12           HG       SER  12  -8.851 -11.042   4.084
   65    HB2  SER  12           HB2      SER  12 -10.490 -10.048   2.848
   66    HB3  SER  12           HB1      SER  12  -8.893  -9.771   2.152
   67    H    LEU  13           HN       LEU  13  -8.568  -7.885   5.326
   68    HA   LEU  13           HA       LEU  13  -6.505  -6.024   4.427
   69    HG   LEU  13           HG       LEU  13  -8.996  -5.872   6.321
   70    HB2  LEU  13           HB2      LEU  13  -6.942  -7.100   7.211
   71    HB3  LEU  13           HB1      LEU  13  -6.022  -5.682   6.748
   72   HD11  LEU  13          HD11      LEU  13  -8.554  -6.174   8.696
   73   HD12  LEU  13          HD12      LEU  13  -9.255  -4.585   8.384
   74   HD13  LEU  13          HD13      LEU  13  -7.526  -4.740   8.697
   75   HD21  LEU  13          HD23      LEU  13  -7.085  -3.546   6.488
   76   HD22  LEU  13          HD21      LEU  13  -8.829  -3.434   6.249
   77   HD23  LEU  13          HD22      LEU  13  -7.816  -4.187   5.016
   78    H    TYR  14           HN       TYR  14  -4.918  -7.118   3.367
   79    HA   TYR  14           HA       TYR  14  -3.717  -9.404   4.784
   80    HD1  TYR  14           HD1      TYR  14  -5.852  -8.169   1.477
   81    HD2  TYR  14           HD2      TYR  14  -1.805  -9.395   0.950
   82    HE1  TYR  14           HE1      TYR  14  -5.752  -6.917  -0.635
   83    HE2  TYR  14           HE2      TYR  14  -1.700  -8.147  -1.160
   84    HH   TYR  14           HH       TYR  14  -3.289  -7.316  -2.895
   85    HB2  TYR  14           HB2      TYR  14  -3.151 -10.402   2.643
   86    HB3  TYR  14           HB1      TYR  14  -4.884 -10.107   2.722
   87    H    SER  15           HN       SER  15  -1.466  -9.597   4.750
   88    HA   SER  15           HA       SER  15  -0.058  -7.117   4.016
   89    HG   SER  15           HG       SER  15  -0.104  -9.598   6.889
   90    HB2  SER  15           HB2      SER  15   1.567  -7.692   5.786
   91    HB3  SER  15           HB1      SER  15  -0.066  -7.528   6.429
   92    H    VAL  16           HN       VAL  16   1.944  -7.234   3.007
   93    HA   VAL  16           HA       VAL  16   2.658  -9.878   1.912
   94    HB   VAL  16           HB       VAL  16   3.118  -7.241   0.520
   95   HG11  VAL  16          HG11      VAL  16   3.219 -10.085  -0.475
   96   HG12  VAL  16          HG12      VAL  16   4.613  -9.063  -0.126
   97   HG13  VAL  16          HG13      VAL  16   3.514  -8.638  -1.439
   98   HG21  VAL  16          HG23      VAL  16   1.224  -7.811  -0.921
   99   HG22  VAL  16          HG21      VAL  16   0.719  -7.603   0.755
  100   HG23  VAL  16          HG22      VAL  16   0.887  -9.222   0.079
  101    H    GLU  17           HN       GLU  17   4.747 -10.511   2.078
  102    HA   GLU  17           HA       GLU  17   6.517  -8.791   3.625
  103    HB2  GLU  17           HB2      GLU  17   6.739 -11.697   2.839
  104    HB3  GLU  17           HB1      GLU  17   7.931 -10.837   3.804
  105    HG2  GLU  17           HG2      GLU  17   6.241 -10.419   5.517
  106    HG3  GLU  17           HG1      GLU  17   5.052 -11.292   4.552
  107    H    LEU  18           HN       LEU  18   7.767  -7.441   2.549
  108    HA   LEU  18           HA       LEU  18   9.031  -8.363   0.051
  109    HG   LEU  18           HG       LEU  18   7.421  -5.520  -1.573
  110    HB2  LEU  18           HB2      LEU  18   7.790  -5.796   0.817
  111    HB3  LEU  18           HB1      LEU  18   9.314  -5.664  -0.041
  112   HD11  LEU  18          HD11      LEU  18   9.537  -6.512  -2.340
  113   HD12  LEU  18          HD12      LEU  18   8.138  -7.173  -3.185
  114   HD13  LEU  18          HD13      LEU  18   8.924  -8.109  -1.914
  115   HD21  LEU  18          HD23      LEU  18   5.806  -6.841  -0.328
  116   HD22  LEU  18          HD21      LEU  18   6.754  -8.300  -0.613
  117   HD23  LEU  18          HD22      LEU  18   5.986  -7.469  -1.967
  118    H    PHE  19           HN       PHE  19  11.185  -7.277  -0.369
  119    HA   PHE  19           HA       PHE  19  12.626  -6.422   1.990
  120    HD1  PHE  19           HD2      PHE  19  11.412 -10.117   0.743
  121    HD2  PHE  19           HD1      PHE  19  15.297  -8.788  -0.380
  122    HE1  PHE  19           HE2      PHE  19  11.423 -11.731  -1.114
  123    HE2  PHE  19           HE1      PHE  19  15.314 -10.397  -2.241
  124    HZ   PHE  19           HZ       PHE  19  13.376 -11.872  -2.609
  125    HB2  PHE  19           HB2      PHE  19  14.369  -8.189   1.740
  126    HB3  PHE  19           HB1      PHE  19  12.807  -8.808   2.266
  127    H    ARG  20           HN       ARG  20  14.309  -5.108   1.525
  128    HA   ARG  20           HA       ARG  20  15.113  -4.933  -1.312
  129    HE   ARG  20           HE       ARG  20  14.561  -0.552   0.420
  130    HB2  ARG  20           HB2      ARG  20  13.740  -2.996  -0.584
  131    HB3  ARG  20           HB1      ARG  20  14.932  -2.647   0.660
  132    HG2  ARG  20           HG2      ARG  20  16.545  -1.997  -0.896
  133    HG3  ARG  20           HG1      ARG  20  15.699  -2.775  -2.233
  134    HD2  ARG  20           HD2      ARG  20  15.465  -0.352  -2.337
  135    HD3  ARG  20           HD1      ARG  20  13.907  -1.129  -2.067
  136   HH11  ARG  20          HH11      ARG  20  14.898   1.392  -2.451
  137   HH12  ARG  20          HH12      ARG  20  14.721   2.895  -1.609
  138   HH21  ARG  20          HH21      ARG  20  14.329   1.423   1.537
  139   HH22  ARG  20          HH22      ARG  20  14.400   2.913   0.656
  140    H    GLU  21           HN       GLU  21  17.275  -4.763  -1.769
  141    HA   GLU  21           HA       GLU  21  19.219  -4.228   0.275
  142    HB2  GLU  21           HB2      GLU  21  20.366  -6.419   0.097
  143    HB3  GLU  21           HB1      GLU  21  18.779  -6.530   0.845
  144    HG2  GLU  21           HG2      GLU  21  17.834  -7.355  -1.230
  145    HG3  GLU  21           HG1      GLU  21  19.399  -7.192  -2.025
  146    H    LYS  22           HN       LYS  22  18.407  -3.353  -2.448
  147    HA   LYS  22           HA       LYS  22  21.027  -3.677  -3.760
  148    HB2  LYS  22           HB2      LYS  22  18.312  -3.405  -5.061
  149    HB3  LYS  22           HB1      LYS  22  19.841  -3.347  -5.928
  150    HG2  LYS  22           HG2      LYS  22  18.848  -5.695  -4.324
  151    HG3  LYS  22           HG1      LYS  22  18.747  -5.537  -6.079
  152    HD2  LYS  22           HD2      LYS  22  21.179  -5.442  -6.224
  153    HD3  LYS  22           HD1      LYS  22  21.300  -5.546  -4.467
  154    HE2  LYS  22           HE2      LYS  22  20.264  -7.754  -4.519
  155    HE3  LYS  22           HE1      LYS  22  20.101  -7.646  -6.271
  156    HZ1  LYS  22           HZ3      LYS  22  22.662  -7.667  -4.766
  157    HZ2  LYS  22           HZ1      LYS  22  22.514  -7.546  -6.447
  158    HZ3  LYS  22           HZ2      LYS  22  22.027  -8.957  -5.654
  159    H    ASP  23           HN       ASP  23  21.551  -1.837  -5.258
  160    HA   ASP  23           HA       ASP  23  21.016   0.656  -3.862
  161    HB2  ASP  23           HB2      ASP  23  23.337   0.009  -4.524
  162    HB3  ASP  23           HB1      ASP  23  22.855   0.155  -6.211
  163    H    THR  24           HN       THR  24  18.727   0.561  -4.605
  164    HA   THR  24           HA       THR  24  18.475   1.789  -7.273
  165    HB   THR  24           HB       THR  24  16.291   0.770  -7.545
  166    HG1  THR  24           HG1      THR  24  16.572  -0.905  -5.336
  167   HG21  THR  24          HG23      THR  24  16.937  -1.569  -7.769
  168   HG22  THR  24          HG21      THR  24  18.319  -1.306  -6.706
  169   HG23  THR  24          HG22      THR  24  18.256  -0.517  -8.281
  170    H    SER  25           HN       SER  25  17.670   1.841  -3.918
  171    HA   SER  25           HA       SER  25  16.639   3.348  -2.573
  172    HG   SER  25           HG       SER  25  16.622   6.795  -3.514
  173    HB2  SER  25           HB2      SER  25  18.277   4.880  -3.620
  174    HB3  SER  25           HB1      SER  25  17.105   5.248  -4.885
  175    H    SER  26           HN       SER  26  15.071   1.798  -4.606
  176    HA   SER  26           HA       SER  26  12.568   3.204  -4.193
  177    HG   SER  26           HG       SER  26  14.318   4.444  -6.257
  178    HB2  SER  26           HB2      SER  26  13.502   2.438  -6.969
  179    HB3  SER  26           HB1      SER  26  11.886   3.013  -6.563
  180    H    LEU  27           HN       LEU  27  10.896   1.850  -3.871
  181    HA   LEU  27           HA       LEU  27  11.457  -1.017  -4.015
  182    HG   LEU  27           HG       LEU  27  11.704   0.188  -1.477
  183    HB2  LEU  27           HB2      LEU  27   9.443   0.632  -2.516
  184    HB3  LEU  27           HB1      LEU  27   9.256  -1.104  -2.676
  185   HD11  LEU  27          HD11      LEU  27  10.768  -0.430   0.701
  186   HD12  LEU  27          HD12      LEU  27   9.269  -0.920  -0.089
  187   HD13  LEU  27          HD13      LEU  27   9.772   0.770  -0.126
  188   HD21  LEU  27          HD23      LEU  27  12.102  -2.046  -0.580
  189   HD22  LEU  27          HD21      LEU  27  12.019  -2.076  -2.342
  190   HD23  LEU  27          HD22      LEU  27  10.647  -2.635  -1.385
  191    H    GLY  28           HN       GLY  28   9.843   1.397  -5.715
  192    HA2  GLY  28           HA2      GLY  28   8.810   1.059  -7.803
  193    HA3  GLY  28           HA1      GLY  28   8.514  -0.615  -7.364
  194    H    ILE  29           HN       ILE  29   7.735   1.792  -5.042
  195    HA   ILE  29           HA       ILE  29   4.889   1.241  -5.453
  196    HB   ILE  29           HB       ILE  29   6.286   2.527  -3.103
  197   HG12  ILE  29          HG12      ILE  29   5.073  -0.234  -3.331
  198   HG13  ILE  29          HG11      ILE  29   6.795   0.099  -3.488
  199   HG21  ILE  29          HG21      ILE  29   3.425   1.640  -3.444
  200   HG22  ILE  29          HG22      ILE  29   3.998   3.303  -3.318
  201   HG23  ILE  29          HG23      ILE  29   4.144   2.213  -1.940
  202   HD11  ILE  29          HD13      ILE  29   6.213  -0.721  -1.266
  203   HD12  ILE  29          HD11      ILE  29   5.127   0.650  -1.045
  204   HD13  ILE  29          HD12      ILE  29   6.863   0.917  -1.206
  205    H    SER  30           HN       SER  30   3.846   2.659  -6.691
  206    HA   SER  30           HA       SER  30   4.579   5.506  -6.492
  207    HG   SER  30           HG       SER  30   5.420   5.098  -9.676
  208    HB2  SER  30           HB2      SER  30   3.334   3.999  -8.804
  209    HB3  SER  30           HB1      SER  30   3.601   5.742  -8.770
  210    H    ILE  31           HN       ILE  31   3.213   6.249  -4.944
  211    HA   ILE  31           HA       ILE  31   0.391   5.531  -5.030
  212    HB   ILE  31           HB       ILE  31   0.220   6.880  -2.947
  213   HG12  ILE  31          HG12      ILE  31   3.233   7.076  -3.178
  214   HG13  ILE  31          HG11      ILE  31   2.124   8.409  -3.481
  215   HG21  ILE  31          HG21      ILE  31   1.469   5.298  -1.540
  216   HG22  ILE  31          HG22      ILE  31   2.337   4.732  -2.967
  217   HG23  ILE  31          HG23      ILE  31   0.595   4.487  -2.839
  218   HD11  ILE  31          HD13      ILE  31   3.095   8.572  -1.270
  219   HD12  ILE  31          HD11      ILE  31   2.487   6.966  -0.865
  220   HD13  ILE  31          HD12      ILE  31   1.358   8.288  -1.163
  221    H    SER  32           HN       SER  32  -1.218   7.318  -4.686
  222    HA   SER  32           HA       SER  32  -0.499   9.871  -5.886
  223    HG   SER  32           HG       SER  32  -1.793  10.520  -8.151
  224    HB2  SER  32           HB2      SER  32  -1.122   8.484  -7.816
  225    HB3  SER  32           HB1      SER  32  -2.657   8.087  -7.043
  226    H    GLY  33           HN       GLY  33  -2.075  11.526  -5.531
  227    HA2  GLY  33           HA2      GLY  33  -3.809  10.922  -3.230
  228    HA3  GLY  33           HA1      GLY  33  -3.171  12.508  -3.634
  229    H    MET  34           HN       MET  34  -5.948  11.547  -3.152
  230    HA   MET  34           HA       MET  34  -7.258  11.767  -5.716
  231    HB2  MET  34           HB2      MET  34  -8.383  11.685  -2.911
  232    HB3  MET  34           HB1      MET  34  -9.347  11.645  -4.382
  233    HG2  MET  34           HG2      MET  34  -8.151   9.555  -5.022
  234    HG3  MET  34           HG1      MET  34  -7.382   9.576  -3.436
  235    HE1  MET  34           HE3      MET  34  -8.718   9.299  -1.135
  236    HE2  MET  34           HE1      MET  34 -10.476   9.193  -1.050
  237    HE3  MET  34           HE2      MET  34  -9.709  10.685  -1.593
  238    H    ARG  35           HN       ARG  35  -8.395  13.499  -6.501
  239    HA   ARG  35           HA       ARG  35  -7.829  16.065  -5.215
  240    HE   ARG  35           HE       ARG  35  -7.532  14.294  -9.249
  241    HB2  ARG  35           HB2      ARG  35  -8.683  15.314  -8.006
  242    HB3  ARG  35           HB1      ARG  35  -8.697  16.978  -7.440
  243    HG2  ARG  35           HG2      ARG  35  -6.674  16.673  -8.617
  244    HG3  ARG  35           HG1      ARG  35  -6.258  16.712  -6.903
  245    HD2  ARG  35           HD2      ARG  35  -5.039  14.947  -8.059
  246    HD3  ARG  35           HD1      ARG  35  -6.151  14.271  -6.872
  247   HH11  ARG  35          HH11      ARG  35  -4.568  12.889  -8.076
  248   HH12  ARG  35          HH12      ARG  35  -4.653  11.514  -9.124
  249   HH21  ARG  35          HH21      ARG  35  -7.655  12.491 -10.634
  250   HH22  ARG  35          HH22      ARG  35  -6.410  11.287 -10.580
  251    H    ASP  36           HN       ASP  36  -9.408  15.898  -3.560
  252    HA   ASP  36           HA       ASP  36 -12.209  15.845  -4.398
  253    HB2  ASP  36           HB2      ASP  36 -10.994  15.859  -1.625
  254    HB3  ASP  36           HB1      ASP  36 -12.709  15.690  -1.990
  255    H    GLN  37           HN       GLN  37 -13.541  17.568  -4.314
  256    HA   GLN  37           HA       GLN  37 -12.384  20.115  -3.388
  257    HB2  GLN  37           HB2      GLN  37 -14.417  19.662  -5.579
  258    HB3  GLN  37           HB1      GLN  37 -13.803  21.226  -5.061
  259    HG2  GLN  37           HG2      GLN  37 -11.555  20.576  -5.766
  260    HG3  GLN  37           HG1      GLN  37 -12.177  19.013  -6.293
  261   HE21  GLN  37          HE21      GLN  37 -14.668  20.186  -7.292
  262   HE22  GLN  37          HE22      GLN  37 -14.258  20.974  -8.773
  263    H    SER  38           HN       SER  38 -13.962  18.118  -1.871
  264    HA   SER  38           HA       SER  38 -15.834  19.978  -0.702
  265    HG   SER  38           HG       SER  38 -18.823  18.040  -1.039
  266    HB2  SER  38           HB2      SER  38 -17.225  18.970  -2.452
  267    HB3  SER  38           HB1      SER  38 -16.824  17.359  -1.856
  268    H    THR  39           HN       THR  39 -15.292  19.865   1.364
  269    HA   THR  39           HA       THR  39 -14.259  17.405   2.505
  270    HB   THR  39           HB       THR  39 -13.962  18.792   4.572
  271    HG1  THR  39           HG1      THR  39 -15.440  20.542   3.046
  272   HG21  THR  39          HG23      THR  39 -12.140  18.544   2.969
  273   HG22  THR  39          HG21      THR  39 -12.140  20.166   3.660
  274   HG23  THR  39          HG22      THR  39 -12.763  19.902   2.031
  275    H    THR  40           HN       THR  40 -15.258  16.132   3.984
  276    HA   THR  40           HA       THR  40 -17.806  16.972   5.131
  277    HB   THR  40           HB       THR  40 -18.510  15.868   3.088
  278    HG1  THR  40           HG1      THR  40 -19.255  15.182   5.494
  279   HG21  THR  40          HG23      THR  40 -16.903  13.502   4.061
  280   HG22  THR  40          HG21      THR  40 -16.514  14.518   2.674
  281   HG23  THR  40          HG22      THR  40 -17.965  13.515   2.652
  282    H    GLY  41           HN       GLY  41 -14.845  15.579   5.459
  283    HA2  GLY  41           HA2      GLY  41 -14.940  15.011   8.118
  284    HA3  GLY  41           HA1      GLY  41 -15.487  13.520   7.366
  285    H    GLU  42           HN       GLU  42 -13.983  12.948   5.368
  286    HA   GLU  42           HA       GLU  42 -11.288  12.798   6.487
  287    HB2  GLU  42           HB2      GLU  42 -12.586  11.273   4.223
  288    HB3  GLU  42           HB1      GLU  42 -10.939  11.022   4.785
  289    HG2  GLU  42           HG2      GLU  42 -11.774  10.348   6.969
  290    HG3  GLU  42           HG1      GLU  42 -13.428  10.627   6.430
  291    H    ALA  43           HN       ALA  43  -9.454  12.861   4.889
  292    HA   ALA  43           HA       ALA  43  -9.923  14.724   2.675
  293    HB1  ALA  43           HB3      ALA  43  -7.801  15.135   4.780
  294    HB2  ALA  43           HB1      ALA  43  -9.278  16.084   4.607
  295    HB3  ALA  43           HB2      ALA  43  -8.049  16.126   3.343
  296    H    THR  44           HN       THR  44  -9.158  13.783   0.920
  297    HA   THR  44           HA       THR  44  -7.933  12.496  -0.497
  298    HB   THR  44           HB       THR  44  -5.525  12.738  -0.412
  299    HG1  THR  44           HG1      THR  44  -5.247  14.264   1.782
  300   HG21  THR  44          HG23      THR  44  -6.917  15.272   0.459
  301   HG22  THR  44          HG21      THR  44  -6.812  14.661  -1.192
  302   HG23  THR  44          HG22      THR  44  -5.352  15.185  -0.350
  303    H    GLY  45           HN       GLY  45  -5.810  10.851  -0.341
  304    HA2  GLY  45           HA2      GLY  45  -5.740   9.135   1.909
  305    HA3  GLY  45           HA1      GLY  45  -6.849   8.487   0.708
  306    H    ILE  46           HN       ILE  46  -4.063   7.740   1.782
  307    HA   ILE  46           HA       ILE  46  -2.429   7.845  -0.606
  308    HB   ILE  46           HB       ILE  46  -1.897   6.341   1.956
  309   HG12  ILE  46          HG12      ILE  46  -2.186   8.711   2.448
  310   HG13  ILE  46          HG11      ILE  46  -0.487   8.274   2.582
  311   HG21  ILE  46          HG21      ILE  46  -0.562   5.558   0.095
  312   HG22  ILE  46          HG22      ILE  46   0.450   6.452   1.229
  313   HG23  ILE  46          HG23      ILE  46  -0.069   7.209  -0.277
  314   HD11  ILE  46          HD13      ILE  46  -1.772   9.691   0.258
  315   HD12  ILE  46          HD11      ILE  46  -0.069   9.246   0.379
  316   HD13  ILE  46          HD12      ILE  46  -0.755  10.423   1.499
  317    H    TYR  47           HN       TYR  47  -2.447   6.376  -2.174
  318    HA   TYR  47           HA       TYR  47  -2.890   3.581  -1.611
  319    HD1  TYR  47           HD1      TYR  47  -5.144   6.944  -2.609
  320    HD2  TYR  47           HD2      TYR  47  -4.912   3.684  -5.336
  321    HE1  TYR  47           HE1      TYR  47  -5.784   8.443  -4.451
  322    HE2  TYR  47           HE2      TYR  47  -5.548   5.175  -7.182
  323    HH   TYR  47           HH       TYR  47  -6.707   7.293  -7.520
  324    HB2  TYR  47           HB2      TYR  47  -4.815   3.273  -3.016
  325    HB3  TYR  47           HB1      TYR  47  -5.198   4.535  -1.850
  326    H    VAL  48           HN       VAL  48  -1.938   2.267  -3.101
  327    HA   VAL  48           HA       VAL  48  -0.159   3.499  -4.985
  328    HB   VAL  48           HB       VAL  48  -0.744   0.568  -4.535
  329   HG11  VAL  48          HG11      VAL  48   1.435   0.205  -5.625
  330   HG12  VAL  48          HG12      VAL  48   1.529   1.931  -5.977
  331   HG13  VAL  48          HG13      VAL  48   0.260   0.949  -6.709
  332   HG21  VAL  48          HG23      VAL  48   1.454   2.315  -3.431
  333   HG22  VAL  48          HG21      VAL  48   1.299   0.575  -3.190
  334   HG23  VAL  48          HG22      VAL  48   0.088   1.670  -2.522
  335    H    LYS  49           HN       LYS  49  -0.486   3.873  -7.073
  336    HA   LYS  49           HA       LYS  49  -2.792   2.585  -8.379
  337    HB2  LYS  49           HB2      LYS  49  -3.068   5.019  -8.024
  338    HB3  LYS  49           HB1      LYS  49  -1.610   5.306  -8.961
  339    HG2  LYS  49           HG2      LYS  49  -2.714   4.254 -10.915
  340    HG3  LYS  49           HG1      LYS  49  -4.190   4.115  -9.957
  341    HD2  LYS  49           HD2      LYS  49  -4.378   6.079 -11.304
  342    HD3  LYS  49           HD1      LYS  49  -4.117   6.597  -9.637
  343    HE2  LYS  49           HE2      LYS  49  -1.763   6.988 -10.109
  344    HE3  LYS  49           HE1      LYS  49  -1.978   6.405 -11.757
  345    HZ1  LYS  49           HZ3      LYS  49  -3.287   8.803 -10.591
  346    HZ2  LYS  49           HZ1      LYS  49  -3.483   8.246 -12.177
  347    HZ3  LYS  49           HZ2      LYS  49  -1.977   8.818 -11.661
  348    H    SER  50           HN       SER  50   0.594   3.233  -8.512
  349    HA   SER  50           HA       SER  50   0.762   1.672 -10.986
  350    HG   SER  50           HG       SER  50   3.490   3.715 -12.077
  351    HB2  SER  50           HB2      SER  50   0.931   4.000 -11.697
  352    HB3  SER  50           HB1      SER  50   2.209   4.289 -10.517
  353    H    LEU  51           HN       LEU  51   2.974   0.862 -11.403
  354    HA   LEU  51           HA       LEU  51   4.599   0.604  -8.970
  355    HG   LEU  51           HG       LEU  51   1.983  -1.066  -9.210
  356    HB2  LEU  51           HB2      LEU  51   3.814  -1.681 -10.782
  357    HB3  LEU  51           HB1      LEU  51   4.907  -1.789  -9.416
  358   HD11  LEU  51          HD11      LEU  51   2.266  -3.364  -9.962
  359   HD12  LEU  51          HD12      LEU  51   1.692  -3.313  -8.296
  360   HD13  LEU  51          HD13      LEU  51   3.386  -3.672  -8.635
  361   HD21  LEU  51          HD23      LEU  51   4.031  -1.739  -7.099
  362   HD22  LEU  51          HD21      LEU  51   2.317  -1.437  -6.817
  363   HD23  LEU  51          HD22      LEU  51   3.353  -0.141  -7.412
  364    H    ILE  52           HN       ILE  52   6.799  -0.247  -9.429
  365    HA   ILE  52           HA       ILE  52   7.722   0.699 -12.063
  366    HB   ILE  52           HB       ILE  52   9.303   0.482  -9.500
  367   HG12  ILE  52          HG12      ILE  52   7.643   2.271  -9.367
  368   HG13  ILE  52          HG11      ILE  52   9.260   2.949  -9.510
  369   HG21  ILE  52          HG21      ILE  52  11.012   1.759 -10.743
  370   HG22  ILE  52          HG22      ILE  52  10.033   1.597 -12.201
  371   HG23  ILE  52          HG23      ILE  52  10.708   0.163 -11.429
  372   HD11  ILE  52          HD13      ILE  52   8.860   3.361 -11.892
  373   HD12  ILE  52          HD11      ILE  52   7.686   4.184 -10.866
  374   HD13  ILE  52          HD12      ILE  52   7.230   2.709 -11.719
  375    HA   PRO  53           HA       PRO  53   8.288  -3.819 -12.576
  376    HB2  PRO  53           HB2      PRO  53   9.264  -2.767 -15.188
  377    HB3  PRO  53           HB1      PRO  53   8.150  -4.098 -14.856
  378    HG2  PRO  53           HG2      PRO  53   7.241  -1.762 -15.748
  379    HG3  PRO  53           HG1      PRO  53   6.345  -2.681 -14.524
  380    HD2  PRO  53           HD2      PRO  53   8.041  -0.245 -14.203
  381    HD3  PRO  53           HD1      PRO  53   6.545  -0.700 -13.362
  382    H    GLY  54           HN       GLY  54  10.047  -4.833 -11.868
  383    HA2  GLY  54           HA2      GLY  54  12.362  -5.447 -12.241
  384    HA3  GLY  54           HA1      GLY  54  12.692  -3.764 -12.620
  385    H    SER  55           HN       SER  55  10.665  -3.553 -10.109
  386    HA   SER  55           HA       SER  55  12.876  -3.322  -8.199
  387    HG   SER  55           HG       SER  55   9.386  -1.488  -8.562
  388    HB2  SER  55           HB2      SER  55  11.362  -1.901  -6.897
  389    HB3  SER  55           HB1      SER  55  11.473  -1.324  -8.561
  390    H    ALA  56           HN       ALA  56  11.689  -3.492  -5.806
  391    HA   ALA  56           HA       ALA  56  11.418  -6.284  -5.413
  392    HB1  ALA  56           HB3      ALA  56  10.804  -4.026  -3.511
  393    HB2  ALA  56           HB1      ALA  56  12.374  -4.802  -3.721
  394    HB3  ALA  56           HB2      ALA  56  11.015  -5.722  -3.075
  395    H    ALA  57           HN       ALA  57   9.068  -3.650  -4.881
  396    HA   ALA  57           HA       ALA  57   6.863  -5.290  -4.359
  397    HB1  ALA  57           HB3      ALA  57   6.856  -2.520  -5.550
  398    HB2  ALA  57           HB1      ALA  57   6.935  -2.897  -3.829
  399    HB3  ALA  57           HB2      ALA  57   5.497  -3.323  -4.759
  400    H    ALA  58           HN       ALA  58   8.396  -4.468  -7.345
  401    HA   ALA  58           HA       ALA  58   6.118  -5.105  -8.993
  402    HB1  ALA  58           HB3      ALA  58   7.613  -4.765 -10.868
  403    HB2  ALA  58           HB1      ALA  58   9.003  -4.731  -9.782
  404    HB3  ALA  58           HB2      ALA  58   7.789  -3.453  -9.701
  405    H    LEU  59           HN       LEU  59   8.935  -6.793  -7.770
  406    HA   LEU  59           HA       LEU  59   8.574  -9.051  -9.535
  407    HG   LEU  59           HG       LEU  59  10.988  -7.371  -9.346
  408    HB2  LEU  59           HB2      LEU  59  10.423  -8.552  -7.213
  409    HB3  LEU  59           HB1      LEU  59  10.394 -10.060  -8.106
  410   HD11  LEU  59          HD11      LEU  59  12.721  -7.970  -7.745
  411   HD12  LEU  59          HD12      LEU  59  13.316  -8.116  -9.399
  412   HD13  LEU  59          HD13      LEU  59  12.874  -9.562  -8.490
  413   HD21  LEU  59          HD23      LEU  59  10.078  -9.008 -10.908
  414   HD22  LEU  59          HD21      LEU  59  11.292 -10.182 -10.399
  415   HD23  LEU  59          HD22      LEU  59  11.785  -8.707 -11.232
  416    H    ASP  60           HN       ASP  60   8.479  -8.686  -5.974
  417    HA   ASP  60           HA       ASP  60   6.834 -11.114  -5.862
  418    HB2  ASP  60           HB2      ASP  60   8.890 -11.191  -4.541
  419    HB3  ASP  60           HB1      ASP  60   8.411  -9.729  -3.685
  420    H    GLY  61           HN       GLY  61   6.818  -7.713  -5.254
  421    HA2  GLY  61           HA2      GLY  61   4.669  -7.590  -3.428
  422    HA3  GLY  61           HA1      GLY  61   5.185  -6.289  -4.492
  423    H    ARG  62           HN       ARG  62   3.109  -9.083  -4.172
  424    HA   ARG  62           HA       ARG  62   1.889  -9.019  -6.694
  425    HE   ARG  62           HE       ARG  62   1.146 -11.655  -2.862
  426    HB2  ARG  62           HB2      ARG  62   0.842  -9.948  -4.020
  427    HB3  ARG  62           HB1      ARG  62  -0.015 -10.192  -5.536
  428    HG2  ARG  62           HG2      ARG  62   1.874 -11.494  -6.389
  429    HG3  ARG  62           HG1      ARG  62   2.716 -11.262  -4.855
  430    HD2  ARG  62           HD2      ARG  62   0.040 -12.616  -5.174
  431    HD3  ARG  62           HD1      ARG  62   1.583 -13.455  -5.026
  432   HH11  ARG  62          HH11      ARG  62   0.284 -14.801  -4.094
  433   HH12  ARG  62          HH12      ARG  62  -0.036 -15.468  -2.528
  434   HH21  ARG  62          HH21      ARG  62   0.725 -12.528  -0.799
  435   HH22  ARG  62          HH22      ARG  62   0.214 -14.176  -0.657
  436    H    ILE  63           HN       ILE  63   1.953  -6.582  -4.539
  437    HA   ILE  63           HA       ILE  63  -0.565  -5.580  -4.181
  438    HB   ILE  63           HB       ILE  63   1.851  -3.944  -4.955
  439   HG12  ILE  63          HG12      ILE  63   0.933  -4.728  -2.183
  440   HG13  ILE  63          HG11      ILE  63   2.212  -5.563  -3.058
  441   HG21  ILE  63          HG21      ILE  63  -0.629  -3.221  -3.399
  442   HG22  ILE  63          HG22      ILE  63  -0.209  -2.666  -5.020
  443   HG23  ILE  63          HG23      ILE  63   0.770  -2.174  -3.638
  444   HD11  ILE  63          HD13      ILE  63   3.530  -3.524  -3.101
  445   HD12  ILE  63          HD11      ILE  63   3.101  -3.964  -1.449
  446   HD13  ILE  63          HD12      ILE  63   2.239  -2.660  -2.265
  447    H    GLU  64           HN       GLU  64  -2.160  -4.952  -5.479
  448    HA   GLU  64           HA       GLU  64  -1.789  -4.897  -8.329
  449    HB2  GLU  64           HB2      GLU  64  -4.075  -4.817  -6.452
  450    HB3  GLU  64           HB1      GLU  64  -4.321  -4.007  -7.993
  451    HG2  GLU  64           HG2      GLU  64  -3.659  -6.085  -9.149
  452    HG3  GLU  64           HG1      GLU  64  -3.542  -6.884  -7.580
  453    HA   PRO  65           HA       PRO  65  -1.307  -0.546  -8.926
  454    HB2  PRO  65           HB2      PRO  65  -2.635  -0.103 -11.234
  455    HB3  PRO  65           HB1      PRO  65  -1.123  -1.016 -11.176
  456    HG2  PRO  65           HG2      PRO  65  -3.940  -2.025 -11.305
  457    HG3  PRO  65           HG1      PRO  65  -2.514  -2.578 -12.202
  458    HD2  PRO  65           HD2      PRO  65  -3.464  -3.863 -10.009
  459    HD3  PRO  65           HD1      PRO  65  -1.743  -3.843 -10.442
  460    H    ASN  66           HN       ASN  66  -3.715  -1.480  -7.344
  461    HA   ASN  66           HA       ASN  66  -5.013   1.062  -7.171
  462    HB2  ASN  66           HB2      ASN  66  -6.215   0.022  -9.096
  463    HB3  ASN  66           HB1      ASN  66  -6.694  -1.302  -8.040
  464   HD21  ASN  66          HD21      ASN  66  -6.491   2.041  -7.032
  465   HD22  ASN  66          HD22      ASN  66  -8.187   2.275  -6.805
  466    H    ASP  67           HN       ASP  67  -3.547  -0.172  -5.309
  467    HA   ASP  67           HA       ASP  67  -5.461  -1.420  -3.448
  468    HB2  ASP  67           HB2      ASP  67  -3.610  -2.877  -3.818
  469    HB3  ASP  67           HB1      ASP  67  -2.451  -1.564  -3.632
  470    H    LYS  68           HN       LYS  68  -5.472  -0.746  -1.240
  471    HA   LYS  68           HA       LYS  68  -4.593   2.040  -0.905
  472    HB2  LYS  68           HB2      LYS  68  -7.023   1.650  -0.741
  473    HB3  LYS  68           HB1      LYS  68  -6.746   0.523   0.581
  474    HG2  LYS  68           HG2      LYS  68  -5.843   2.322   1.945
  475    HG3  LYS  68           HG1      LYS  68  -6.071   3.457   0.614
  476    HD2  LYS  68           HD2      LYS  68  -8.484   3.060   0.689
  477    HD3  LYS  68           HD1      LYS  68  -8.256   1.921   2.019
  478    HE2  LYS  68           HE2      LYS  68  -7.357   3.705   3.409
  479    HE3  LYS  68           HE1      LYS  68  -7.527   4.847   2.076
  480    HZ1  LYS  68           HZ3      LYS  68  -9.924   4.494   2.139
  481    HZ2  LYS  68           HZ1      LYS  68  -9.353   5.049   3.633
  482    HZ3  LYS  68           HZ2      LYS  68  -9.751   3.417   3.433
  483    H    ILE  69           HN       ILE  69  -2.748   2.202   0.180
  484    HA   ILE  69           HA       ILE  69  -1.748   0.175   1.912
  485    HB   ILE  69           HB       ILE  69  -0.807   3.039   1.734
  486   HG12  ILE  69          HG12      ILE  69  -0.867   2.057  -0.505
  487   HG13  ILE  69          HG11      ILE  69   0.797   2.241   0.041
  488   HG21  ILE  69          HG21      ILE  69   1.342   2.114   2.455
  489   HG22  ILE  69          HG22      ILE  69   0.612   0.513   2.570
  490   HG23  ILE  69          HG23      ILE  69   0.072   1.807   3.640
  491   HD11  ILE  69          HD13      ILE  69  -0.804  -0.306  -0.024
  492   HD12  ILE  69          HD11      ILE  69   0.825  -0.153   0.635
  493   HD13  ILE  69          HD12      ILE  69   0.537   0.135  -1.080
  494    H    LEU  70           HN       LEU  70  -1.662   0.086   4.130
  495    HA   LEU  70           HA       LEU  70  -3.281   2.084   5.568
  496    HG   LEU  70           HG       LEU  70  -4.494  -0.441   4.282
  497    HB2  LEU  70           HB2      LEU  70  -2.944  -0.850   6.187
  498    HB3  LEU  70           HB1      LEU  70  -3.872   0.290   7.144
  499   HD11  LEU  70          HD11      LEU  70  -5.781  -1.358   6.849
  500   HD12  LEU  70          HD12      LEU  70  -4.816  -2.349   5.755
  501   HD13  LEU  70          HD13      LEU  70  -6.369  -1.702   5.222
  502   HD21  LEU  70          HD23      LEU  70  -6.051   1.136   6.330
  503   HD22  LEU  70          HD21      LEU  70  -6.617   0.697   4.717
  504   HD23  LEU  70          HD22      LEU  70  -5.248   1.794   4.905
  505    H    ARG  71           HN       ARG  71  -0.926  -0.468   6.407
  506    HA   ARG  71           HA       ARG  71   0.640   1.549   7.844
  507    HE   ARG  71           HE       ARG  71  -3.016   1.434  11.295
  508    HB2  ARG  71           HB2      ARG  71  -0.231  -1.103   9.000
  509    HB3  ARG  71           HB1      ARG  71   0.902   0.007   9.757
  510    HG2  ARG  71           HG2      ARG  71  -0.854   1.697   9.916
  511    HG3  ARG  71           HG1      ARG  71  -1.992   0.584   9.152
  512    HD2  ARG  71           HD2      ARG  71  -1.678  -0.991  11.009
  513    HD3  ARG  71           HD1      ARG  71  -0.565   0.143  11.774
  514   HH11  ARG  71          HH11      ARG  71  -1.628  -1.040  13.318
  515   HH12  ARG  71          HH12      ARG  71  -2.740  -0.781  14.620
  516   HH21  ARG  71          HH21      ARG  71  -4.488   1.781  13.008
  517   HH22  ARG  71          HH22      ARG  71  -4.361   0.821  14.445
  518    H    VAL  72           HN       VAL  72   2.790   1.322   7.672
  519    HA   VAL  72           HA       VAL  72   3.794  -0.890   6.049
  520    HB   VAL  72           HB       VAL  72   5.433   1.451   6.995
  521   HG11  VAL  72          HG11      VAL  72   6.540   1.053   4.769
  522   HG12  VAL  72          HG12      VAL  72   5.571  -0.416   4.638
  523   HG13  VAL  72          HG13      VAL  72   6.732  -0.238   5.954
  524   HG21  VAL  72          HG23      VAL  72   3.401   2.388   6.025
  525   HG22  VAL  72          HG21      VAL  72   3.627   1.403   4.579
  526   HG23  VAL  72          HG22      VAL  72   4.789   2.670   4.973
  527    H    ASP  73           HN       ASP  73   6.147  -1.574   6.727
  528    HA   ASP  73           HA       ASP  73   6.025  -3.024   9.073
  529    HB2  ASP  73           HB2      ASP  73   7.631  -3.397   7.204
  530    HB3  ASP  73           HB1      ASP  73   8.552  -2.006   7.764
  531    H    ASP  74           HN       ASP  74   5.706  -2.215  11.040
  532    HA   ASP  74           HA       ASP  74   5.994  -1.065  12.974
  533    HB2  ASP  74           HB2      ASP  74   8.354  -1.879  12.626
  534    HB3  ASP  74           HB1      ASP  74   8.720  -0.311  11.912
  535    H    VAL  75           HN       VAL  75   5.237   0.333  10.320
  536    HA   VAL  75           HA       VAL  75   5.261   3.032  11.469
  537    HB   VAL  75           HB       VAL  75   5.830   2.505   8.546
  538   HG11  VAL  75          HG11      VAL  75   4.708   4.610   8.910
  539   HG12  VAL  75          HG12      VAL  75   6.400   4.913   8.520
  540   HG13  VAL  75          HG13      VAL  75   5.845   5.035  10.188
  541   HG21  VAL  75          HG23      VAL  75   8.116   3.232   9.005
  542   HG22  VAL  75          HG21      VAL  75   7.714   1.783   9.926
  543   HG23  VAL  75          HG22      VAL  75   7.739   3.357  10.723
  544    H    ASN  76           HN       ASN  76   3.563   4.423  10.626
  545    HA   ASN  76           HA       ASN  76   1.354   2.942   9.359
  546    HB2  ASN  76           HB2      ASN  76   1.091   4.958  11.603
  547    HB3  ASN  76           HB1      ASN  76  -0.234   4.116  10.805
  548   HD21  ASN  76          HD21      ASN  76   0.541   4.138  13.610
  549   HD22  ASN  76          HD22      ASN  76   0.821   2.490  14.044
  550    H    VAL  77           HN       VAL  77   0.475   3.910   7.630
  551    HA   VAL  77           HA       VAL  77   1.274   6.688   7.070
  552    HB   VAL  77           HB       VAL  77   0.773   6.209   4.709
  553   HG11  VAL  77          HG11      VAL  77   2.644   4.624   4.311
  554   HG12  VAL  77          HG12      VAL  77   2.684   4.300   6.045
  555   HG13  VAL  77          HG13      VAL  77   3.040   5.918   5.442
  556   HG21  VAL  77          HG23      VAL  77   0.335   3.923   3.974
  557   HG22  VAL  77          HG21      VAL  77  -0.944   4.501   5.042
  558   HG23  VAL  77          HG22      VAL  77   0.279   3.387   5.653
  559    H    GLN  78           HN       GLN  78  -1.050   5.629   8.699
  560    HA   GLN  78           HA       GLN  78  -3.364   6.456   7.163
  561    HB2  GLN  78           HB2      GLN  78  -3.051   5.520  10.020
  562    HB3  GLN  78           HB1      GLN  78  -4.593   5.951   9.293
  563    HG2  GLN  78           HG2      GLN  78  -2.802   3.829   8.155
  564    HG3  GLN  78           HG1      GLN  78  -4.028   3.495   9.376
  565   HE21  GLN  78          HE21      GLN  78  -3.432   4.384   6.073
  566   HE22  GLN  78          HE22      GLN  78  -5.042   4.130   5.501
  567    H    GLY  79           HN       GLY  79  -1.157   8.357   7.915
  568    HA2  GLY  79           HA2      GLY  79  -2.770  10.613   8.441
  569    HA3  GLY  79           HA1      GLY  79  -1.966  10.124   9.924
  570    H    MET  80           HN       MET  80  -0.285   9.485   6.995
  571    HA   MET  80           HA       MET  80   1.469  11.796   7.518
  572    HB2  MET  80           HB2      MET  80   2.206   9.106   6.348
  573    HB3  MET  80           HB1      MET  80   3.311  10.450   6.598
  574    HG2  MET  80           HG2      MET  80   2.685  10.297   9.057
  575    HG3  MET  80           HG1      MET  80   1.953   8.745   8.655
  576    HE1  MET  80           HE3      MET  80   3.367   6.729   7.512
  577    HE2  MET  80           HE1      MET  80   5.106   6.813   7.233
  578    HE3  MET  80           HE2      MET  80   4.013   7.838   6.303
  579    H    ALA  81           HN       ALA  81   2.068  13.095   5.845
  580    HA   ALA  81           HA       ALA  81   0.433  13.163   3.540
  581    HB1  ALA  81           HB3      ALA  81   1.786  15.034   2.830
  582    HB2  ALA  81           HB1      ALA  81   3.038  14.611   3.999
  583    HB3  ALA  81           HB2      ALA  81   1.460  15.162   4.559
  584    H    GLN  82           HN       GLN  82   1.116  13.030   1.310
  585    HA   GLN  82           HA       GLN  82   2.162  10.650   0.521
  586    HB2  GLN  82           HB2      GLN  82   1.018  12.133  -1.021
  587    HB3  GLN  82           HB1      GLN  82   2.343  13.288  -0.943
  588    HG2  GLN  82           HG2      GLN  82   3.832  11.643  -1.978
  589    HG3  GLN  82           HG1      GLN  82   2.494  10.499  -2.070
  590   HE21  GLN  82          HE21      GLN  82   0.848  10.842  -3.553
  591   HE22  GLN  82          HE22      GLN  82   1.011  11.944  -4.874
  592    H    SER  83           HN       SER  83   4.019  13.697   0.617
  593    HA   SER  83           HA       SER  83   6.480  12.732  -0.158
  594    HG   SER  83           HG       SER  83   4.901  14.650   2.265
  595    HB2  SER  83           HB2      SER  83   7.454  14.639   1.079
  596    HB3  SER  83           HB1      SER  83   6.034  15.115   0.148
  597    H    ASP  84           HN       ASP  84   5.147  12.857   3.132
  598    HA   ASP  84           HA       ASP  84   7.388  11.829   4.461
  599    HB2  ASP  84           HB2      ASP  84   4.459  11.619   5.190
  600    HB3  ASP  84           HB1      ASP  84   5.795  11.253   6.279
  601    H    VAL  85           HN       VAL  85   4.631  10.197   2.963
  602    HA   VAL  85           HA       VAL  85   5.174   7.597   3.853
  603    HB   VAL  85           HB       VAL  85   3.953   8.344   1.191
  604   HG11  VAL  85          HG11      VAL  85   3.654   5.880   2.906
  605   HG12  VAL  85          HG12      VAL  85   4.539   5.987   1.383
  606   HG13  VAL  85          HG13      VAL  85   2.788   6.200   1.404
  607   HG21  VAL  85          HG23      VAL  85   2.720   8.148   3.930
  608   HG22  VAL  85          HG21      VAL  85   1.781   8.114   2.438
  609   HG23  VAL  85          HG22      VAL  85   2.737   9.537   2.846
  610    H    VAL  86           HN       VAL  86   6.370   9.402   1.061
  611    HA   VAL  86           HA       VAL  86   7.738   7.271  -0.182
  612    HB   VAL  86           HB       VAL  86   8.467  10.203  -0.291
  613   HG11  VAL  86          HG11      VAL  86  10.177   8.696  -1.184
  614   HG12  VAL  86          HG12      VAL  86   9.429   9.653  -2.461
  615   HG13  VAL  86          HG13      VAL  86   8.977   7.962  -2.246
  616   HG21  VAL  86          HG23      VAL  86   7.036  10.309  -2.280
  617   HG22  VAL  86          HG21      VAL  86   6.114   9.897  -0.834
  618   HG23  VAL  86          HG22      VAL  86   6.531   8.642  -2.000
  619    H    GLU  87           HN       GLU  87   8.659   9.566   2.326
  620    HA   GLU  87           HA       GLU  87  11.405   9.060   2.411
  621    HB2  GLU  87           HB2      GLU  87   9.524   9.813   4.653
  622    HB3  GLU  87           HB1      GLU  87  11.277   9.865   4.764
  623    HG2  GLU  87           HG2      GLU  87  11.309  11.505   2.920
  624    HG3  GLU  87           HG1      GLU  87   9.546  11.495   2.920
  625    H    VAL  88           HN       VAL  88   8.758   7.525   4.221
  626    HA   VAL  88           HA       VAL  88  10.281   5.758   5.740
  627    HB   VAL  88           HB       VAL  88   7.483   5.449   4.650
  628   HG11  VAL  88          HG11      VAL  88   8.348   3.242   5.115
  629   HG12  VAL  88          HG12      VAL  88   7.192   3.697   6.370
  630   HG13  VAL  88          HG13      VAL  88   8.923   3.767   6.698
  631   HG21  VAL  88          HG23      VAL  88   7.786   7.318   6.181
  632   HG22  VAL  88          HG21      VAL  88   8.520   6.244   7.371
  633   HG23  VAL  88          HG22      VAL  88   6.822   6.048   6.935
  634    H    LEU  89           HN       LEU  89   8.636   5.118   2.646
  635    HA   LEU  89           HA       LEU  89   9.522   2.511   2.296
  636    HG   LEU  89           HG       LEU  89   6.996   4.175   1.669
  637    HB2  LEU  89           HB2      LEU  89   8.945   4.583   0.179
  638    HB3  LEU  89           HB1      LEU  89   9.058   2.856  -0.101
  639   HD11  LEU  89          HD11      LEU  89   5.419   3.645  -0.132
  640   HD12  LEU  89          HD12      LEU  89   6.760   3.089  -1.134
  641   HD13  LEU  89          HD13      LEU  89   6.660   4.784  -0.658
  642   HD21  LEU  89          HD23      LEU  89   7.284   1.336   0.688
  643   HD22  LEU  89          HD21      LEU  89   5.904   1.973   1.582
  644   HD23  LEU  89          HD22      LEU  89   7.490   1.897   2.348
  645    H    ARG  90           HN       ARG  90  11.146   5.547   1.642
  646    HA   ARG  90           HA       ARG  90  13.288   4.311   0.159
  647    HE   ARG  90           HE       ARG  90  11.949   8.744   0.529
  648    HB2  ARG  90           HB2      ARG  90  12.870   7.104   1.215
  649    HB3  ARG  90           HB1      ARG  90  14.330   6.613   0.366
  650    HG2  ARG  90           HG2      ARG  90  13.005   6.048  -1.602
  651    HG3  ARG  90           HG1      ARG  90  11.534   6.524  -0.751
  652    HD2  ARG  90           HD2      ARG  90  13.868   8.324  -1.394
  653    HD3  ARG  90           HD1      ARG  90  12.325   8.292  -2.246
  654   HH11  ARG  90          HH11      ARG  90  12.956  10.315  -2.413
  655   HH12  ARG  90          HH12      ARG  90  12.485  11.894  -1.882
  656   HH21  ARG  90          HH21      ARG  90  11.326  10.817   1.237
  657   HH22  ARG  90          HH22      ARG  90  11.559  12.181   0.194
  658    H    ASN  91           HN       ASN  91  12.572   4.910   3.455
  659    HA   ASN  91           HA       ASN  91  15.336   4.828   4.325
  660    HB2  ASN  91           HB2      ASN  91  12.696   5.057   5.746
  661    HB3  ASN  91           HB1      ASN  91  14.183   4.744   6.636
  662   HD21  ASN  91          HD21      ASN  91  14.176   6.674   3.746
  663   HD22  ASN  91          HD22      ASN  91  14.458   8.192   4.518
  664    H    ALA  92           HN       ALA  92  12.853   2.606   3.628
  665    HA   ALA  92           HA       ALA  92  13.347   0.543   5.439
  666    HB1  ALA  92           HB3      ALA  92  12.496   0.300   2.556
  667    HB2  ALA  92           HB1      ALA  92  11.424   0.585   3.928
  668    HB3  ALA  92           HB2      ALA  92  12.313  -0.934   3.802
  669    H    GLY  93           HN       GLY  93  14.212  -0.043   2.068
  670    HA2  GLY  93           HA2      GLY  93  16.077  -0.989   1.119
  671    HA3  GLY  93           HA1      GLY  93  17.002  -0.164   2.363
  672    H    ASN  94           HN       ASN  94  14.587  -2.292   3.496
  673    HA   ASN  94           HA       ASN  94  16.382  -4.581   3.670
  674    HB2  ASN  94           HB2      ASN  94  16.038  -2.713   5.809
  675    HB3  ASN  94           HB1      ASN  94  15.278  -4.230   6.276
  676   HD21  ASN  94          HD21      ASN  94  17.959  -4.156   4.067
  677   HD22  ASN  94          HD22      ASN  94  19.126  -4.826   5.145
  678    HA   PRO  95           HA       PRO  95  12.692  -7.072   3.615
  679    HB2  PRO  95           HB2      PRO  95  13.213  -8.225   6.294
  680    HB3  PRO  95           HB1      PRO  95  13.032  -9.038   4.736
  681    HG2  PRO  95           HG2      PRO  95  15.425  -8.810   5.895
  682    HG3  PRO  95           HG1      PRO  95  15.238  -8.671   4.137
  683    HD2  PRO  95           HD2      PRO  95  15.617  -6.518   6.180
  684    HD3  PRO  95           HD1      PRO  95  16.307  -6.659   4.550
  685    H    VAL  96           HN       VAL  96  11.073  -5.541   3.787
  686    HA   VAL  96           HA       VAL  96  10.065  -4.997   6.504
  687    HB   VAL  96           HB       VAL  96   8.986  -2.963   5.450
  688   HG11  VAL  96          HG11      VAL  96  10.971  -2.818   6.866
  689   HG12  VAL  96          HG12      VAL  96  11.028  -1.627   5.568
  690   HG13  VAL  96          HG13      VAL  96  12.000  -3.094   5.461
  691   HG21  VAL  96          HG23      VAL  96   9.159  -3.682   3.117
  692   HG22  VAL  96          HG21      VAL  96  10.918  -3.599   3.220
  693   HG23  VAL  96          HG22      VAL  96   9.954  -2.129   3.370
  694    H    ARG  97           HN       ARG  97   7.772  -4.821   6.769
  695    HA   ARG  97           HA       ARG  97   6.291  -6.576   4.950
  696    HE   ARG  97           HE       ARG  97   4.239  -6.224   9.224
  697    HB2  ARG  97           HB2      ARG  97   6.382  -7.237   7.330
  698    HB3  ARG  97           HB1      ARG  97   5.618  -5.716   7.772
  699    HG2  ARG  97           HG2      ARG  97   3.591  -6.330   6.683
  700    HG3  ARG  97           HG1      ARG  97   4.345  -7.751   5.960
  701    HD2  ARG  97           HD2      ARG  97   2.959  -8.374   7.862
  702    HD3  ARG  97           HD1      ARG  97   4.658  -8.719   8.180
  703   HH11  ARG  97          HH11      ARG  97   2.825  -9.377   9.678
  704   HH12  ARG  97          HH12      ARG  97   2.402  -9.090  11.332
  705   HH21  ARG  97          HH21      ARG  97   3.686  -5.840  11.403
  706   HH22  ARG  97          HH22      ARG  97   2.894  -7.081  12.313
  707    H    LEU  98           HN       LEU  98   4.298  -5.983   4.108
  708    HA   LEU  98           HA       LEU  98   3.633  -3.119   4.326
  709    HG   LEU  98           HG       LEU  98   5.621  -4.682   2.379
  710    HB2  LEU  98           HB2      LEU  98   3.119  -4.786   1.882
  711    HB3  LEU  98           HB1      LEU  98   3.123  -3.040   2.027
  712   HD11  LEU  98          HD11      LEU  98   4.558  -3.428  -0.150
  713   HD12  LEU  98          HD12      LEU  98   4.738  -5.154   0.167
  714   HD13  LEU  98          HD13      LEU  98   6.165  -4.125   0.055
  715   HD21  LEU  98          HD23      LEU  98   5.725  -2.434   3.275
  716   HD22  LEU  98          HD21      LEU  98   5.124  -1.774   1.753
  717   HD23  LEU  98          HD22      LEU  98   6.709  -2.546   1.815
  718    H    LEU  99           HN       LEU  99   1.857  -3.080   5.608
  719    HA   LEU  99           HA       LEU  99  -0.219  -5.103   5.272
  720    HG   LEU  99           HG       LEU  99  -2.344  -3.548   6.955
  721    HB2  LEU  99           HB2      LEU  99   0.465  -4.493   7.545
  722    HB3  LEU  99           HB1      LEU  99   0.014  -2.827   7.243
  723   HD11  LEU  99          HD11      LEU  99  -1.298  -6.224   7.868
  724   HD12  LEU  99          HD12      LEU  99  -1.942  -5.850   6.269
  725   HD13  LEU  99          HD13      LEU  99  -2.997  -5.788   7.681
  726   HD21  LEU  99          HD23      LEU  99  -1.077  -4.341   9.574
  727   HD22  LEU  99          HD21      LEU  99  -2.776  -3.944   9.321
  728   HD23  LEU  99          HD22      LEU  99  -1.539  -2.706   9.103
  729    H    LEU 100           HN       LEU 100  -1.578  -4.754   3.634
  730    HA   LEU 100           HA       LEU 100  -2.845  -2.119   3.433
  731    HG   LEU 100           HG       LEU 100  -0.259  -3.998   1.816
  732    HB2  LEU 100           HB2      LEU 100  -2.761  -2.605   0.851
  733    HB3  LEU 100           HB1      LEU 100  -1.439  -1.797   1.671
  734   HD11  LEU 100          HD11      LEU 100  -2.238  -5.436   1.619
  735   HD12  LEU 100          HD12      LEU 100  -1.006  -5.830   0.420
  736   HD13  LEU 100          HD13      LEU 100  -2.437  -4.916  -0.055
  737   HD21  LEU 100          HD23      LEU 100   0.285  -2.382   0.078
  738   HD22  LEU 100          HD21      LEU 100  -0.987  -3.043  -0.950
  739   HD23  LEU 100          HD22      LEU 100   0.414  -4.031  -0.534
  740    H    ILE 101           HN       ILE 101  -4.779  -2.192   1.944
  741    HA   ILE 101           HA       ILE 101  -6.171  -4.775   2.239
  742    HB   ILE 101           HB       ILE 101  -7.088  -3.091   3.764
  743   HG12  ILE 101          HG12      ILE 101  -8.902  -3.736   1.426
  744   HG13  ILE 101          HG11      ILE 101  -8.603  -4.766   2.822
  745   HG21  ILE 101          HG21      ILE 101  -6.452  -1.109   2.464
  746   HG22  ILE 101          HG22      ILE 101  -8.152  -1.074   2.932
  747   HG23  ILE 101          HG23      ILE 101  -7.701  -1.497   1.280
  748   HD11  ILE 101          HD13      ILE 101  -9.610  -3.006   4.255
  749   HD12  ILE 101          HD11      ILE 101 -10.725  -3.714   3.085
  750   HD13  ILE 101          HD12      ILE 101 -10.030  -2.121   2.788
  751    H    ARG 102           HN       ARG 102  -7.361  -5.527   0.535
  752    HA   ARG 102           HA       ARG 102  -8.061  -3.925  -1.717
  753    HE   ARG 102           HE       ARG 102  -7.162  -4.674  -6.350
  754    HB2  ARG 102           HB2      ARG 102  -5.701  -4.110  -2.245
  755    HB3  ARG 102           HB1      ARG 102  -5.757  -5.853  -2.041
  756    HG2  ARG 102           HG2      ARG 102  -5.726  -5.303  -4.385
  757    HG3  ARG 102           HG1      ARG 102  -7.285  -6.014  -3.960
  758    HD2  ARG 102           HD2      ARG 102  -8.242  -3.745  -3.811
  759    HD3  ARG 102           HD1      ARG 102  -6.690  -3.078  -4.316
  760   HH11  ARG 102          HH11      ARG 102  -9.392  -2.604  -4.649
  761   HH12  ARG 102          HH12      ARG 102 -10.402  -2.342  -6.031
  762   HH21  ARG 102          HH21      ARG 102  -8.487  -4.334  -8.174
  763   HH22  ARG 102          HH22      ARG 102  -9.889  -3.324  -8.034
  764    H    ARG 103           HN       ARG 103  -9.627  -4.881  -2.915
  765    HA   ARG 103           HA       ARG 103 -10.909  -7.167  -1.877
  766    HE   ARG 103           HE       ARG 103 -14.981  -8.325  -4.636
  767    HB2  ARG 103           HB2      ARG 103 -12.118  -5.386  -3.061
  768    HB3  ARG 103           HB1      ARG 103 -11.282  -5.799  -4.552
  769    HG2  ARG 103           HG2      ARG 103 -12.347  -8.004  -4.531
  770    HG3  ARG 103           HG1      ARG 103 -13.200  -7.570  -3.048
  771    HD2  ARG 103           HD2      ARG 103 -14.317  -5.742  -4.214
  772    HD3  ARG 103           HD1      ARG 103 -13.443  -6.138  -5.693
  773   HH11  ARG 103          HH11      ARG 103 -15.053  -5.489  -6.662
  774   HH12  ARG 103          HH12      ARG 103 -16.403  -6.036  -7.599
  775   HH21  ARG 103          HH21      ARG 103 -16.761  -9.051  -5.866
  776   HH22  ARG 103          HH22      ARG 103 -17.373  -8.060  -7.147
  777    H    LEU 104           HN       LEU 104 -11.060  -9.251  -2.610
  778    HA   LEU 104           HA       LEU 104  -8.834 -10.153  -4.270
  779    HG   LEU 104           HG       LEU 104  -9.269 -10.152  -1.344
  780    HB2  LEU 104           HB2      LEU 104 -10.799 -11.805  -2.689
  781    HB3  LEU 104           HB1      LEU 104  -9.278 -12.345  -3.375
  782   HD11  LEU 104          HD11      LEU 104 -10.640 -11.831  -0.306
  783   HD12  LEU 104          HD12      LEU 104  -9.032 -11.870   0.419
  784   HD13  LEU 104          HD13      LEU 104  -9.499 -13.098  -0.759
  785   HD21  LEU 104          HD23      LEU 104  -7.209 -10.680  -2.529
  786   HD22  LEU 104          HD21      LEU 104  -7.348 -12.369  -2.039
  787   HD23  LEU 104          HD22      LEU 104  -7.082 -11.118  -0.825
  788    HA   PRO 105           HA       PRO 105 -11.524 -11.072  -7.686
  789    HB2  PRO 105           HB2      PRO 105  -9.955 -12.657  -9.137
  790    HB3  PRO 105           HB1      PRO 105  -9.487 -10.976  -8.835
  791    HG2  PRO 105           HG2      PRO 105  -8.599 -13.465  -7.411
  792    HG3  PRO 105           HG1      PRO 105  -7.601 -12.144  -8.054
  793    HD2  PRO 105           HD2      PRO 105  -8.334 -12.317  -5.437
  794    HD3  PRO 105           HD1      PRO 105  -8.061 -10.768  -6.262
  795    H    LEU 106           HN       LEU 106 -12.596 -12.368  -5.703
  796    HA   LEU 106           HA       LEU 106 -12.464 -15.219  -5.886
  797    HG   LEU 106           HG       LEU 106 -12.387 -13.029  -3.593
  798    HB2  LEU 106           HB2      LEU 106 -14.591 -13.503  -4.605
  799    HB3  LEU 106           HB1      LEU 106 -14.335 -15.215  -4.330
  800   HD11  LEU 106          HD11      LEU 106 -14.222 -14.679  -1.862
  801   HD12  LEU 106          HD12      LEU 106 -14.400 -12.961  -2.221
  802   HD13  LEU 106          HD13      LEU 106 -13.015 -13.529  -1.289
  803   HD21  LEU 106          HD23      LEU 106 -12.353 -15.994  -3.039
  804   HD22  LEU 106          HD21      LEU 106 -11.225 -14.815  -2.369
  805   HD23  LEU 106          HD22      LEU 106 -11.258 -15.115  -4.106
  806    H    LEU 107           HN       LEU 107 -13.520 -16.544  -7.201
  807    HA   LEU 107           HA       LEU 107 -15.173 -15.500  -9.285
  808    HG   LEU 107           HG       LEU 107 -13.193 -18.351 -10.650
  809    HB2  LEU 107           HB2      LEU 107 -14.353 -18.291  -8.507
  810    HB3  LEU 107           HB1      LEU 107 -15.454 -17.979  -9.835
  811   HD11  LEU 107          HD11      LEU 107 -14.752 -16.754 -11.774
  812   HD12  LEU 107          HD12      LEU 107 -13.041 -16.485 -12.108
  813   HD13  LEU 107          HD13      LEU 107 -13.892 -15.443 -10.967
  814   HD21  LEU 107          HD23      LEU 107 -12.439 -15.929  -9.017
  815   HD22  LEU 107          HD21      LEU 107 -11.392 -16.778 -10.153
  816   HD23  LEU 107          HD22      LEU 107 -11.950 -17.592  -8.692
  817    H    GLU 108           HN       GLU 108 -17.228 -14.977  -9.024
  818    HA   GLU 108           HA       GLU 108 -19.393 -14.958  -8.334
  819    HB2  GLU 108           HB2      GLU 108 -19.357 -17.153  -9.496
  820    HB3  GLU 108           HB1      GLU 108 -18.966 -17.929  -7.967
  821    HG2  GLU 108           HG2      GLU 108 -21.089 -17.181  -7.034
  822    HG3  GLU 108           HG1      GLU 108 -21.479 -16.379  -8.556
  Start of MODEL   24
    1    H1   GLY   1           HT1      GLY   1  -1.560  -8.941  11.838
    2    H2   GLY   1           HT2      GLY   1  -3.033  -9.656  12.265
    3    H3   GLY   1           HT3      GLY   1  -2.938  -7.981  12.053
    4    HA2  GLY   1           HA1      GLY   1  -2.440  -8.282   9.701
    5    HA3  GLY   1           HA2      GLY   1  -2.564 -10.020   9.928
    6    H    SER   2           HN       SER   2  -4.780 -10.252  11.517
    7    HA   SER   2           HA       SER   2  -6.910  -9.021   9.896
    8    HG   SER   2           HG       SER   2  -5.588 -11.389   9.053
    9    HB2  SER   2           HB2      SER   2  -6.842 -11.840  10.998
   10    HB3  SER   2           HB1      SER   2  -8.195 -11.115  10.133
   11    H    HIS   3           HN       HIS   3  -8.762  -8.366  10.944
   12    HA   HIS   3           HA       HIS   3  -9.303  -8.985  13.677
   13    HD1  HIS   3           HD1      HIS   3 -10.084  -4.813  14.318
   14    HD2  HIS   3           HD2      HIS   3  -8.633  -8.018  16.531
   15    HE1  HIS   3           HE1      HIS   3 -10.992  -4.492  16.641
   16    HE2  HIS   3           HE2      HIS   3 -10.035  -6.400  17.981
   17    HB2  HIS   3           HB2      HIS   3  -7.461  -7.360  13.977
   18    HB3  HIS   3           HB1      HIS   3  -8.379  -6.170  13.060
   19    H    GLY   4           HN       GLY   4 -11.321  -9.525  12.796
   20    HA2  GLY   4           HA2      GLY   4 -13.585  -8.891  12.734
   21    HA3  GLY   4           HA1      GLY   4 -13.089  -7.227  12.470
   22    H    TYR   5           HN       TYR   5 -11.250  -7.992  10.289
   23    HA   TYR   5           HA       TYR   5 -13.269  -8.597   8.228
   24    HD1  TYR   5           HD1      TYR   5 -14.252  -6.358   6.573
   25    HD2  TYR   5           HD2      TYR   5 -11.716  -5.183   9.779
   26    HE1  TYR   5           HE1      TYR   5 -15.820  -4.552   7.142
   27    HE2  TYR   5           HE2      TYR   5 -13.278  -3.373  10.360
   28    HH   TYR   5           HH       TYR   5 -15.028  -2.026   9.246
   29    HB2  TYR   5           HB2      TYR   5 -10.923  -6.697   8.078
   30    HB3  TYR   5           HB1      TYR   5 -11.936  -7.137   6.706
   31    H    SER   6           HN       SER   6 -12.907 -10.383   7.117
   32    HA   SER   6           HA       SER   6 -10.253 -11.131   6.277
   33    HG   SER   6           HG       SER   6 -10.513 -13.914   6.366
   34    HB2  SER   6           HB2      SER   6 -10.296 -12.105   8.528
   35    HB3  SER   6           HB1      SER   6 -11.799 -12.945   8.147
   36    H    ASP   7           HN       ASP   7 -10.878 -11.149   4.180
   37    HA   ASP   7           HA       ASP   7 -11.826 -11.857   2.239
   38    HB2  ASP   7           HB2      ASP   7 -12.388 -14.335   3.883
   39    HB3  ASP   7           HB1      ASP   7 -12.526 -14.233   2.130
   40    H    ALA   8           HN       ALA   8 -13.431 -10.152   2.632
   41    HA   ALA   8           HA       ALA   8 -16.126 -11.309   2.844
   42    HB1  ALA   8           HB3      ALA   8 -16.895  -9.363   4.094
   43    HB2  ALA   8           HB1      ALA   8 -15.261  -8.701   4.089
   44    HB3  ALA   8           HB2      ALA   8 -15.604 -10.195   4.961
   45    H    SER   9           HN       SER   9 -17.056 -11.064   0.929
   46    HA   SER   9           HA       SER   9 -17.674 -10.220  -1.093
   47    HG   SER   9           HG       SER   9 -19.909  -8.225   0.142
   48    HB2  SER   9           HB2      SER   9 -17.424  -7.599   0.403
   49    HB3  SER   9           HB1      SER   9 -18.274  -7.825  -1.125
   50    H    GLY  10           HN       GLY  10 -14.867 -10.694  -0.723
   51    HA2  GLY  10           HA2      GLY  10 -13.132 -10.488  -2.295
   52    HA3  GLY  10           HA1      GLY  10 -13.885  -9.019  -2.898
   53    H    PHE  11           HN       PHE  11 -14.046  -7.347  -0.873
   54    HA   PHE  11           HA       PHE  11 -11.458  -6.377  -0.518
   55    HD1  PHE  11           HD1      PHE  11 -15.017  -5.256  -1.322
   56    HD2  PHE  11           HD2      PHE  11 -11.453  -3.374   0.045
   57    HE1  PHE  11           HE1      PHE  11 -15.254  -3.546  -3.074
   58    HE2  PHE  11           HE2      PHE  11 -11.683  -1.660  -1.706
   59    HZ   PHE  11           HZ       PHE  11 -13.565  -1.743  -3.268
   60    HB2  PHE  11           HB2      PHE  11 -14.072  -5.788   0.840
   61    HB3  PHE  11           HB1      PHE  11 -12.586  -5.023   1.397
   62    H    SER  12           HN       SER  12  -9.853  -6.960   0.775
   63    HA   SER  12           HA       SER  12 -10.396  -8.019   3.419
   64    HG   SER  12           HG       SER  12  -8.381 -10.975   3.004
   65    HB2  SER  12           HB2      SER  12 -10.442 -10.036   2.019
   66    HB3  SER  12           HB1      SER  12  -8.849  -9.634   1.379
   67    H    LEU  13           HN       LEU  13  -8.552  -8.085   4.785
   68    HA   LEU  13           HA       LEU  13  -6.516  -6.132   4.028
   69    HG   LEU  13           HG       LEU  13  -9.001  -6.131   5.987
   70    HB2  LEU  13           HB2      LEU  13  -6.956  -7.417   6.722
   71    HB3  LEU  13           HB1      LEU  13  -6.014  -5.982   6.373
   72   HD11  LEU  13          HD11      LEU  13  -9.184  -4.898   8.086
   73   HD12  LEU  13          HD12      LEU  13  -7.443  -5.044   8.330
   74   HD13  LEU  13          HD13      LEU  13  -8.460  -6.485   8.341
   75   HD21  LEU  13          HD23      LEU  13  -8.788  -3.664   6.029
   76   HD22  LEU  13          HD21      LEU  13  -7.951  -4.413   4.670
   77   HD23  LEU  13          HD22      LEU  13  -7.035  -3.849   6.066
   78    H    TYR  14           HN       TYR  14  -4.911  -7.115   2.897
   79    HA   TYR  14           HA       TYR  14  -3.664  -9.467   4.154
   80    HD1  TYR  14           HD1      TYR  14  -5.886  -8.075   0.948
   81    HD2  TYR  14           HD2      TYR  14  -1.836  -9.235   0.297
   82    HE1  TYR  14           HE1      TYR  14  -5.834  -6.743  -1.110
   83    HE2  TYR  14           HE2      TYR  14  -1.781  -7.897  -1.764
   84    HH   TYR  14           HH       TYR  14  -3.378  -7.008  -3.421
   85    HB2  TYR  14           HB2      TYR  14  -3.103 -10.327   1.950
   86    HB3  TYR  14           HB1      TYR  14  -4.840 -10.087   2.079
   87    H    SER  15           HN       SER  15  -1.386  -9.650   3.982
   88    HA   SER  15           HA       SER  15  -0.034  -7.122   3.299
   89    HG   SER  15           HG       SER  15   0.836  -9.958   5.078
   90    HB2  SER  15           HB2      SER  15   1.540  -7.569   5.151
   91    HB3  SER  15           HB1      SER  15  -0.120  -7.407   5.725
   92    H    VAL  16           HN       VAL  16   2.266  -7.335   2.779
   93    HA   VAL  16           HA       VAL  16   2.976  -9.963   1.660
   94    HB   VAL  16           HB       VAL  16   3.583  -7.363   0.255
   95   HG11  VAL  16          HG11      VAL  16   3.653 -10.223  -0.697
   96   HG12  VAL  16          HG12      VAL  16   5.057  -9.260  -0.242
   97   HG13  VAL  16          HG13      VAL  16   4.088  -8.798  -1.641
   98   HG21  VAL  16          HG23      VAL  16   1.168  -7.633   0.311
   99   HG22  VAL  16          HG21      VAL  16   1.321  -9.286  -0.287
  100   HG23  VAL  16          HG22      VAL  16   1.780  -7.928  -1.316
  101    H    GLU  17           HN       GLU  17   5.213 -10.417   1.562
  102    HA   GLU  17           HA       GLU  17   6.807  -8.783   3.413
  103    HB2  GLU  17           HB2      GLU  17   7.255 -11.629   2.496
  104    HB3  GLU  17           HB1      GLU  17   8.198 -10.774   3.709
  105    HG2  GLU  17           HG2      GLU  17   5.277 -11.467   3.919
  106    HG3  GLU  17           HG1      GLU  17   6.601 -12.312   4.719
  107    H    LEU  18           HN       LEU  18   8.062  -7.349   2.415
  108    HA   LEU  18           HA       LEU  18   9.614  -8.246   0.077
  109    HG   LEU  18           HG       LEU  18   7.825  -5.843  -2.013
  110    HB2  LEU  18           HB2      LEU  18   7.941  -5.838   0.434
  111    HB3  LEU  18           HB1      LEU  18   9.510  -5.562  -0.297
  112   HD11  LEU  18          HD11      LEU  18  10.063  -6.655  -2.504
  113   HD12  LEU  18          HD12      LEU  18   8.846  -7.650  -3.302
  114   HD13  LEU  18          HD13      LEU  18   9.648  -8.237  -1.845
  115   HD21  LEU  18          HD23      LEU  18   6.260  -7.211  -0.687
  116   HD22  LEU  18          HD21      LEU  18   7.344  -8.589  -0.869
  117   HD23  LEU  18          HD22      LEU  18   6.570  -7.884  -2.288
  118    H    PHE  19           HN       PHE  19  11.739  -8.159   0.389
  119    HA   PHE  19           HA       PHE  19  12.764  -6.404   2.522
  120    HD1  PHE  19           HD2      PHE  19  12.320 -10.166   0.899
  121    HD2  PHE  19           HD1      PHE  19  16.227  -8.512   1.236
  122    HE1  PHE  19           HE2      PHE  19  13.118 -11.705  -0.848
  123    HE2  PHE  19           HE1      PHE  19  17.031 -10.046  -0.512
  124    HZ   PHE  19           HZ       PHE  19  15.476 -11.645  -1.555
  125    HB2  PHE  19           HB2      PHE  19  14.590  -7.965   2.818
  126    HB3  PHE  19           HB1      PHE  19  13.068  -8.846   2.902
  127    H    ARG  20           HN       ARG  20  14.525  -5.075   2.133
  128    HA   ARG  20           HA       ARG  20  15.500  -5.053  -0.653
  129    HE   ARG  20           HE       ARG  20  15.107  -0.559   0.703
  130    HB2  ARG  20           HB2      ARG  20  13.888  -3.190  -0.159
  131    HB3  ARG  20           HB1      ARG  20  15.039  -2.584   1.023
  132    HG2  ARG  20           HG2      ARG  20  16.659  -2.140  -0.667
  133    HG3  ARG  20           HG1      ARG  20  15.697  -2.976  -1.885
  134    HD2  ARG  20           HD2      ARG  20  15.526  -0.529  -2.071
  135    HD3  ARG  20           HD1      ARG  20  13.972  -1.287  -1.730
  136   HH11  ARG  20          HH11      ARG  20  13.886   0.977  -2.174
  137   HH12  ARG  20          HH12      ARG  20  13.408   2.424  -1.352
  138   HH21  ARG  20          HH21      ARG  20  14.486   1.340   1.791
  139   HH22  ARG  20          HH22      ARG  20  13.749   2.629   0.902
  140    H    GLU  21           HN       GLU  21  17.617  -4.012  -0.932
  141    HA   GLU  21           HA       GLU  21  19.307  -3.507   1.290
  142    HB2  GLU  21           HB2      GLU  21  20.868  -5.446   0.852
  143    HB3  GLU  21           HB1      GLU  21  19.355  -5.852   1.649
  144    HG2  GLU  21           HG2      GLU  21  18.437  -6.644  -0.455
  145    HG3  GLU  21           HG1      GLU  21  19.925  -6.193  -1.287
  146    H    LYS  22           HN       LYS  22  18.937  -4.255  -2.092
  147    HA   LYS  22           HA       LYS  22  21.455  -3.498  -3.036
  148    HB2  LYS  22           HB2      LYS  22  18.760  -3.258  -4.387
  149    HB3  LYS  22           HB1      LYS  22  20.309  -3.116  -5.205
  150    HG2  LYS  22           HG2      LYS  22  19.399  -5.571  -3.720
  151    HG3  LYS  22           HG1      LYS  22  19.218  -5.331  -5.459
  152    HD2  LYS  22           HD2      LYS  22  21.864  -5.237  -4.014
  153    HD3  LYS  22           HD1      LYS  22  21.218  -6.685  -4.786
  154    HE2  LYS  22           HE2      LYS  22  21.137  -5.468  -6.931
  155    HE3  LYS  22           HE1      LYS  22  21.860  -4.067  -6.140
  156    HZ1  LYS  22           HZ3      LYS  22  23.114  -6.745  -6.422
  157    HZ2  LYS  22           HZ1      LYS  22  23.809  -5.419  -5.633
  158    HZ3  LYS  22           HZ2      LYS  22  23.526  -5.359  -7.300
  159    H    ASP  23           HN       ASP  23  22.004  -1.538  -4.269
  160    HA   ASP  23           HA       ASP  23  21.269   0.820  -2.760
  161    HB2  ASP  23           HB2      ASP  23  23.025   1.926  -4.155
  162    HB3  ASP  23           HB1      ASP  23  23.608   0.528  -3.256
  163    H    THR  24           HN       THR  24  19.042   0.016  -4.026
  164    HA   THR  24           HA       THR  24  18.801   1.607  -6.475
  165    HB   THR  24           HB       THR  24  16.614   0.520  -6.767
  166    HG1  THR  24           HG1      THR  24  17.301  -0.939  -4.413
  167   HG21  THR  24          HG23      THR  24  18.856  -1.424  -6.201
  168   HG22  THR  24          HG21      THR  24  18.593  -0.555  -7.712
  169   HG23  THR  24          HG22      THR  24  17.426  -1.761  -7.175
  170    H    SER  25           HN       SER  25  17.890   1.552  -3.150
  171    HA   SER  25           HA       SER  25  16.709   2.963  -1.818
  172    HG   SER  25           HG       SER  25  16.397   5.222  -1.377
  173    HB2  SER  25           HB2      SER  25  18.338   4.589  -2.687
  174    HB3  SER  25           HB1      SER  25  17.269   4.937  -4.045
  175    H    SER  26           HN       SER  26  15.358   1.512  -4.168
  176    HA   SER  26           HA       SER  26  12.786   2.870  -3.843
  177    HG   SER  26           HG       SER  26  13.055   4.506  -6.448
  178    HB2  SER  26           HB2      SER  26  13.908   1.988  -6.512
  179    HB3  SER  26           HB1      SER  26  12.269   2.582  -6.244
  180    H    LEU  27           HN       LEU  27  10.977   1.530  -3.976
  181    HA   LEU  27           HA       LEU  27  11.574  -1.355  -3.910
  182    HG   LEU  27           HG       LEU  27  11.790  -0.069  -1.389
  183    HB2  LEU  27           HB2      LEU  27   9.504   0.276  -2.454
  184    HB3  LEU  27           HB1      LEU  27   9.402  -1.469  -2.578
  185   HD11  LEU  27          HD11      LEU  27   9.349  -1.138   0.021
  186   HD12  LEU  27          HD12      LEU  27   9.823   0.557  -0.101
  187   HD13  LEU  27          HD13      LEU  27  10.827  -0.578   0.803
  188   HD21  LEU  27          HD23      LEU  27  12.177  -2.259  -0.363
  189   HD22  LEU  27          HD21      LEU  27  12.157  -2.363  -2.124
  190   HD23  LEU  27          HD22      LEU  27  10.758  -2.896  -1.192
  191    H    GLY  28           HN       GLY  28   9.703   1.146  -5.373
  192    HA2  GLY  28           HA2      GLY  28   8.825   0.713  -7.599
  193    HA3  GLY  28           HA1      GLY  28   8.365  -0.888  -7.041
  194    H    ILE  29           HN       ILE  29   7.437   0.361  -4.452
  195    HA   ILE  29           HA       ILE  29   4.712   0.587  -5.100
  196    HB   ILE  29           HB       ILE  29   6.122   1.555  -2.607
  197   HG12  ILE  29          HG12      ILE  29   4.714  -1.072  -3.127
  198   HG13  ILE  29          HG11      ILE  29   6.461  -0.860  -3.164
  199   HG21  ILE  29          HG21      ILE  29   3.213   0.919  -3.091
  200   HG22  ILE  29          HG22      ILE  29   3.899   2.525  -2.848
  201   HG23  ILE  29          HG23      ILE  29   3.929   1.345  -1.537
  202   HD11  ILE  29          HD13      ILE  29   4.673  -0.446  -0.779
  203   HD12  ILE  29          HD11      ILE  29   6.420  -0.207  -0.807
  204   HD13  ILE  29          HD12      ILE  29   5.746  -1.817  -1.060
  205    H    SER  30           HN       SER  30   3.900   2.168  -6.314
  206    HA   SER  30           HA       SER  30   4.848   4.916  -5.849
  207    HG   SER  30           HG       SER  30   4.821   6.164  -8.482
  208    HB2  SER  30           HB2      SER  30   5.279   4.140  -8.125
  209    HB3  SER  30           HB1      SER  30   3.579   3.722  -8.325
  210    H    ILE  31           HN       ILE  31   3.501   5.697  -4.338
  211    HA   ILE  31           HA       ILE  31   0.652   5.195  -4.445
  212    HB   ILE  31           HB       ILE  31   0.577   6.652  -2.414
  213   HG12  ILE  31          HG12      ILE  31   3.595   6.587  -2.612
  214   HG13  ILE  31          HG11      ILE  31   2.621   7.982  -3.064
  215   HG21  ILE  31          HG21      ILE  31   2.532   4.357  -2.355
  216   HG22  ILE  31          HG22      ILE  31   0.778   4.241  -2.212
  217   HG23  ILE  31          HG23      ILE  31   1.715   5.042  -0.950
  218   HD11  ILE  31          HD13      ILE  31   2.681   6.741  -0.326
  219   HD12  ILE  31          HD11      ILE  31   1.832   8.212  -0.801
  220   HD13  ILE  31          HD12      ILE  31   3.596   8.166  -0.818
  221    H    SER  32           HN       SER  32  -0.788   7.190  -4.014
  222    HA   SER  32           HA       SER  32   0.069   9.508  -5.586
  223    HG   SER  32           HG       SER  32  -2.195  10.486  -6.356
  224    HB2  SER  32           HB2      SER  32  -1.130   8.044  -7.153
  225    HB3  SER  32           HB1      SER  32  -2.514   7.996  -6.061
  226    H    GLY  33           HN       GLY  33  -0.559  11.397  -4.735
  227    HA2  GLY  33           HA2      GLY  33  -1.765  11.489  -2.178
  228    HA3  GLY  33           HA1      GLY  33  -1.433  12.873  -3.207
  229    H    MET  34           HN       MET  34  -3.729  12.491  -1.530
  230    HA   MET  34           HA       MET  34  -5.895  12.033  -3.448
  231    HB2  MET  34           HB2      MET  34  -6.007  10.872  -1.268
  232    HB3  MET  34           HB1      MET  34  -6.018  12.430  -0.454
  233    HG2  MET  34           HG2      MET  34  -8.251  11.563  -0.555
  234    HG3  MET  34           HG1      MET  34  -8.128  12.983  -1.592
  235    HE1  MET  34           HE3      MET  34  -8.387   9.086  -1.432
  236    HE2  MET  34           HE1      MET  34  -6.861   9.310  -2.285
  237    HE3  MET  34           HE2      MET  34  -8.253   8.636  -3.132
  238    H    ARG  35           HN       ARG  35  -7.135  13.640  -4.222
  239    HA   ARG  35           HA       ARG  35  -7.421  16.149  -2.863
  240    HE   ARG  35           HE       ARG  35  -4.746  14.317  -7.642
  241    HB2  ARG  35           HB2      ARG  35  -6.489  17.528  -4.713
  242    HB3  ARG  35           HB1      ARG  35  -5.274  16.599  -3.849
  243    HG2  ARG  35           HG2      ARG  35  -6.476  15.505  -6.353
  244    HG3  ARG  35           HG1      ARG  35  -5.212  16.733  -6.440
  245    HD2  ARG  35           HD2      ARG  35  -3.734  15.307  -5.115
  246    HD3  ARG  35           HD1      ARG  35  -5.001  14.087  -5.006
  247   HH11  ARG  35          HH11      ARG  35  -2.317  14.064  -5.157
  248   HH12  ARG  35          HH12      ARG  35  -1.178  13.247  -6.174
  249   HH21  ARG  35          HH21      ARG  35  -3.252  13.239  -8.986
  250   HH22  ARG  35          HH22      ARG  35  -1.710  12.780  -8.348
  251    H    ASP  36           HN       ASP  36  -9.525  14.865  -3.193
  252    HA   ASP  36           HA       ASP  36 -10.740  14.811  -5.750
  253    HB2  ASP  36           HB2      ASP  36 -12.035  14.813  -3.015
  254    HB3  ASP  36           HB1      ASP  36 -12.836  14.391  -4.525
  255    H    GLN  37           HN       GLN  37 -13.104  15.955  -5.776
  256    HA   GLN  37           HA       GLN  37 -12.568  18.678  -6.275
  257    HB2  GLN  37           HB2      GLN  37 -14.990  18.878  -6.679
  258    HB3  GLN  37           HB1      GLN  37 -14.296  17.485  -7.498
  259    HG2  GLN  37           HG2      GLN  37 -15.143  16.028  -5.721
  260    HG3  GLN  37           HG1      GLN  37 -15.857  17.430  -4.924
  261   HE21  GLN  37          HE21      GLN  37 -17.937  16.627  -5.081
  262   HE22  GLN  37          HE22      GLN  37 -18.792  16.550  -6.579
  263    H    SER  38           HN       SER  38 -14.143  20.409  -5.353
  264    HA   SER  38           HA       SER  38 -14.532  21.802  -3.596
  265    HG   SER  38           HG       SER  38 -14.925  19.137  -1.173
  266    HB2  SER  38           HB2      SER  38 -15.982  20.948  -1.887
  267    HB3  SER  38           HB1      SER  38 -16.394  20.114  -3.383
  268    H    THR  39           HN       THR  39 -14.402  21.467  -0.832
  269    HA   THR  39           HA       THR  39 -11.715  21.916  -0.290
  270    HB   THR  39           HB       THR  39 -12.287  21.653   2.092
  271    HG1  THR  39           HG1      THR  39 -14.927  21.264   1.879
  272   HG21  THR  39          HG23      THR  39 -14.034  23.375   2.197
  273   HG22  THR  39          HG21      THR  39 -14.394  23.110   0.492
  274   HG23  THR  39          HG22      THR  39 -12.825  23.756   0.971
  275    H    THR  40           HN       THR  40 -10.036  20.679   0.401
  276    HA   THR  40           HA       THR  40 -10.214  17.838  -0.085
  277    HB   THR  40           HB       THR  40  -7.801  17.799   0.298
  278    HG1  THR  40           HG1      THR  40  -7.704  20.577   0.645
  279   HG21  THR  40          HG23      THR  40  -7.111  19.284  -1.513
  280   HG22  THR  40          HG21      THR  40  -8.629  20.172  -1.380
  281   HG23  THR  40          HG22      THR  40  -8.634  18.490  -1.910
  282    H    GLY  41           HN       GLY  41 -11.404  19.331   2.366
  283    HA2  GLY  41           HA2      GLY  41 -10.024  18.158   4.605
  284    HA3  GLY  41           HA1      GLY  41 -11.549  19.031   4.656
  285    H    GLU  42           HN       GLU  42 -12.651  17.234   2.526
  286    HA   GLU  42           HA       GLU  42 -13.279  14.974   4.300
  287    HB2  GLU  42           HB2      GLU  42 -14.855  16.174   2.017
  288    HB3  GLU  42           HB1      GLU  42 -15.341  14.744   2.917
  289    HG2  GLU  42           HG2      GLU  42 -15.468  16.066   4.961
  290    HG3  GLU  42           HG1      GLU  42 -14.963  17.500   4.067
  291    H    ALA  43           HN       ALA  43 -13.386  12.864   3.468
  292    HA   ALA  43           HA       ALA  43 -12.614  11.084   2.283
  293    HB1  ALA  43           HB3      ALA  43 -12.845  11.170  -0.139
  294    HB2  ALA  43           HB1      ALA  43 -13.006  12.924  -0.074
  295    HB3  ALA  43           HB2      ALA  43 -14.243  11.897   0.650
  296    H    THR  44           HN       THR  44 -10.535  11.079   3.166
  297    HA   THR  44           HA       THR  44  -8.441  11.938   1.293
  298    HB   THR  44           HB       THR  44  -6.999  12.587   3.212
  299    HG1  THR  44           HG1      THR  44  -9.039  13.009   4.966
  300   HG21  THR  44          HG23      THR  44  -9.596  14.117   3.006
  301   HG22  THR  44          HG21      THR  44  -8.198  14.302   1.947
  302   HG23  THR  44          HG22      THR  44  -8.079  14.745   3.650
  303    H    GLY  45           HN       GLY  45  -6.511  10.703   1.367
  304    HA2  GLY  45           HA2      GLY  45  -5.665   8.762   3.025
  305    HA3  GLY  45           HA1      GLY  45  -6.968   7.955   2.166
  306    H    ILE  46           HN       ILE  46  -3.996   7.549   2.206
  307    HA   ILE  46           HA       ILE  46  -3.182   8.218  -0.493
  308    HB   ILE  46           HB       ILE  46  -1.696   8.091   1.668
  309   HG12  ILE  46          HG12      ILE  46   0.272   7.463   0.185
  310   HG13  ILE  46          HG11      ILE  46  -0.905   7.149  -1.086
  311   HG21  ILE  46          HG21      ILE  46  -0.547   6.014   1.994
  312   HG22  ILE  46          HG22      ILE  46  -1.416   5.271   0.652
  313   HG23  ILE  46          HG23      ILE  46  -2.281   5.720   2.122
  314   HD11  ILE  46          HD13      ILE  46  -1.642   9.458  -0.995
  315   HD12  ILE  46          HD11      ILE  46   0.094   9.364  -1.288
  316   HD13  ILE  46          HD12      ILE  46  -0.509   9.782   0.316
  317    H    TYR  47           HN       TYR  47  -2.386   6.558  -1.991
  318    HA   TYR  47           HA       TYR  47  -3.158   3.826  -1.621
  319    HD1  TYR  47           HD1      TYR  47  -5.310   7.261  -2.461
  320    HD2  TYR  47           HD2      TYR  47  -4.467   4.536  -5.620
  321    HE1  TYR  47           HE1      TYR  47  -5.667   9.059  -4.100
  322    HE2  TYR  47           HE2      TYR  47  -4.821   6.328  -7.266
  323    HH   TYR  47           HH       TYR  47  -5.976   8.469  -7.440
  324    HB2  TYR  47           HB2      TYR  47  -4.834   3.725  -3.407
  325    HB3  TYR  47           HB1      TYR  47  -5.357   4.800  -2.113
  326    H    VAL  48           HN       VAL  48  -2.103   2.479  -3.005
  327    HA   VAL  48           HA       VAL  48   0.014   3.561  -4.574
  328    HB   VAL  48           HB       VAL  48  -1.021   0.728  -4.387
  329   HG11  VAL  48          HG11      VAL  48   0.149   0.984  -6.476
  330   HG12  VAL  48          HG12      VAL  48   1.177   0.098  -5.350
  331   HG13  VAL  48          HG13      VAL  48   1.486   1.805  -5.669
  332   HG21  VAL  48          HG23      VAL  48  -0.145   1.623  -2.286
  333   HG22  VAL  48          HG21      VAL  48   1.360   2.053  -3.099
  334   HG23  VAL  48          HG22      VAL  48   0.899   0.358  -2.935
  335    H    LYS  49           HN       LYS  49  -0.461   4.623  -6.391
  336    HA   LYS  49           HA       LYS  49  -2.697   4.088  -8.037
  337    HB2  LYS  49           HB2      LYS  49  -1.618   6.287  -7.946
  338    HB3  LYS  49           HB1      LYS  49  -0.161   5.611  -8.662
  339    HG2  LYS  49           HG2      LYS  49  -1.407   5.096 -10.705
  340    HG3  LYS  49           HG1      LYS  49  -2.863   5.786  -9.985
  341    HD2  LYS  49           HD2      LYS  49  -1.903   7.447 -11.406
  342    HD3  LYS  49           HD1      LYS  49  -1.612   7.942  -9.737
  343    HE2  LYS  49           HE2      LYS  49   0.664   7.054  -9.871
  344    HE3  LYS  49           HE1      LYS  49   0.372   6.552 -11.535
  345    HZ1  LYS  49           HZ3      LYS  49   0.040   8.868 -12.136
  346    HZ2  LYS  49           HZ1      LYS  49   1.566   8.646 -11.440
  347    HZ3  LYS  49           HZ2      LYS  49   0.320   9.350 -10.539
  348    H    SER  50           HN       SER  50   0.690   3.103  -8.177
  349    HA   SER  50           HA       SER  50   0.070   0.823  -9.767
  350    HG   SER  50           HG       SER  50   0.883   0.438 -12.012
  351    HB2  SER  50           HB2      SER  50  -0.015   2.525 -11.545
  352    HB3  SER  50           HB1      SER  50   1.622   3.036 -11.133
  353    H    LEU  51           HN       LEU  51   2.225  -0.185 -10.619
  354    HA   LEU  51           HA       LEU  51   4.242   0.130  -8.497
  355    HG   LEU  51           HG       LEU  51   1.830  -1.826  -8.355
  356    HB2  LEU  51           HB2      LEU  51   3.552  -2.349 -10.077
  357    HB3  LEU  51           HB1      LEU  51   4.783  -2.239  -8.833
  358   HD11  LEU  51          HD11      LEU  51   3.577  -4.213  -7.773
  359   HD12  LEU  51          HD12      LEU  51   2.298  -4.130  -8.984
  360   HD13  LEU  51          HD13      LEU  51   1.899  -4.016  -7.270
  361   HD21  LEU  51          HD23      LEU  51   4.144  -2.106  -6.440
  362   HD22  LEU  51          HD21      LEU  51   2.443  -1.975  -5.994
  363   HD23  LEU  51          HD22      LEU  51   3.254  -0.623  -6.783
  364    H    ILE  52           HN       ILE  52   6.459  -0.248  -9.090
  365    HA   ILE  52           HA       ILE  52   7.009   0.646 -11.820
  366    HB   ILE  52           HB       ILE  52   8.829   0.562  -9.423
  367   HG12  ILE  52          HG12      ILE  52   7.441   2.896 -10.760
  368   HG13  ILE  52          HG11      ILE  52   6.928   2.154  -9.249
  369   HG21  ILE  52          HG21      ILE  52  10.076   0.376 -11.498
  370   HG22  ILE  52          HG22      ILE  52  10.310   1.975 -10.793
  371   HG23  ILE  52          HG23      ILE  52   9.219   1.766 -12.161
  372   HD11  ILE  52          HD13      ILE  52   9.567   3.509  -9.716
  373   HD12  ILE  52          HD11      ILE  52   8.997   2.825  -8.195
  374   HD13  ILE  52          HD12      ILE  52   8.175   4.218  -8.898
  375    HA   PRO  53           HA       PRO  53   8.063  -3.696 -12.647
  376    HB2  PRO  53           HB2      PRO  53   8.875  -2.488 -15.233
  377    HB3  PRO  53           HB1      PRO  53   7.810  -3.863 -14.917
  378    HG2  PRO  53           HG2      PRO  53   6.817  -1.513 -15.695
  379    HG3  PRO  53           HG1      PRO  53   5.975  -2.514 -14.496
  380    HD2  PRO  53           HD2      PRO  53   7.640  -0.063 -14.089
  381    HD3  PRO  53           HD1      PRO  53   6.142  -0.558 -13.273
  382    H    GLY  54           HN       GLY  54   9.949  -4.728 -12.348
  383    HA2  GLY  54           HA2      GLY  54  12.283  -5.046 -12.817
  384    HA3  GLY  54           HA1      GLY  54  12.448  -3.304 -12.976
  385    H    SER  55           HN       SER  55  10.650  -3.198 -10.447
  386    HA   SER  55           HA       SER  55  12.893  -3.185  -8.600
  387    HG   SER  55           HG       SER  55   9.489  -3.085  -8.733
  388    HB2  SER  55           HB2      SER  55  11.377  -2.013  -7.078
  389    HB3  SER  55           HB1      SER  55  11.351  -1.258  -8.671
  390    H    ALA  56           HN       ALA  56  11.958  -3.738  -6.195
  391    HA   ALA  56           HA       ALA  56  11.788  -6.571  -6.161
  392    HB1  ALA  56           HB3      ALA  56  12.905  -5.313  -4.393
  393    HB2  ALA  56           HB1      ALA  56  11.626  -6.334  -3.735
  394    HB3  ALA  56           HB2      ALA  56  11.364  -4.600  -3.919
  395    H    ALA  57           HN       ALA  57   9.468  -4.065  -5.130
  396    HA   ALA  57           HA       ALA  57   7.348  -5.709  -4.451
  397    HB1  ALA  57           HB3      ALA  57   7.413  -3.311  -3.985
  398    HB2  ALA  57           HB1      ALA  57   5.914  -3.771  -4.789
  399    HB3  ALA  57           HB2      ALA  57   7.193  -2.970  -5.700
  400    H    ALA  58           HN       ALA  58   8.331  -4.548  -7.628
  401    HA   ALA  58           HA       ALA  58   6.004  -5.442  -9.003
  402    HB1  ALA  58           HB3      ALA  58   7.474  -3.682  -9.881
  403    HB2  ALA  58           HB1      ALA  58   7.259  -5.000 -11.033
  404    HB3  ALA  58           HB2      ALA  58   8.754  -4.875 -10.106
  405    H    LEU  59           HN       LEU  59   9.262  -6.810  -8.590
  406    HA   LEU  59           HA       LEU  59   8.792  -9.129 -10.139
  407    HG   LEU  59           HG       LEU  59  11.137  -7.244 -10.000
  408    HB2  LEU  59           HB2      LEU  59  10.781  -8.586  -7.936
  409    HB3  LEU  59           HB1      LEU  59  10.784 -10.040  -8.916
  410   HD11  LEU  59          HD11      LEU  59  13.177  -9.398  -9.472
  411   HD12  LEU  59          HD12      LEU  59  13.015  -7.879  -8.590
  412   HD13  LEU  59          HD13      LEU  59  13.484  -7.867 -10.290
  413   HD21  LEU  59          HD23      LEU  59  11.845  -8.397 -12.042
  414   HD22  LEU  59          HD21      LEU  59  10.177  -8.787 -11.620
  415   HD23  LEU  59          HD22      LEU  59  11.463  -9.948 -11.295
  416    H    ASP  60           HN       ASP  60   7.829  -8.221  -6.984
  417    HA   ASP  60           HA       ASP  60   7.643 -10.720  -5.726
  418    HB2  ASP  60           HB2      ASP  60   7.414  -8.604  -4.510
  419    HB3  ASP  60           HB1      ASP  60   5.906  -8.269  -5.356
  420    H    GLY  61           HN       GLY  61   5.089  -8.862  -7.401
  421    HA2  GLY  61           HA2      GLY  61   3.564  -9.823  -8.945
  422    HA3  GLY  61           HA1      GLY  61   3.909 -11.404  -8.263
  423    H    ARG  62           HN       ARG  62   3.454 -11.053  -5.602
  424    HA   ARG  62           HA       ARG  62   0.693 -11.302  -5.391
  425    HE   ARG  62           HE       ARG  62   4.225 -11.648  -2.138
  426    HB2  ARG  62           HB2      ARG  62   2.641 -10.540  -3.210
  427    HB3  ARG  62           HB1      ARG  62   1.015 -11.160  -2.961
  428    HG2  ARG  62           HG2      ARG  62   1.672 -13.251  -4.093
  429    HG3  ARG  62           HG1      ARG  62   3.315 -12.626  -4.234
  430    HD2  ARG  62           HD2      ARG  62   1.845 -12.998  -1.628
  431    HD3  ARG  62           HD1      ARG  62   2.979 -14.163  -2.307
  432   HH11  ARG  62          HH11      ARG  62   3.061 -14.211  -0.079
  433   HH12  ARG  62          HH12      ARG  62   4.214 -13.899   1.175
  434   HH21  ARG  62          HH21      ARG  62   5.741 -11.231  -0.490
  435   HH22  ARG  62          HH22      ARG  62   5.735 -12.202   0.944
  436    H    ILE  63           HN       ILE  63   2.735  -8.461  -5.004
  437    HA   ILE  63           HA       ILE  63   0.697  -6.777  -3.952
  438    HB   ILE  63           HB       ILE  63   3.204  -5.969  -5.434
  439   HG12  ILE  63          HG12      ILE  63   2.734  -6.274  -2.459
  440   HG13  ILE  63          HG11      ILE  63   3.636  -7.411  -3.455
  441   HG21  ILE  63          HG21      ILE  63   2.940  -3.842  -4.245
  442   HG22  ILE  63          HG22      ILE  63   1.428  -4.423  -3.549
  443   HG23  ILE  63          HG23      ILE  63   1.561  -4.177  -5.290
  444   HD11  ILE  63          HD13      ILE  63   4.372  -4.533  -2.977
  445   HD12  ILE  63          HD11      ILE  63   5.285  -5.692  -3.943
  446   HD13  ILE  63          HD12      ILE  63   5.112  -5.935  -2.204
  447    H    GLU  64           HN       GLU  64  -1.051  -6.129  -5.003
  448    HA   GLU  64           HA       GLU  64  -0.975  -5.952  -7.930
  449    HB2  GLU  64           HB2      GLU  64  -2.694  -7.418  -6.912
  450    HB3  GLU  64           HB1      GLU  64  -3.362  -6.023  -6.076
  451    HG2  GLU  64           HG2      GLU  64  -3.914  -4.989  -8.205
  452    HG3  GLU  64           HG1      GLU  64  -3.206  -6.357  -9.064
  453    HA   PRO  65           HA       PRO  65  -0.899  -1.509  -7.625
  454    HB2  PRO  65           HB2      PRO  65  -1.935  -0.969 -10.118
  455    HB3  PRO  65           HB1      PRO  65  -0.241  -1.359  -9.805
  456    HG2  PRO  65           HG2      PRO  65  -2.449  -3.132 -10.768
  457    HG3  PRO  65           HG1      PRO  65  -0.758  -3.056 -11.299
  458    HD2  PRO  65           HD2      PRO  65  -1.624  -4.983  -9.644
  459    HD3  PRO  65           HD1      PRO  65   0.000  -4.279  -9.482
  460    H    ASN  66           HN       ASN  66  -2.447   0.353  -8.002
  461    HA   ASN  66           HA       ASN  66  -4.396   1.386  -7.444
  462    HB2  ASN  66           HB2      ASN  66  -5.555  -1.058  -8.801
  463    HB3  ASN  66           HB1      ASN  66  -6.495   0.357  -8.338
  464   HD21  ASN  66          HD21      ASN  66  -7.082   0.821 -10.432
  465   HD22  ASN  66          HD22      ASN  66  -5.970   1.452 -11.594
  466    H    ASP  67           HN       ASP  67  -3.318   0.311  -5.297
  467    HA   ASP  67           HA       ASP  67  -5.571  -0.963  -3.883
  468    HB2  ASP  67           HB2      ASP  67  -3.942  -2.135  -2.470
  469    HB3  ASP  67           HB1      ASP  67  -3.723  -2.553  -4.167
  470    H    LYS  68           HN       LYS  68  -5.231  -0.696  -1.398
  471    HA   LYS  68           HA       LYS  68  -4.531   2.124  -0.904
  472    HB2  LYS  68           HB2      LYS  68  -6.925   1.719  -0.690
  473    HB3  LYS  68           HB1      LYS  68  -6.625   0.403   0.438
  474    HG2  LYS  68           HG2      LYS  68  -5.671   1.996   2.033
  475    HG3  LYS  68           HG1      LYS  68  -5.994   3.311   0.902
  476    HD2  LYS  68           HD2      LYS  68  -8.384   2.842   1.021
  477    HD3  LYS  68           HD1      LYS  68  -8.074   1.494   2.119
  478    HE2  LYS  68           HE2      LYS  68  -7.155   3.031   3.768
  479    HE3  LYS  68           HE1      LYS  68  -7.408   4.384   2.666
  480    HZ1  LYS  68           HZ3      LYS  68  -9.165   4.239   4.318
  481    HZ2  LYS  68           HZ1      LYS  68  -9.545   2.669   3.813
  482    HZ3  LYS  68           HZ2      LYS  68  -9.786   3.977   2.767
  483    H    ILE  69           HN       ILE  69  -2.964   2.523   0.519
  484    HA   ILE  69           HA       ILE  69  -1.794   0.298   1.986
  485    HB   ILE  69           HB       ILE  69  -0.857   3.161   1.762
  486   HG12  ILE  69          HG12      ILE  69  -0.859   2.001  -0.406
  487   HG13  ILE  69          HG11      ILE  69   0.783   2.298   0.155
  488   HG21  ILE  69          HG21      ILE  69  -0.031   2.050   3.770
  489   HG22  ILE  69          HG22      ILE  69   1.273   2.317   2.613
  490   HG23  ILE  69          HG23      ILE  69   0.568   0.711   2.792
  491   HD11  ILE  69          HD13      ILE  69  -0.703  -0.314   0.296
  492   HD12  ILE  69          HD11      ILE  69   0.925  -0.032   0.912
  493   HD13  ILE  69          HD12      ILE  69   0.600   0.096  -0.817
  494    H    LEU  70           HN       LEU  70  -1.707   0.114   4.182
  495    HA   LEU  70           HA       LEU  70  -3.345   2.025   5.709
  496    HG   LEU  70           HG       LEU  70  -4.405  -0.595   4.467
  497    HB2  LEU  70           HB2      LEU  70  -2.736  -0.875   6.294
  498    HB3  LEU  70           HB1      LEU  70  -3.710   0.178   7.302
  499   HD11  LEU  70          HD11      LEU  70  -4.499  -2.530   5.936
  500   HD12  LEU  70          HD12      LEU  70  -6.124  -2.011   5.487
  501   HD13  LEU  70          HD13      LEU  70  -5.485  -1.627   7.086
  502   HD21  LEU  70          HD23      LEU  70  -5.982   0.845   6.597
  503   HD22  LEU  70          HD21      LEU  70  -6.596   0.352   5.018
  504   HD23  LEU  70          HD22      LEU  70  -5.317   1.562   5.129
  505    H    ARG  71           HN       ARG  71  -0.688  -0.287   6.335
  506    HA   ARG  71           HA       ARG  71   0.847   1.822   7.611
  507    HE   ARG  71           HE       ARG  71  -1.584   0.543  10.891
  508    HB2  ARG  71           HB2      ARG  71   1.139   0.506   9.704
  509    HB3  ARG  71           HB1      ARG  71  -0.502   1.093   9.466
  510    HG2  ARG  71           HG2      ARG  71  -1.169  -1.119   8.653
  511    HG3  ARG  71           HG1      ARG  71   0.474  -1.704   8.921
  512    HD2  ARG  71           HD2      ARG  71  -1.060  -2.310  10.751
  513    HD3  ARG  71           HD1      ARG  71   0.275  -1.295  11.293
  514   HH11  ARG  71          HH11      ARG  71  -1.840  -2.582  12.412
  515   HH12  ARG  71          HH12      ARG  71  -3.115  -2.100  13.482
  516   HH21  ARG  71          HH21      ARG  71  -3.256   1.188  12.300
  517   HH22  ARG  71          HH22      ARG  71  -3.919   0.044  13.419
  518    H    VAL  72           HN       VAL  72   2.987   1.523   7.466
  519    HA   VAL  72           HA       VAL  72   3.942  -0.813   6.020
  520    HB   VAL  72           HB       VAL  72   5.715   1.429   6.937
  521   HG11  VAL  72          HG11      VAL  72   6.793  -0.422   5.837
  522   HG12  VAL  72          HG12      VAL  72   6.817   0.977   4.766
  523   HG13  VAL  72          HG13      VAL  72   5.663  -0.327   4.486
  524   HG21  VAL  72          HG23      VAL  72   5.128   2.712   4.929
  525   HG22  VAL  72          HG21      VAL  72   3.756   2.543   6.024
  526   HG23  VAL  72          HG22      VAL  72   3.850   1.551   4.570
  527    H    ASP  73           HN       ASP  73   6.260  -1.547   6.783
  528    HA   ASP  73           HA       ASP  73   6.067  -2.978   9.108
  529    HB2  ASP  73           HB2      ASP  73   7.816  -3.193   7.288
  530    HB3  ASP  73           HB1      ASP  73   8.678  -1.873   8.071
  531    H    ASP  74           HN       ASP  74   5.602  -2.193  11.067
  532    HA   ASP  74           HA       ASP  74   5.704  -1.006  13.004
  533    HB2  ASP  74           HB2      ASP  74   8.045  -1.924  12.889
  534    HB3  ASP  74           HB1      ASP  74   8.550  -0.387  12.196
  535    H    VAL  75           HN       VAL  75   4.915   0.386  10.528
  536    HA   VAL  75           HA       VAL  75   5.145   3.108  11.552
  537    HB   VAL  75           HB       VAL  75   5.794   2.422   8.677
  538   HG11  VAL  75          HG11      VAL  75   4.577   4.510   8.830
  539   HG12  VAL  75          HG12      VAL  75   6.269   4.828   8.449
  540   HG13  VAL  75          HG13      VAL  75   5.672   5.085  10.088
  541   HG21  VAL  75          HG23      VAL  75   7.558   3.499  10.876
  542   HG22  VAL  75          HG21      VAL  75   8.027   3.304   9.187
  543   HG23  VAL  75          HG22      VAL  75   7.644   1.889  10.165
  544    H    ASN  76           HN       ASN  76   3.386   4.410  11.064
  545    HA   ASN  76           HA       ASN  76   1.171   3.069   9.656
  546    HB2  ASN  76           HB2      ASN  76   0.715   3.383  12.044
  547    HB3  ASN  76           HB1      ASN  76   1.042   5.107  11.892
  548   HD21  ASN  76          HD21      ASN  76  -0.998   5.691  12.581
  549   HD22  ASN  76          HD22      ASN  76  -2.406   5.471  11.606
  550    H    VAL  77           HN       VAL  77   0.325   4.049   7.908
  551    HA   VAL  77           HA       VAL  77   1.234   6.796   7.340
  552    HB   VAL  77           HB       VAL  77   0.932   6.285   4.957
  553   HG11  VAL  77          HG11      VAL  77   2.826   4.709   4.730
  554   HG12  VAL  77          HG12      VAL  77   2.703   4.356   6.454
  555   HG13  VAL  77          HG13      VAL  77   3.126   5.980   5.914
  556   HG21  VAL  77          HG23      VAL  77   0.527   4.000   4.215
  557   HG22  VAL  77          HG21      VAL  77  -0.824   4.591   5.183
  558   HG23  VAL  77          HG22      VAL  77   0.346   3.475   5.890
  559    H    GLN  78           HN       GLN  78  -1.180   5.922   8.851
  560    HA   GLN  78           HA       GLN  78  -3.345   6.752   7.074
  561    HB2  GLN  78           HB2      GLN  78  -3.381   5.754   9.927
  562    HB3  GLN  78           HB1      GLN  78  -4.813   6.182   9.002
  563    HG2  GLN  78           HG2      GLN  78  -2.862   3.998   8.306
  564    HG3  GLN  78           HG1      GLN  78  -4.441   3.772   9.055
  565   HE21  GLN  78          HE21      GLN  78  -2.734   4.578   6.138
  566   HE22  GLN  78          HE22      GLN  78  -4.079   4.419   5.065
  567    H    GLY  79           HN       GLY  79  -1.287   8.646   7.868
  568    HA2  GLY  79           HA2      GLY  79  -2.873  10.882   8.420
  569    HA3  GLY  79           HA1      GLY  79  -2.169  10.347   9.937
  570    H    MET  80           HN       MET  80  -0.600  10.110   6.787
  571    HA   MET  80           HA       MET  80   1.196  12.309   7.542
  572    HB2  MET  80           HB2      MET  80   2.079   9.603   6.529
  573    HB3  MET  80           HB1      MET  80   3.134  10.987   6.776
  574    HG2  MET  80           HG2      MET  80   2.428  10.944   9.193
  575    HG3  MET  80           HG1      MET  80   1.663   9.393   8.852
  576    HE1  MET  80           HE3      MET  80   4.785   7.264   7.706
  577    HE2  MET  80           HE1      MET  80   3.867   8.316   6.627
  578    HE3  MET  80           HE2      MET  80   3.027   7.325   7.819
  579    H    ALA  81           HN       ALA  81   2.063  13.479   5.844
  580    HA   ALA  81           HA       ALA  81   0.536  13.626   3.489
  581    HB1  ALA  81           HB3      ALA  81   1.828  15.505   4.491
  582    HB2  ALA  81           HB1      ALA  81   2.078  15.306   2.757
  583    HB3  ALA  81           HB2      ALA  81   3.303  14.747   3.894
  584    H    GLN  82           HN       GLN  82   1.084  13.158   1.324
  585    HA   GLN  82           HA       GLN  82   2.001  10.655   0.751
  586    HB2  GLN  82           HB2      GLN  82   0.791  12.040  -0.855
  587    HB3  GLN  82           HB1      GLN  82   2.187  13.098  -1.019
  588    HG2  GLN  82           HG2      GLN  82   3.476  11.240  -1.956
  589    HG3  GLN  82           HG1      GLN  82   2.062  10.196  -1.809
  590   HE21  GLN  82          HE21      GLN  82   1.995   9.808  -4.018
  591   HE22  GLN  82          HE22      GLN  82   1.468  11.004  -5.149
  592    H    SER  83           HN       SER  83   3.923  13.644   0.521
  593    HA   SER  83           HA       SER  83   6.313  12.601  -0.355
  594    HG   SER  83           HG       SER  83   5.334  15.977  -0.006
  595    HB2  SER  83           HB2      SER  83   5.918  14.835   1.648
  596    HB3  SER  83           HB1      SER  83   7.394  14.536   0.730
  597    H    ASP  84           HN       ASP  84   5.210  12.896   3.015
  598    HA   ASP  84           HA       ASP  84   7.508  11.870   4.236
  599    HB2  ASP  84           HB2      ASP  84   4.623  11.760   5.138
  600    HB3  ASP  84           HB1      ASP  84   5.999  11.351   6.159
  601    H    VAL  85           HN       VAL  85   4.623  10.225   3.006
  602    HA   VAL  85           HA       VAL  85   5.193   7.653   3.944
  603    HB   VAL  85           HB       VAL  85   3.842   8.263   1.314
  604   HG11  VAL  85          HG11      VAL  85   4.343   5.911   1.695
  605   HG12  VAL  85          HG12      VAL  85   2.606   6.200   1.782
  606   HG13  VAL  85          HG13      VAL  85   3.537   5.981   3.262
  607   HG21  VAL  85          HG23      VAL  85   2.835   9.653   3.026
  608   HG22  VAL  85          HG21      VAL  85   2.655   8.258   4.088
  609   HG23  VAL  85          HG22      VAL  85   1.736   8.348   2.584
  610    H    VAL  86           HN       VAL  86   6.269   9.345   1.039
  611    HA   VAL  86           HA       VAL  86   7.511   7.123  -0.199
  612    HB   VAL  86           HB       VAL  86   8.238  10.037  -0.529
  613   HG11  VAL  86          HG11      VAL  86   8.621   7.675  -2.364
  614   HG12  VAL  86          HG12      VAL  86   9.889   8.492  -1.451
  615   HG13  VAL  86          HG13      VAL  86   9.036   9.349  -2.735
  616   HG21  VAL  86          HG23      VAL  86   5.856   9.719  -0.898
  617   HG22  VAL  86          HG21      VAL  86   6.188   8.385  -2.003
  618   HG23  VAL  86          HG22      VAL  86   6.679  10.025  -2.427
  619    H    GLU  87           HN       GLU  87   8.653   9.563   2.082
  620    HA   GLU  87           HA       GLU  87  11.387   9.019   1.979
  621    HB2  GLU  87           HB2      GLU  87   9.703   9.911   4.328
  622    HB3  GLU  87           HB1      GLU  87  11.461   9.947   4.289
  623    HG2  GLU  87           HG2      GLU  87  11.372  11.502   2.393
  624    HG3  GLU  87           HG1      GLU  87   9.612  11.489   2.484
  625    H    VAL  88           HN       VAL  88   8.853   7.576   4.001
  626    HA   VAL  88           HA       VAL  88  10.475   5.866   5.504
  627    HB   VAL  88           HB       VAL  88   7.599   5.573   4.639
  628   HG11  VAL  88          HG11      VAL  88   7.392   3.857   6.390
  629   HG12  VAL  88          HG12      VAL  88   9.138   3.913   6.636
  630   HG13  VAL  88          HG13      VAL  88   8.482   3.357   5.095
  631   HG21  VAL  88          HG23      VAL  88   8.852   6.404   7.255
  632   HG22  VAL  88          HG21      VAL  88   7.123   6.243   6.946
  633   HG23  VAL  88          HG22      VAL  88   8.060   7.471   6.094
  634    H    LEU  89           HN       LEU  89   8.618   5.154   2.550
  635    HA   LEU  89           HA       LEU  89   9.427   2.520   2.225
  636    HG   LEU  89           HG       LEU  89   6.919   4.272   1.691
  637    HB2  LEU  89           HB2      LEU  89   8.786   4.529   0.062
  638    HB3  LEU  89           HB1      LEU  89   8.809   2.788  -0.137
  639   HD11  LEU  89          HD11      LEU  89   6.466   4.788  -0.647
  640   HD12  LEU  89          HD12      LEU  89   5.208   3.753   0.026
  641   HD13  LEU  89          HD13      LEU  89   6.441   3.067  -1.031
  642   HD21  LEU  89          HD23      LEU  89   7.380   1.999   2.429
  643   HD22  LEU  89          HD21      LEU  89   7.011   1.386   0.817
  644   HD23  LEU  89          HD22      LEU  89   5.741   2.124   1.793
  645    H    ARG  90           HN       ARG  90  11.137   5.471   1.583
  646    HA   ARG  90           HA       ARG  90  13.180   4.136   0.002
  647    HE   ARG  90           HE       ARG  90  11.636   8.600   0.015
  648    HB2  ARG  90           HB2      ARG  90  12.836   6.999   0.890
  649    HB3  ARG  90           HB1      ARG  90  14.239   6.428  -0.002
  650    HG2  ARG  90           HG2      ARG  90  12.800   5.757  -1.853
  651    HG3  ARG  90           HG1      ARG  90  11.386   6.319  -0.958
  652    HD2  ARG  90           HD2      ARG  90  13.715   8.043  -1.798
  653    HD3  ARG  90           HD1      ARG  90  12.166   7.950  -2.635
  654   HH11  ARG  90          HH11      ARG  90  13.277   9.990  -2.725
  655   HH12  ARG  90          HH12      ARG  90  12.973  11.625  -2.242
  656   HH21  ARG  90          HH21      ARG  90  11.227  10.749   0.659
  657   HH22  ARG  90          HH22      ARG  90  11.809  12.056  -0.318
  658    H    ASN  91           HN       ASN  91  12.584   4.951   3.280
  659    HA   ASN  91           HA       ASN  91  15.393   4.847   4.027
  660    HB2  ASN  91           HB2      ASN  91  12.875   5.235   5.650
  661    HB3  ASN  91           HB1      ASN  91  14.486   5.163   6.355
  662   HD21  ASN  91          HD21      ASN  91  12.540   7.333   6.333
  663   HD22  ASN  91          HD22      ASN  91  13.338   8.683   5.610
  664    H    ALA  92           HN       ALA  92  12.931   2.655   3.468
  665    HA   ALA  92           HA       ALA  92  13.221   0.767   5.500
  666    HB1  ALA  92           HB3      ALA  92  11.428   0.681   3.853
  667    HB2  ALA  92           HB1      ALA  92  12.302  -0.849   3.915
  668    HB3  ALA  92           HB2      ALA  92  12.592   0.280   2.591
  669    H    GLY  93           HN       GLY  93  14.343  -0.165   2.286
  670    HA2  GLY  93           HA2      GLY  93  16.253  -1.238   1.597
  671    HA3  GLY  93           HA1      GLY  93  17.095  -0.302   2.823
  672    H    ASN  94           HN       ASN  94  14.518  -2.311   3.871
  673    HA   ASN  94           HA       ASN  94  16.267  -4.550   4.515
  674    HB2  ASN  94           HB2      ASN  94  15.046  -2.673   6.520
  675    HB3  ASN  94           HB1      ASN  94  15.336  -4.355   6.950
  676   HD21  ASN  94          HD21      ASN  94  17.684  -4.591   5.283
  677   HD22  ASN  94          HD22      ASN  94  18.944  -3.725   6.079
  678    HA   PRO  95           HA       PRO  95  12.603  -7.048   4.175
  679    HB2  PRO  95           HB2      PRO  95  12.443  -8.454   6.532
  680    HB3  PRO  95           HB1      PRO  95  13.516  -8.877   5.195
  681    HG2  PRO  95           HG2      PRO  95  14.121  -7.370   7.707
  682    HG3  PRO  95           HG1      PRO  95  15.085  -8.611   6.884
  683    HD2  PRO  95           HD2      PRO  95  15.677  -6.010   6.659
  684    HD3  PRO  95           HD1      PRO  95  15.870  -7.123   5.289
  685    H    VAL  96           HN       VAL  96  11.163  -5.257   4.186
  686    HA   VAL  96           HA       VAL  96   9.874  -4.664   6.756
  687    HB   VAL  96           HB       VAL  96   8.883  -2.716   5.599
  688   HG11  VAL  96          HG11      VAL  96  10.950  -1.414   5.431
  689   HG12  VAL  96          HG12      VAL  96  11.886  -2.908   5.402
  690   HG13  VAL  96          HG13      VAL  96  10.965  -2.473   6.841
  691   HG21  VAL  96          HG23      VAL  96   9.704  -2.074   3.388
  692   HG22  VAL  96          HG21      VAL  96   8.857  -3.619   3.330
  693   HG23  VAL  96          HG22      VAL  96  10.619  -3.578   3.288
  694    H    ARG  97           HN       ARG  97   7.624  -4.633   6.957
  695    HA   ARG  97           HA       ARG  97   6.231  -6.472   5.153
  696    HE   ARG  97           HE       ARG  97   1.996  -8.148   7.324
  697    HB2  ARG  97           HB2      ARG  97   6.262  -7.083   7.528
  698    HB3  ARG  97           HB1      ARG  97   5.540  -5.537   7.948
  699    HG2  ARG  97           HG2      ARG  97   3.504  -6.136   6.782
  700    HG3  ARG  97           HG1      ARG  97   4.229  -7.659   6.258
  701    HD2  ARG  97           HD2      ARG  97   4.473  -8.326   8.615
  702    HD3  ARG  97           HD1      ARG  97   3.692  -6.826   9.107
  703   HH11  ARG  97          HH11      ARG  97   3.301  -8.555  10.527
  704   HH12  ARG  97          HH12      ARG  97   1.944  -9.464  11.105
  705   HH21  ARG  97          HH21      ARG  97   0.203  -9.345   8.076
  706   HH22  ARG  97          HH22      ARG  97   0.184  -9.913   9.712
  707    H    LEU  98           HN       LEU  98   4.277  -5.925   4.194
  708    HA   LEU  98           HA       LEU  98   3.519  -3.081   4.377
  709    HG   LEU  98           HG       LEU  98   5.183  -5.341   2.325
  710    HB2  LEU  98           HB2      LEU  98   2.835  -4.455   1.880
  711    HB3  LEU  98           HB1      LEU  98   3.493  -2.852   2.139
  712   HD11  LEU  98          HD11      LEU  98   4.741  -3.564  -0.072
  713   HD12  LEU  98          HD12      LEU  98   4.182  -5.229   0.099
  714   HD13  LEU  98          HD13      LEU  98   5.910  -4.880   0.045
  715   HD21  LEU  98          HD23      LEU  98   5.846  -2.424   1.930
  716   HD22  LEU  98          HD21      LEU  98   7.010  -3.748   1.928
  717   HD23  LEU  98          HD22      LEU  98   6.110  -3.367   3.396
  718    H    LEU  99           HN       LEU  99   1.689  -3.085   5.568
  719    HA   LEU  99           HA       LEU  99  -0.326  -5.146   5.086
  720    HG   LEU  99           HG       LEU  99  -2.539  -3.640   6.824
  721    HB2  LEU  99           HB2      LEU  99   0.255  -4.636   7.413
  722    HB3  LEU  99           HB1      LEU  99  -0.210  -2.963   7.172
  723   HD11  LEU  99          HD11      LEU  99  -2.168  -5.830   5.839
  724   HD12  LEU  99          HD12      LEU  99  -3.230  -5.952   7.243
  725   HD13  LEU  99          HD13      LEU  99  -1.536  -6.430   7.373
  726   HD21  LEU  99          HD23      LEU  99  -3.015  -4.398   9.112
  727   HD22  LEU  99          HD21      LEU  99  -1.823  -3.100   9.077
  728   HD23  LEU  99          HD22      LEU  99  -1.305  -4.765   9.336
  729    H    LEU 100           HN       LEU 100  -1.557  -4.725   3.364
  730    HA   LEU 100           HA       LEU 100  -2.858  -2.097   3.225
  731    HG   LEU 100           HG       LEU 100  -0.288  -4.003   1.660
  732    HB2  LEU 100           HB2      LEU 100  -2.729  -2.558   0.633
  733    HB3  LEU 100           HB1      LEU 100  -1.427  -1.752   1.486
  734   HD11  LEU 100          HD11      LEU 100  -2.287  -5.372   1.254
  735   HD12  LEU 100          HD12      LEU 100  -0.974  -5.750   0.139
  736   HD13  LEU 100          HD13      LEU 100  -2.340  -4.776  -0.405
  737   HD21  LEU 100          HD23      LEU 100   0.520  -3.948  -0.660
  738   HD22  LEU 100          HD21      LEU 100   0.438  -2.340   0.059
  739   HD23  LEU 100          HD22      LEU 100  -0.802  -2.861  -1.081
  740    H    ILE 101           HN       ILE 101  -4.773  -2.144   1.707
  741    HA   ILE 101           HA       ILE 101  -6.157  -4.738   1.892
  742    HB   ILE 101           HB       ILE 101  -7.128  -3.242   3.520
  743   HG12  ILE 101          HG12      ILE 101  -8.909  -3.422   1.076
  744   HG13  ILE 101          HG11      ILE 101  -8.656  -4.713   2.244
  745   HG21  ILE 101          HG21      ILE 101  -7.513  -1.313   1.239
  746   HG22  ILE 101          HG22      ILE 101  -6.371  -1.136   2.571
  747   HG23  ILE 101          HG23      ILE 101  -8.107  -1.092   2.884
  748   HD11  ILE 101          HD13      ILE 101 -10.771  -3.545   2.593
  749   HD12  ILE 101          HD11      ILE 101  -9.894  -2.037   2.846
  750   HD13  ILE 101          HD12      ILE 101  -9.693  -3.374   3.978
  751    H    ARG 102           HN       ARG 102  -7.380  -5.384   0.168
  752    HA   ARG 102           HA       ARG 102  -8.078  -3.661  -1.994
  753    HE   ARG 102           HE       ARG 102  -7.211  -4.230  -6.648
  754    HB2  ARG 102           HB2      ARG 102  -5.719  -3.861  -2.546
  755    HB3  ARG 102           HB1      ARG 102  -5.814  -5.611  -2.443
  756    HG2  ARG 102           HG2      ARG 102  -5.787  -4.951  -4.746
  757    HG3  ARG 102           HG1      ARG 102  -7.372  -5.615  -4.352
  758    HD2  ARG 102           HD2      ARG 102  -8.253  -3.338  -4.108
  759    HD3  ARG 102           HD1      ARG 102  -6.668  -2.686  -4.525
  760   HH11  ARG 102          HH11      ARG 102  -9.106  -1.822  -4.984
  761   HH12  ARG 102          HH12      ARG 102  -9.991  -1.356  -6.399
  762   HH21  ARG 102          HH21      ARG 102  -8.369  -3.624  -8.513
  763   HH22  ARG 102          HH22      ARG 102  -9.572  -2.381  -8.407
  764    H    ARG 103           HN       ARG 103  -9.703  -4.517  -3.161
  765    HA   ARG 103           HA       ARG 103 -11.004  -6.817  -2.223
  766    HE   ARG 103           HE       ARG 103 -12.592  -5.908  -6.600
  767    HB2  ARG 103           HB2      ARG 103 -12.137  -4.933  -3.369
  768    HB3  ARG 103           HB1      ARG 103 -11.382  -5.422  -4.880
  769    HG2  ARG 103           HG2      ARG 103 -12.560  -7.581  -4.739
  770    HG3  ARG 103           HG1      ARG 103 -13.358  -7.024  -3.267
  771    HD2  ARG 103           HD2      ARG 103 -14.833  -6.724  -5.156
  772    HD3  ARG 103           HD1      ARG 103 -14.334  -5.151  -4.536
  773   HH11  ARG 103          HH11      ARG 103 -15.906  -4.940  -6.118
  774   HH12  ARG 103          HH12      ARG 103 -16.072  -4.258  -7.701
  775   HH21  ARG 103          HH21      ARG 103 -12.802  -5.011  -8.687
  776   HH22  ARG 103          HH22      ARG 103 -14.308  -4.298  -9.161
  777    H    LEU 104           HN       LEU 104 -11.217  -8.863  -3.007
  778    HA   LEU 104           HA       LEU 104  -9.103  -9.747  -4.841
  779    HG   LEU 104           HG       LEU 104  -9.135  -9.636  -1.939
  780    HB2  LEU 104           HB2      LEU 104 -10.796 -11.448  -3.016
  781    HB3  LEU 104           HB1      LEU 104  -9.314 -11.910  -3.834
  782   HD11  LEU 104          HD11      LEU 104  -8.918 -11.173  -0.028
  783   HD12  LEU 104          HD12      LEU 104  -9.484 -12.495  -1.049
  784   HD13  LEU 104          HD13      LEU 104 -10.553 -11.137  -0.688
  785   HD21  LEU 104          HD23      LEU 104  -7.400 -12.036  -2.516
  786   HD22  LEU 104          HD21      LEU 104  -6.986 -10.697  -1.446
  787   HD23  LEU 104          HD22      LEU 104  -7.185 -10.413  -3.175
  788    HA   PRO 105           HA       PRO 105 -12.189 -10.861  -7.824
  789    HB2  PRO 105           HB2      PRO 105 -10.868 -12.622  -9.335
  790    HB3  PRO 105           HB1      PRO 105 -10.361 -10.930  -9.256
  791    HG2  PRO 105           HG2      PRO 105  -9.232 -13.313  -7.843
  792    HG3  PRO 105           HG1      PRO 105  -8.378 -11.980  -8.640
  793    HD2  PRO 105           HD2      PRO 105  -8.811 -12.138  -5.928
  794    HD3  PRO 105           HD1      PRO 105  -8.554 -10.619  -6.807
  795    H    LEU 106           HN       LEU 106 -13.549 -12.579  -8.558
  796    HA   LEU 106           HA       LEU 106 -13.387 -15.115  -7.121
  797    HG   LEU 106           HG       LEU 106 -14.062 -12.849  -5.283
  798    HB2  LEU 106           HB2      LEU 106 -15.780 -13.279  -7.058
  799    HB3  LEU 106           HB1      LEU 106 -15.816 -14.955  -6.546
  800   HD11  LEU 106          HD11      LEU 106 -15.667 -12.881  -3.432
  801   HD12  LEU 106          HD12      LEU 106 -16.720 -13.940  -4.369
  802   HD13  LEU 106          HD13      LEU 106 -16.402 -12.297  -4.925
  803   HD21  LEU 106          HD23      LEU 106 -13.237 -15.133  -5.038
  804   HD22  LEU 106          HD21      LEU 106 -14.805 -15.639  -4.411
  805   HD23  LEU 106          HD22      LEU 106 -13.816 -14.498  -3.498
  806    H    LEU 107           HN       LEU 107 -13.770 -16.754  -8.457
  807    HA   LEU 107           HA       LEU 107 -14.477 -16.338 -11.167
  808    HG   LEU 107           HG       LEU 107 -12.292 -19.345 -10.925
  809    HB2  LEU 107           HB2      LEU 107 -14.209 -18.828  -9.493
  810    HB3  LEU 107           HB1      LEU 107 -14.647 -18.882 -11.188
  811   HD11  LEU 107          HD11      LEU 107 -12.639 -16.586 -12.074
  812   HD12  LEU 107          HD12      LEU 107 -13.112 -18.075 -12.891
  813   HD13  LEU 107          HD13      LEU 107 -11.416 -17.782 -12.506
  814   HD21  LEU 107          HD23      LEU 107 -10.737 -17.703 -10.035
  815   HD22  LEU 107          HD21      LEU 107 -11.925 -18.156  -8.813
  816   HD23  LEU 107          HD22      LEU 107 -12.073 -16.615  -9.660
  817    H    GLU 108           HN       GLU 108 -16.460 -15.547 -11.576
  818    HA   GLU 108           HA       GLU 108 -18.719 -15.400 -11.756
  819    HB2  GLU 108           HB2      GLU 108 -18.540 -18.371 -11.231
  820    HB3  GLU 108           HB1      GLU 108 -19.972 -17.538 -11.825
  821    HG2  GLU 108           HG2      GLU 108 -17.316 -17.684 -13.234
  822    HG3  GLU 108           HG1      GLU 108 -18.741 -18.647 -13.618
  Start of MODEL   25
    1    H1   GLY   1           HT1      GLY   1  -3.773  -2.446  16.143
    2    H2   GLY   1           HT2      GLY   1  -5.148  -3.375  16.468
    3    H3   GLY   1           HT3      GLY   1  -5.276  -1.694  16.338
    4    HA2  GLY   1           HA1      GLY   1  -4.668  -1.792  14.003
    5    HA3  GLY   1           HA2      GLY   1  -4.526  -3.539  14.137
    6    H    SER   2           HN       SER   2  -6.121  -2.957  12.232
    7    HA   SER   2           HA       SER   2  -8.849  -3.093  13.337
    8    HG   SER   2           HG       SER   2  -8.317  -0.854  13.166
    9    HB2  SER   2           HB2      SER   2  -7.971  -1.911  10.689
   10    HB3  SER   2           HB1      SER   2  -9.640  -2.054  11.237
   11    H    HIS   3           HN       HIS   3 -10.310  -4.525  12.351
   12    HA   HIS   3           HA       HIS   3  -9.563  -6.183  10.149
   13    HD1  HIS   3           HD1      HIS   3 -11.015  -9.518  12.429
   14    HD2  HIS   3           HD2      HIS   3  -8.077  -8.861   9.563
   15    HE1  HIS   3           HE1      HIS   3 -10.988 -11.592  11.006
   16    HE2  HIS   3           HE2      HIS   3  -9.241 -11.150   9.245
   17    HB2  HIS   3           HB2      HIS   3  -8.193  -7.218  11.921
   18    HB3  HIS   3           HB1      HIS   3  -9.641  -7.458  12.892
   19    H    GLY   4           HN       GLY   4 -11.514  -5.853   9.206
   20    HA2  GLY   4           HA2      GLY   4 -13.833  -7.025  10.578
   21    HA3  GLY   4           HA1      GLY   4 -13.965  -5.398   9.929
   22    H    TYR   5           HN       TYR   5 -12.587  -5.690   7.531
   23    HA   TYR   5           HA       TYR   5 -14.585  -7.069   5.974
   24    HD1  TYR   5           HD1      TYR   5 -15.629  -5.026   4.212
   25    HD2  TYR   5           HD2      TYR   5 -12.229  -3.606   6.340
   26    HE1  TYR   5           HE1      TYR   5 -16.761  -2.874   4.573
   27    HE2  TYR   5           HE2      TYR   5 -13.353  -1.450   6.707
   28    HH   TYR   5           HH       TYR   5 -16.679  -0.980   6.086
   29    HB2  TYR   5           HB2      TYR   5 -12.089  -5.617   5.066
   30    HB3  TYR   5           HB1      TYR   5 -13.415  -6.139   4.032
   31    H    SER   6           HN       SER   6 -14.197  -9.247   6.607
   32    HA   SER   6           HA       SER   6 -11.641 -10.425   5.844
   33    HG   SER   6           HG       SER   6 -11.556 -10.776   8.196
   34    HB2  SER   6           HB2      SER   6 -14.057 -11.660   7.188
   35    HB3  SER   6           HB1      SER   6 -12.521 -12.477   6.904
   36    H    ASP   7           HN       ASP   7 -11.758 -10.270   3.595
   37    HA   ASP   7           HA       ASP   7 -12.228 -10.946   1.477
   38    HB2  ASP   7           HB2      ASP   7 -13.303 -13.380   2.918
   39    HB3  ASP   7           HB1      ASP   7 -12.975 -13.289   1.190
   40    H    ALA   8           HN       ALA   8 -14.118  -9.244   2.677
   41    HA   ALA   8           HA       ALA   8 -16.743 -10.246   1.913
   42    HB1  ALA   8           HB3      ALA   8 -16.493  -8.949   3.987
   43    HB2  ALA   8           HB1      ALA   8 -17.603  -8.179   2.854
   44    HB3  ALA   8           HB2      ALA   8 -15.962  -7.558   3.041
   45    H    SER   9           HN       SER   9 -17.529  -9.997  -0.066
   46    HA   SER   9           HA       SER   9 -17.819  -9.289  -2.208
   47    HG   SER   9           HG       SER   9 -18.996  -7.368  -0.033
   48    HB2  SER   9           HB2      SER   9 -17.156  -6.611  -0.961
   49    HB3  SER   9           HB1      SER   9 -17.864  -6.833  -2.561
   50    H    GLY  10           HN       GLY  10 -15.117 -10.091  -1.269
   51    HA2  GLY  10           HA2      GLY  10 -13.269 -10.506  -2.702
   52    HA3  GLY  10           HA1      GLY  10 -13.645  -9.024  -3.570
   53    H    PHE  11           HN       PHE  11 -13.869  -7.312  -1.318
   54    HA   PHE  11           HA       PHE  11 -11.200  -6.524  -0.990
   55    HD1  PHE  11           HD1      PHE  11 -14.707  -5.310  -1.728
   56    HD2  PHE  11           HD2      PHE  11 -11.132  -3.428  -0.391
   57    HE1  PHE  11           HE1      PHE  11 -14.969  -3.588  -3.466
   58    HE2  PHE  11           HE2      PHE  11 -11.387  -1.702  -2.126
   59    HZ   PHE  11           HZ       PHE  11 -13.302  -1.777  -3.664
   60    HB2  PHE  11           HB2      PHE  11 -13.731  -5.799   0.473
   61    HB3  PHE  11           HB1      PHE  11 -12.176  -5.112   0.929
   62    H    SER  12           HN       SER  12  -9.643  -7.137   0.364
   63    HA   SER  12           HA       SER  12 -10.307  -8.364   2.912
   64    HG   SER  12           HG       SER  12  -9.359 -10.584   3.471
   65    HB2  SER  12           HB2      SER  12 -10.257 -10.284   1.392
   66    HB3  SER  12           HB1      SER  12  -8.653  -9.814   0.831
   67    H    LEU  13           HN       LEU  13  -8.671  -8.277   4.427
   68    HA   LEU  13           HA       LEU  13  -6.560  -6.359   3.838
   69    HG   LEU  13           HG       LEU  13  -9.139  -6.177   5.534
   70    HB2  LEU  13           HB2      LEU  13  -7.319  -7.656   6.460
   71    HB3  LEU  13           HB1      LEU  13  -6.214  -6.310   6.252
   72   HD11  LEU  13          HD11      LEU  13  -8.905  -6.590   7.925
   73   HD12  LEU  13          HD12      LEU  13  -9.435  -4.936   7.619
   74   HD13  LEU  13          HD13      LEU  13  -7.757  -5.257   8.050
   75   HD21  LEU  13          HD23      LEU  13  -7.780  -4.563   4.369
   76   HD22  LEU  13          HD21      LEU  13  -7.000  -4.083   5.875
   77   HD23  LEU  13          HD22      LEU  13  -8.713  -3.746   5.622
   78    H    TYR  14           HN       TYR  14  -4.859  -7.321   2.830
   79    HA   TYR  14           HA       TYR  14  -3.691  -9.662   4.182
   80    HD1  TYR  14           HD1      TYR  14  -5.711  -8.407   0.797
   81    HD2  TYR  14           HD2      TYR  14  -1.573  -9.369   0.469
   82    HE1  TYR  14           HE1      TYR  14  -5.562  -7.056  -1.250
   83    HE2  TYR  14           HE2      TYR  14  -1.421  -8.023  -1.574
   84    HH   TYR  14           HH       TYR  14  -3.849  -5.865  -2.551
   85    HB2  TYR  14           HB2      TYR  14  -2.962 -10.533   2.031
   86    HB3  TYR  14           HB1      TYR  14  -4.707 -10.319   2.037
   87    H    SER  15           HN       SER  15  -1.432  -9.812   4.232
   88    HA   SER  15           HA       SER  15  -0.044  -7.271   3.681
   89    HG   SER  15           HG       SER  15  -0.218  -7.265   6.974
   90    HB2  SER  15           HB2      SER  15   0.811  -9.300   5.742
   91    HB3  SER  15           HB1      SER  15   1.318  -7.618   5.592
   92    H    VAL  16           HN       VAL  16   2.164  -7.389   3.011
   93    HA   VAL  16           HA       VAL  16   2.911  -9.968   1.791
   94    HB   VAL  16           HB       VAL  16   3.667  -7.316   0.588
   95   HG11  VAL  16          HG11      VAL  16   3.938  -8.668  -1.441
   96   HG12  VAL  16          HG12      VAL  16   3.462 -10.106  -0.538
   97   HG13  VAL  16          HG13      VAL  16   4.948  -9.254  -0.121
   98   HG21  VAL  16          HG23      VAL  16   1.238  -7.338   0.679
   99   HG22  VAL  16          HG21      VAL  16   1.207  -8.946  -0.046
  100   HG23  VAL  16          HG22      VAL  16   1.791  -7.569  -0.981
  101    H    GLU  17           HN       GLU  17   5.233 -10.289   1.510
  102    HA   GLU  17           HA       GLU  17   6.791  -8.789   3.512
  103    HB2  GLU  17           HB2      GLU  17   7.114 -11.670   2.661
  104    HB3  GLU  17           HB1      GLU  17   8.127 -10.831   3.828
  105    HG2  GLU  17           HG2      GLU  17   6.235 -10.557   5.315
  106    HG3  GLU  17           HG1      GLU  17   5.171 -11.318   4.132
  107    H    LEU  18           HN       LEU  18   8.049  -7.385   2.472
  108    HA   LEU  18           HA       LEU  18   9.532  -8.330   0.105
  109    HG   LEU  18           HG       LEU  18   7.721  -5.587  -1.587
  110    HB2  LEU  18           HB2      LEU  18   8.370  -5.649   0.777
  111    HB3  LEU  18           HB1      LEU  18   9.752  -5.760  -0.294
  112   HD11  LEU  18          HD11      LEU  18   9.524  -6.965  -2.489
  113   HD12  LEU  18          HD12      LEU  18   7.940  -7.556  -2.994
  114   HD13  LEU  18          HD13      LEU  18   8.824  -8.387  -1.714
  115   HD21  LEU  18          HD23      LEU  18   6.816  -8.113  -0.218
  116   HD22  LEU  18          HD21      LEU  18   5.959  -7.240  -1.486
  117   HD23  LEU  18          HD22      LEU  18   6.182  -6.499   0.098
  118    H    PHE  19           HN       PHE  19  11.727  -7.894  -0.024
  119    HA   PHE  19           HA       PHE  19  12.939  -6.835   2.439
  120    HD1  PHE  19           HD2      PHE  19  12.040 -10.180   0.470
  121    HD2  PHE  19           HD1      PHE  19  15.997  -8.711  -0.080
  122    HE1  PHE  19           HE2      PHE  19  12.228 -11.474  -1.614
  123    HE2  PHE  19           HE1      PHE  19  16.189  -9.999  -2.167
  124    HZ   PHE  19           HZ       PHE  19  14.326 -11.402  -2.921
  125    HB2  PHE  19           HB2      PHE  19  14.883  -8.336   1.949
  126    HB3  PHE  19           HB1      PHE  19  13.395  -9.189   2.344
  127    H    ARG  20           HN       ARG  20  13.928  -4.971   2.161
  128    HA   ARG  20           HA       ARG  20  15.018  -4.351  -0.506
  129    HE   ARG  20           HE       ARG  20  15.621   1.006   0.353
  130    HB2  ARG  20           HB2      ARG  20  13.229  -2.847   0.219
  131    HB3  ARG  20           HB1      ARG  20  14.111  -2.489   1.698
  132    HG2  ARG  20           HG2      ARG  20  15.842  -1.378   0.467
  133    HG3  ARG  20           HG1      ARG  20  15.124  -1.872  -1.066
  134    HD2  ARG  20           HD2      ARG  20  13.335  -0.411  -0.845
  135    HD3  ARG  20           HD1      ARG  20  13.537  -0.271   0.901
  136   HH11  ARG  20          HH11      ARG  20  12.966   0.830  -1.898
  137   HH12  ARG  20          HH12      ARG  20  13.346   2.336  -2.663
  138   HH21  ARG  20          HH21      ARG  20  16.129   2.990  -0.649
  139   HH22  ARG  20          HH22      ARG  20  15.143   3.564  -1.952
  140    H    GLU  21           HN       GLU  21  17.046  -3.230  -0.626
  141    HA   GLU  21           HA       GLU  21  18.771  -3.745   1.699
  142    HB2  GLU  21           HB2      GLU  21  19.485  -3.714  -1.232
  143    HB3  GLU  21           HB1      GLU  21  20.639  -3.915   0.078
  144    HG2  GLU  21           HG2      GLU  21  19.509  -5.976   0.754
  145    HG3  GLU  21           HG1      GLU  21  18.367  -5.778  -0.575
  146    H    LYS  22           HN       LYS  22  19.020  -1.763  -1.217
  147    HA   LYS  22           HA       LYS  22  19.423   0.607   0.466
  148    HB2  LYS  22           HB2      LYS  22  21.203  -0.198  -1.843
  149    HB3  LYS  22           HB1      LYS  22  21.299   1.327  -0.973
  150    HG2  LYS  22           HG2      LYS  22  21.727  -1.391   0.252
  151    HG3  LYS  22           HG1      LYS  22  23.007  -0.293  -0.265
  152    HD2  LYS  22           HD2      LYS  22  22.248   1.374   1.343
  153    HD3  LYS  22           HD1      LYS  22  20.925   0.314   1.835
  154    HE2  LYS  22           HE2      LYS  22  22.544  -1.348   2.607
  155    HE3  LYS  22           HE1      LYS  22  23.866  -0.294   2.109
  156    HZ1  LYS  22           HZ3      LYS  22  23.447  -0.115   4.476
  157    HZ2  LYS  22           HZ1      LYS  22  21.842   0.335   4.189
  158    HZ3  LYS  22           HZ2      LYS  22  23.104   1.352   3.709
  159    H    ASP  23           HN       ASP  23  19.888   2.488  -1.439
  160    HA   ASP  23           HA       ASP  23  17.357   3.083  -2.419
  161    HB2  ASP  23           HB2      ASP  23  19.117   4.771  -2.116
  162    HB3  ASP  23           HB1      ASP  23  20.026   4.070  -3.452
  163    H    THR  24           HN       THR  24  19.884   1.138  -3.794
  164    HA   THR  24           HA       THR  24  19.034   1.165  -6.484
  165    HB   THR  24           HB       THR  24  20.707  -0.745  -4.863
  166    HG1  THR  24           HG1      THR  24  21.696   0.534  -7.113
  167   HG21  THR  24          HG23      THR  24  21.294  -1.838  -7.011
  168   HG22  THR  24          HG21      THR  24  19.986  -0.942  -7.781
  169   HG23  THR  24          HG22      THR  24  19.626  -2.113  -6.513
  170    H    SER  25           HN       SER  25  18.198  -0.806  -3.690
  171    HA   SER  25           HA       SER  25  16.552  -2.608  -5.226
  172    HG   SER  25           HG       SER  25  18.401  -3.454  -4.106
  173    HB2  SER  25           HB2      SER  25  16.847  -2.284  -2.231
  174    HB3  SER  25           HB1      SER  25  15.987  -3.596  -3.036
  175    H    SER  26           HN       SER  26  15.473  -0.456  -6.019
  176    HA   SER  26           HA       SER  26  13.644   0.927  -4.430
  177    HG   SER  26           HG       SER  26  14.831   1.903  -7.649
  178    HB2  SER  26           HB2      SER  26  13.478   0.307  -7.390
  179    HB3  SER  26           HB1      SER  26  12.541   1.545  -6.554
  180    H    LEU  27           HN       LEU  27  11.563   0.590  -3.830
  181    HA   LEU  27           HA       LEU  27  10.601  -2.119  -3.891
  182    HG   LEU  27           HG       LEU  27  11.407  -0.073  -1.633
  183    HB2  LEU  27           HB2      LEU  27   9.272   0.367  -2.810
  184    HB3  LEU  27           HB1      LEU  27   8.782  -1.288  -2.496
  185   HD11  LEU  27          HD11      LEU  27   8.940  -0.728  -0.029
  186   HD12  LEU  27          HD12      LEU  27   9.511   0.891  -0.434
  187   HD13  LEU  27          HD13      LEU  27  10.474  -0.147   0.617
  188   HD21  LEU  27          HD23      LEU  27  11.572  -2.467  -2.028
  189   HD22  LEU  27          HD21      LEU  27  10.150  -2.747  -1.023
  190   HD23  LEU  27          HD22      LEU  27  11.632  -2.119  -0.301
  191    H    GLY  28           HN       GLY  28   9.790   0.932  -5.434
  192    HA2  GLY  28           HA2      GLY  28   8.796   1.085  -7.566
  193    HA3  GLY  28           HA1      GLY  28   8.177  -0.546  -7.372
  194    H    ILE  29           HN       ILE  29   7.440   0.773  -4.529
  195    HA   ILE  29           HA       ILE  29   4.691   0.954  -5.029
  196    HB   ILE  29           HB       ILE  29   6.238   2.175  -2.740
  197   HG12  ILE  29          HG12      ILE  29   4.828  -0.497  -2.920
  198   HG13  ILE  29          HG11      ILE  29   6.570  -0.277  -3.047
  199   HG21  ILE  29          HG21      ILE  29   4.105   2.056  -1.525
  200   HG22  ILE  29          HG22      ILE  29   3.309   1.507  -3.000
  201   HG23  ILE  29          HG23      ILE  29   4.011   3.123  -2.927
  202   HD11  ILE  29          HD13      ILE  29   6.615   0.611  -0.770
  203   HD12  ILE  29          HD11      ILE  29   5.948  -1.020  -0.830
  204   HD13  ILE  29          HD12      ILE  29   4.873   0.366  -0.647
  205    H    SER  30           HN       SER  30   3.802   2.402  -6.366
  206    HA   SER  30           HA       SER  30   4.697   5.203  -6.177
  207    HG   SER  30           HG       SER  30   2.882   5.807  -8.974
  208    HB2  SER  30           HB2      SER  30   5.044   4.212  -8.402
  209    HB3  SER  30           HB1      SER  30   3.331   3.805  -8.491
  210    H    ILE  31           HN       ILE  31   3.372   6.020  -4.633
  211    HA   ILE  31           HA       ILE  31   0.514   5.484  -4.715
  212    HB   ILE  31           HB       ILE  31   0.418   6.861  -2.661
  213   HG12  ILE  31          HG12      ILE  31   3.430   6.988  -2.951
  214   HG13  ILE  31          HG11      ILE  31   2.336   8.341  -3.216
  215   HG21  ILE  31          HG21      ILE  31   0.746   4.451  -2.522
  216   HG22  ILE  31          HG22      ILE  31   1.605   5.277  -1.222
  217   HG23  ILE  31          HG23      ILE  31   2.493   4.672  -2.621
  218   HD11  ILE  31          HD13      ILE  31   3.353   8.508  -1.041
  219   HD12  ILE  31          HD11      ILE  31   2.793   6.890  -0.620
  220   HD13  ILE  31          HD12      ILE  31   1.627   8.190  -0.866
  221    H    SER  32           HN       SER  32  -0.987   7.375  -4.420
  222    HA   SER  32           HA       SER  32  -0.092   9.825  -5.732
  223    HG   SER  32           HG       SER  32   0.094   8.777  -7.803
  224    HB2  SER  32           HB2      SER  32  -2.444   8.184  -6.703
  225    HB3  SER  32           HB1      SER  32  -2.016   9.793  -7.284
  226    H    GLY  33           HN       GLY  33  -1.129  11.638  -5.038
  227    HA2  GLY  33           HA2      GLY  33  -2.897  11.312  -2.750
  228    HA3  GLY  33           HA1      GLY  33  -2.155  12.811  -3.290
  229    H    MET  34           HN       MET  34  -5.030  11.355  -2.893
  230    HA   MET  34           HA       MET  34  -6.422  11.887  -5.285
  231    HB2  MET  34           HB2      MET  34  -7.275  10.417  -3.492
  232    HB3  MET  34           HB1      MET  34  -7.490  11.821  -2.457
  233    HG2  MET  34           HG2      MET  34  -9.117  12.733  -4.041
  234    HG3  MET  34           HG1      MET  34  -8.911  11.310  -5.061
  235    HE1  MET  34           HE3      MET  34  -9.667   8.864  -4.365
  236    HE2  MET  34           HE1      MET  34 -10.334   8.462  -2.783
  237    HE3  MET  34           HE2      MET  34  -8.654   8.980  -2.927
  238    H    ARG  35           HN       ARG  35  -7.907  13.583  -5.772
  239    HA   ARG  35           HA       ARG  35  -7.680  16.032  -4.206
  240    HE   ARG  35           HE       ARG  35  -4.458  15.683  -7.216
  241    HB2  ARG  35           HB2      ARG  35  -7.149  17.393  -6.179
  242    HB3  ARG  35           HB1      ARG  35  -5.879  16.226  -5.842
  243    HG2  ARG  35           HG2      ARG  35  -8.022  15.593  -7.828
  244    HG3  ARG  35           HG1      ARG  35  -6.649  16.605  -8.278
  245    HD2  ARG  35           HD2      ARG  35  -6.428  13.844  -7.089
  246    HD3  ARG  35           HD1      ARG  35  -6.335  14.201  -8.811
  247   HH11  ARG  35          HH11      ARG  35  -5.048  12.703  -8.922
  248   HH12  ARG  35          HH12      ARG  35  -3.369  12.350  -9.150
  249   HH21  ARG  35          HH21      ARG  35  -2.242  15.229  -7.517
  250   HH22  ARG  35          HH22      ARG  35  -1.772  13.787  -8.351
  251    H    ASP  36           HN       ASP  36  -9.858  14.331  -4.390
  252    HA   ASP  36           HA       ASP  36 -11.729  14.901  -6.378
  253    HB2  ASP  36           HB2      ASP  36 -11.969  13.070  -4.737
  254    HB3  ASP  36           HB1      ASP  36 -12.263  14.256  -3.469
  255    H    GLN  37           HN       GLN  37 -13.317  16.434  -6.622
  256    HA   GLN  37           HA       GLN  37 -13.189  18.735  -4.782
  257    HB2  GLN  37           HB2      GLN  37 -13.744  18.768  -7.754
  258    HB3  GLN  37           HB1      GLN  37 -13.717  20.174  -6.699
  259    HG2  GLN  37           HG2      GLN  37 -11.353  19.808  -6.251
  260    HG3  GLN  37           HG1      GLN  37 -11.372  18.379  -7.282
  261   HE21  GLN  37          HE21      GLN  37 -11.473  21.846  -7.178
  262   HE22  GLN  37          HE22      GLN  37 -11.186  22.110  -8.861
  263    H    SER  38           HN       SER  38 -15.264  20.204  -5.406
  264    HA   SER  38           HA       SER  38 -17.499  20.477  -5.114
  265    HG   SER  38           HG       SER  38 -17.854  20.445  -7.504
  266    HB2  SER  38           HB2      SER  38 -17.646  17.794  -6.509
  267    HB3  SER  38           HB1      SER  38 -19.008  18.884  -6.251
  268    H    THR  39           HN       THR  39 -19.569  19.137  -4.301
  269    HA   THR  39           HA       THR  39 -20.574  18.270  -2.453
  270    HB   THR  39           HB       THR  39 -19.962  16.061  -1.790
  271    HG1  THR  39           HG1      THR  39 -17.946  15.235  -2.062
  272   HG21  THR  39          HG23      THR  39 -20.880  16.268  -4.060
  273   HG22  THR  39          HG21      THR  39 -19.763  14.909  -3.932
  274   HG23  THR  39          HG22      THR  39 -19.243  16.407  -4.703
  275    H    THR  40           HN       THR  40 -19.833  17.153  -0.144
  276    HA   THR  40           HA       THR  40 -17.787  18.907   1.030
  277    HB   THR  40           HB       THR  40 -19.954  19.934   1.513
  278    HG1  THR  40           HG1      THR  40 -19.278  18.757   3.965
  279   HG21  THR  40          HG23      THR  40 -20.635  17.290   2.802
  280   HG22  THR  40          HG21      THR  40 -21.387  17.974   1.361
  281   HG23  THR  40          HG22      THR  40 -21.599  18.761   2.927
  282    H    GLY  41           HN       GLY  41 -17.782  16.081   0.251
  283    HA2  GLY  41           HA2      GLY  41 -16.917  15.003   2.827
  284    HA3  GLY  41           HA1      GLY  41 -18.148  14.102   1.957
  285    H    GLU  42           HN       GLU  42 -14.856  15.381   1.689
  286    HA   GLU  42           HA       GLU  42 -14.273  13.530  -0.486
  287    HB2  GLU  42           HB2      GLU  42 -12.552  15.634   0.840
  288    HB3  GLU  42           HB1      GLU  42 -12.059  14.652  -0.532
  289    HG2  GLU  42           HG2      GLU  42 -12.711  16.742  -1.397
  290    HG3  GLU  42           HG1      GLU  42 -14.007  15.614  -1.789
  291    H    ALA  43           HN       ALA  43 -12.510  12.032  -0.387
  292    HA   ALA  43           HA       ALA  43 -11.691  11.278   2.334
  293    HB1  ALA  43           HB3      ALA  43 -12.052   8.936   1.852
  294    HB2  ALA  43           HB1      ALA  43 -12.594   9.327   0.219
  295    HB3  ALA  43           HB2      ALA  43 -13.551   9.833   1.611
  296    H    THR  44           HN       THR  44  -9.753  12.471   1.627
  297    HA   THR  44           HA       THR  44  -8.118  11.352  -0.458
  298    HB   THR  44           HB       THR  44  -6.406  12.949   0.293
  299    HG1  THR  44           HG1      THR  44  -8.292  13.630   2.322
  300   HG21  THR  44          HG23      THR  44  -9.166  14.166   0.133
  301   HG22  THR  44          HG21      THR  44  -8.155  13.717  -1.241
  302   HG23  THR  44          HG22      THR  44  -7.647  15.012  -0.157
  303    H    GLY  45           HN       GLY  45  -6.693   9.733  -0.282
  304    HA2  GLY  45           HA2      GLY  45  -5.516   9.128   2.329
  305    HA3  GLY  45           HA1      GLY  45  -6.445   7.859   1.546
  306    H    ILE  46           HN       ILE  46  -4.013   7.124   2.066
  307    HA   ILE  46           HA       ILE  46  -2.284   7.711  -0.220
  308    HB   ILE  46           HB       ILE  46  -1.674   6.000   2.192
  309   HG12  ILE  46          HG12      ILE  46  -2.160   8.286   2.905
  310   HG13  ILE  46          HG11      ILE  46  -0.438   7.956   3.054
  311   HG21  ILE  46          HG21      ILE  46   0.109   7.231   0.098
  312   HG22  ILE  46          HG22      ILE  46  -0.256   5.517   0.293
  313   HG23  ILE  46          HG23      ILE  46   0.668   6.368   1.531
  314   HD11  ILE  46          HD13      ILE  46  -0.013   9.185   1.001
  315   HD12  ILE  46          HD11      ILE  46  -0.870  10.187   2.173
  316   HD13  ILE  46          HD12      ILE  46  -1.740   9.484   0.810
  317    H    TYR  47           HN       TYR  47  -2.784   6.536  -1.970
  318    HA   TYR  47           HA       TYR  47  -3.006   3.622  -1.641
  319    HD1  TYR  47           HD1      TYR  47  -5.519   6.857  -1.960
  320    HD2  TYR  47           HD2      TYR  47  -4.379   4.829  -5.522
  321    HE1  TYR  47           HE1      TYR  47  -6.080   8.859  -3.272
  322    HE2  TYR  47           HE2      TYR  47  -4.936   6.826  -6.844
  323    HH   TYR  47           HH       TYR  47  -5.457   9.855  -5.465
  324    HB2  TYR  47           HB2      TYR  47  -4.702   3.608  -3.469
  325    HB3  TYR  47           HB1      TYR  47  -5.256   4.418  -2.007
  326    H    VAL  48           HN       VAL  48  -2.042   2.379  -3.206
  327    HA   VAL  48           HA       VAL  48  -0.048   3.698  -4.823
  328    HB   VAL  48           HB       VAL  48  -0.707   0.754  -4.651
  329   HG11  VAL  48          HG11      VAL  48   1.730   2.195  -5.688
  330   HG12  VAL  48          HG12      VAL  48   0.548   1.307  -6.650
  331   HG13  VAL  48          HG13      VAL  48   1.579   0.447  -5.507
  332   HG21  VAL  48          HG23      VAL  48   1.339   2.374  -3.139
  333   HG22  VAL  48          HG21      VAL  48   1.187   0.618  -3.095
  334   HG23  VAL  48          HG22      VAL  48  -0.111   1.633  -2.465
  335    H    LYS  49           HN       LYS  49  -0.459   4.445  -6.789
  336    HA   LYS  49           HA       LYS  49  -2.769   3.530  -8.271
  337    HB2  LYS  49           HB2      LYS  49  -2.234   5.923  -8.183
  338    HB3  LYS  49           HB1      LYS  49  -0.689   5.611  -8.960
  339    HG2  LYS  49           HG2      LYS  49  -1.885   4.787 -10.951
  340    HG3  LYS  49           HG1      LYS  49  -3.414   5.193 -10.170
  341    HD2  LYS  49           HD2      LYS  49  -2.867   6.987 -11.641
  342    HD3  LYS  49           HD1      LYS  49  -2.590   7.556  -9.993
  343    HE2  LYS  49           HE2      LYS  49  -0.778   8.248 -11.467
  344    HE3  LYS  49           HE1      LYS  49  -0.197   7.118 -10.244
  345    HZ1  LYS  49           HZ3      LYS  49  -0.844   6.451 -13.066
  346    HZ2  LYS  49           HZ1      LYS  49  -0.325   5.344 -11.895
  347    HZ3  LYS  49           HZ2      LYS  49   0.708   6.582 -12.406
  348    H    SER  50           HN       SER  50   0.740   3.307  -8.484
  349    HA   SER  50           HA       SER  50   0.445   1.154 -10.418
  350    HG   SER  50           HG       SER  50   0.206   2.663 -12.776
  351    HB2  SER  50           HB2      SER  50   2.115   3.610 -11.004
  352    HB3  SER  50           HB1      SER  50   2.101   2.135 -11.972
  353    H    LEU  51           HN       LEU  51   2.689   0.246 -10.981
  354    HA   LEU  51           HA       LEU  51   4.486   0.395  -8.657
  355    HG   LEU  51           HG       LEU  51   1.942  -1.201  -8.352
  356    HB2  LEU  51           HB2      LEU  51   3.574  -2.126 -10.050
  357    HB3  LEU  51           HB1      LEU  51   4.801  -2.050  -8.800
  358   HD11  LEU  51          HD11      LEU  51   1.617  -3.354  -7.259
  359   HD12  LEU  51          HD12      LEU  51   3.244  -3.848  -7.730
  360   HD13  LEU  51          HD13      LEU  51   2.015  -3.567  -8.964
  361   HD21  LEU  51          HD23      LEU  51   3.563  -0.254  -6.798
  362   HD22  LEU  51          HD21      LEU  51   4.191  -1.866  -6.455
  363   HD23  LEU  51          HD22      LEU  51   2.541  -1.445  -5.994
  364    H    ILE  52           HN       ILE  52   6.657   0.240  -9.107
  365    HA   ILE  52           HA       ILE  52   7.444   0.779 -11.806
  366    HB   ILE  52           HB       ILE  52   9.097   0.328  -9.321
  367   HG12  ILE  52          HG12      ILE  52   7.697   2.345  -9.264
  368   HG13  ILE  52          HG11      ILE  52   9.404   2.764  -9.381
  369   HG21  ILE  52          HG21      ILE  52  10.433  -0.253 -11.235
  370   HG22  ILE  52          HG22      ILE  52  10.959   1.315 -10.620
  371   HG23  ILE  52          HG23      ILE  52   9.954   1.228 -12.067
  372   HD11  ILE  52          HD13      ILE  52   7.418   2.777 -11.643
  373   HD12  ILE  52          HD11      ILE  52   9.128   3.184 -11.774
  374   HD13  ILE  52          HD12      ILE  52   8.053   4.189 -10.800
  375    HA   PRO  53           HA       PRO  53   7.768  -3.583 -12.915
  376    HB2  PRO  53           HB2      PRO  53   9.182  -2.414 -15.248
  377    HB3  PRO  53           HB1      PRO  53   7.819  -3.536 -15.205
  378    HG2  PRO  53           HG2      PRO  53   7.458  -0.982 -15.866
  379    HG3  PRO  53           HG1      PRO  53   6.266  -1.848 -14.877
  380    HD2  PRO  53           HD2      PRO  53   8.341   0.139 -14.041
  381    HD3  PRO  53           HD1      PRO  53   6.673  -0.060 -13.466
  382    H    GLY  54           HN       GLY  54   9.289  -4.909 -12.164
  383    HA2  GLY  54           HA2      GLY  54  11.471  -5.854 -12.241
  384    HA3  GLY  54           HA1      GLY  54  12.109  -4.274 -12.667
  385    H    SER  55           HN       SER  55  10.187  -3.331 -10.363
  386    HA   SER  55           HA       SER  55  12.248  -3.173  -8.399
  387    HG   SER  55           HG       SER  55   8.810  -3.165  -8.794
  388    HB2  SER  55           HB2      SER  55  10.635  -1.930  -7.069
  389    HB3  SER  55           HB1      SER  55  10.553  -1.387  -8.744
  390    H    ALA  56           HN       ALA  56  11.308  -3.550  -5.978
  391    HA   ALA  56           HA       ALA  56  11.290  -6.367  -5.660
  392    HB1  ALA  56           HB3      ALA  56  10.686  -4.220  -3.632
  393    HB2  ALA  56           HB1      ALA  56  12.283  -4.864  -4.008
  394    HB3  ALA  56           HB2      ALA  56  11.061  -5.906  -3.277
  395    H    ALA  57           HN       ALA  57   8.807  -3.917  -4.920
  396    HA   ALA  57           HA       ALA  57   6.772  -5.658  -4.170
  397    HB1  ALA  57           HB3      ALA  57   6.692  -3.245  -3.792
  398    HB2  ALA  57           HB1      ALA  57   5.238  -3.818  -4.610
  399    HB3  ALA  57           HB2      ALA  57   6.491  -2.978  -5.524
  400    H    ALA  58           HN       ALA  58   7.815  -4.634  -7.358
  401    HA   ALA  58           HA       ALA  58   5.551  -5.619  -8.771
  402    HB1  ALA  58           HB3      ALA  58   6.899  -5.285 -10.773
  403    HB2  ALA  58           HB1      ALA  58   8.338  -5.061  -9.778
  404    HB3  ALA  58           HB2      ALA  58   7.018  -3.895  -9.694
  405    H    LEU  59           HN       LEU  59   8.878  -6.878  -8.470
  406    HA   LEU  59           HA       LEU  59   8.443  -9.281  -9.828
  407    HG   LEU  59           HG       LEU  59  10.749  -7.285  -9.673
  408    HB2  LEU  59           HB2      LEU  59  10.404  -8.643  -7.625
  409    HB3  LEU  59           HB1      LEU  59  10.456 -10.095  -8.606
  410   HD11  LEU  59          HD11      LEU  59  12.832  -9.414  -9.209
  411   HD12  LEU  59          HD12      LEU  59  12.640  -7.935  -8.270
  412   HD13  LEU  59          HD13      LEU  59  13.100  -7.845  -9.970
  413   HD21  LEU  59          HD23      LEU  59   9.795  -8.843 -11.296
  414   HD22  LEU  59          HD21      LEU  59  11.126  -9.965 -11.007
  415   HD23  LEU  59          HD22      LEU  59  11.442  -8.390 -11.737
  416    H    ASP  60           HN       ASP  60   7.457  -8.297  -6.693
  417    HA   ASP  60           HA       ASP  60   7.348 -10.744  -5.347
  418    HB2  ASP  60           HB2      ASP  60   6.967  -8.505  -4.306
  419    HB3  ASP  60           HB1      ASP  60   5.384  -8.458  -5.079
  420    H    GLY  61           HN       GLY  61   4.805  -9.113  -7.246
  421    HA2  GLY  61           HA2      GLY  61   3.383 -10.248  -8.767
  422    HA3  GLY  61           HA1      GLY  61   3.739 -11.753  -7.937
  423    H    ARG  62           HN       ARG  62   3.230 -10.601  -5.277
  424    HA   ARG  62           HA       ARG  62   0.361 -10.972  -5.302
  425    HE   ARG  62           HE       ARG  62   3.498 -11.776  -1.798
  426    HB2  ARG  62           HB2      ARG  62   2.262 -10.533  -2.993
  427    HB3  ARG  62           HB1      ARG  62   0.559 -10.944  -2.841
  428    HG2  ARG  62           HG2      ARG  62   1.003 -13.054  -4.053
  429    HG3  ARG  62           HG1      ARG  62   2.720 -12.648  -4.062
  430    HD2  ARG  62           HD2      ARG  62   1.008 -13.017  -1.606
  431    HD3  ARG  62           HD1      ARG  62   2.153 -14.195  -2.246
  432   HH11  ARG  62          HH11      ARG  62   1.973 -14.357  -0.023
  433   HH12  ARG  62          HH12      ARG  62   2.978 -14.163   1.375
  434   HH21  ARG  62          HH21      ARG  62   4.828 -11.516   0.039
  435   HH22  ARG  62          HH22      ARG  62   4.599 -12.549   1.411
  436    H    ILE  63           HN       ILE  63   2.224  -8.364  -5.858
  437    HA   ILE  63           HA       ILE  63   0.313  -6.524  -4.572
  438    HB   ILE  63           HB       ILE  63   3.136  -5.869  -5.429
  439   HG12  ILE  63          HG12      ILE  63   2.044  -6.306  -2.637
  440   HG13  ILE  63          HG11      ILE  63   3.037  -7.463  -3.515
  441   HG21  ILE  63          HG21      ILE  63   1.612  -3.967  -5.484
  442   HG22  ILE  63          HG22      ILE  63   2.781  -3.801  -4.174
  443   HG23  ILE  63          HG23      ILE  63   1.125  -4.298  -3.821
  444   HD11  ILE  63          HD13      ILE  63   3.864  -4.710  -2.631
  445   HD12  ILE  63          HD11      ILE  63   4.859  -5.821  -3.569
  446   HD13  ILE  63          HD12      ILE  63   4.376  -6.243  -1.927
  447    H    GLU  64           HN       GLU  64  -1.007  -5.488  -5.900
  448    HA   GLU  64           HA       GLU  64  -0.127  -4.957  -8.655
  449    HB2  GLU  64           HB2      GLU  64  -2.626  -6.276  -7.695
  450    HB3  GLU  64           HB1      GLU  64  -2.725  -5.237  -9.110
  451    HG2  GLU  64           HG2      GLU  64  -1.076  -6.577 -10.255
  452    HG3  GLU  64           HG1      GLU  64  -0.859  -7.581  -8.822
  453    HA   PRO  65           HA       PRO  65  -1.327  -0.747  -8.169
  454    HB2  PRO  65           HB2      PRO  65  -2.887  -0.336 -10.424
  455    HB3  PRO  65           HB1      PRO  65  -1.124  -0.260 -10.384
  456    HG2  PRO  65           HG2      PRO  65  -2.904  -2.510 -11.225
  457    HG3  PRO  65           HG1      PRO  65  -1.391  -1.944 -11.955
  458    HD2  PRO  65           HD2      PRO  65  -1.448  -4.131 -10.427
  459    HD3  PRO  65           HD1      PRO  65  -0.079  -3.001 -10.352
  460    H    ASN  66           HN       ASN  66  -3.331   0.734  -8.277
  461    HA   ASN  66           HA       ASN  66  -5.340   1.276  -7.361
  462    HB2  ASN  66           HB2      ASN  66  -6.073   0.020  -9.426
  463    HB3  ASN  66           HB1      ASN  66  -6.278  -1.401  -8.406
  464   HD21  ASN  66          HD21      ASN  66  -7.435   1.807  -9.121
  465   HD22  ASN  66          HD22      ASN  66  -8.960   1.649  -8.324
  466    H    ASP  67           HN       ASP  67  -3.652   0.403  -5.498
  467    HA   ASP  67           HA       ASP  67  -5.292  -1.323  -3.760
  468    HB2  ASP  67           HB2      ASP  67  -3.254  -2.489  -4.347
  469    HB3  ASP  67           HB1      ASP  67  -2.280  -1.086  -3.914
  470    H    LYS  68           HN       LYS  68  -5.339  -0.799  -1.520
  471    HA   LYS  68           HA       LYS  68  -4.692   2.023  -0.985
  472    HB2  LYS  68           HB2      LYS  68  -7.088   1.489  -0.883
  473    HB3  LYS  68           HB1      LYS  68  -6.765   0.251   0.323
  474    HG2  LYS  68           HG2      LYS  68  -5.932   1.985   1.854
  475    HG3  LYS  68           HG1      LYS  68  -6.326   3.212   0.648
  476    HD2  LYS  68           HD2      LYS  68  -8.687   2.512   0.742
  477    HD3  LYS  68           HD1      LYS  68  -8.271   1.336   1.992
  478    HE2  LYS  68           HE2      LYS  68  -7.494   3.158   3.435
  479    HE3  LYS  68           HE1      LYS  68  -7.932   4.326   2.190
  480    HZ1  LYS  68           HZ3      LYS  68  -9.796   2.525   3.642
  481    HZ2  LYS  68           HZ1      LYS  68 -10.244   3.577   2.393
  482    HZ3  LYS  68           HZ2      LYS  68  -9.653   4.197   3.851
  483    H    ILE  69           HN       ILE  69  -2.835   2.183   0.094
  484    HA   ILE  69           HA       ILE  69  -1.781   0.113   1.744
  485    HB   ILE  69           HB       ILE  69  -0.941   3.012   1.576
  486   HG12  ILE  69          HG12      ILE  69  -0.831   1.883  -0.600
  487   HG13  ILE  69          HG11      ILE  69   0.782   2.220   0.018
  488   HG21  ILE  69          HG21      ILE  69   1.210   2.199   2.457
  489   HG22  ILE  69          HG22      ILE  69   0.503   0.597   2.661
  490   HG23  ILE  69          HG23      ILE  69  -0.115   1.961   3.595
  491   HD11  ILE  69          HD13      ILE  69   0.977  -0.111   0.743
  492   HD12  ILE  69          HD11      ILE  69   0.687   0.025  -0.992
  493   HD13  ILE  69          HD12      ILE  69  -0.628  -0.439   0.086
  494    H    LEU  70           HN       LEU  70  -1.667  -0.049   3.951
  495    HA   LEU  70           HA       LEU  70  -3.399   1.791   5.464
  496    HG   LEU  70           HG       LEU  70  -4.334  -0.883   4.128
  497    HB2  LEU  70           HB2      LEU  70  -2.784  -1.104   6.058
  498    HB3  LEU  70           HB1      LEU  70  -3.842  -0.066   6.994
  499   HD11  LEU  70          HD11      LEU  70  -4.488  -2.786   5.649
  500   HD12  LEU  70          HD12      LEU  70  -6.075  -2.324   5.035
  501   HD13  LEU  70          HD13      LEU  70  -5.600  -1.881   6.675
  502   HD21  LEU  70          HD23      LEU  70  -6.566   0.042   4.501
  503   HD22  LEU  70          HD21      LEU  70  -5.321   1.274   4.702
  504   HD23  LEU  70          HD22      LEU  70  -6.086   0.555   6.119
  505    H    ARG  71           HN       ARG  71  -0.926  -0.619   6.351
  506    HA   ARG  71           HA       ARG  71   0.577   1.512   7.699
  507    HE   ARG  71           HE       ARG  71   0.324   0.804  11.644
  508    HB2  ARG  71           HB2      ARG  71  -0.089  -1.158   8.951
  509    HB3  ARG  71           HB1      ARG  71   0.885   0.114   9.676
  510    HG2  ARG  71           HG2      ARG  71  -1.058   1.588   9.720
  511    HG3  ARG  71           HG1      ARG  71  -2.037   0.319   8.981
  512    HD2  ARG  71           HD2      ARG  71  -2.425   0.335  11.357
  513    HD3  ARG  71           HD1      ARG  71  -1.549  -1.133  10.923
  514   HH11  ARG  71          HH11      ARG  71  -2.229  -1.060  13.107
  515   HH12  ARG  71          HH12      ARG  71  -1.504  -1.060  14.679
  516   HH21  ARG  71          HH21      ARG  71   1.288   0.811  13.710
  517   HH22  ARG  71          HH22      ARG  71   0.495   0.004  15.023
  518    H    VAL  72           HN       VAL  72   2.731   1.375   7.508
  519    HA   VAL  72           HA       VAL  72   3.817  -0.839   5.944
  520    HB   VAL  72           HB       VAL  72   5.310   1.635   6.817
  521   HG11  VAL  72          HG11      VAL  72   6.730  -0.096   5.945
  522   HG12  VAL  72          HG12      VAL  72   6.603   1.187   4.743
  523   HG13  VAL  72          HG13      VAL  72   5.684  -0.306   4.541
  524   HG21  VAL  72          HG23      VAL  72   3.652   1.297   4.319
  525   HG22  VAL  72          HG21      VAL  72   4.679   2.678   4.706
  526   HG23  VAL  72          HG22      VAL  72   3.254   2.336   5.688
  527    H    ASP  73           HN       ASP  73   6.124  -1.521   6.620
  528    HA   ASP  73           HA       ASP  73   6.105  -2.924   8.953
  529    HB2  ASP  73           HB2      ASP  73   7.781  -3.114   7.095
  530    HB3  ASP  73           HB1      ASP  73   8.600  -1.708   7.764
  531    H    ASP  74           HN       ASP  74   5.684  -2.177  10.921
  532    HA   ASP  74           HA       ASP  74   5.759  -0.976  12.846
  533    HB2  ASP  74           HB2      ASP  74   8.615  -0.570  11.947
  534    HB3  ASP  74           HB1      ASP  74   8.015  -0.229  13.566
  535    H    VAL  75           HN       VAL  75   5.378   0.526  10.128
  536    HA   VAL  75           HA       VAL  75   5.326   3.167  11.373
  537    HB   VAL  75           HB       VAL  75   6.576   2.684   8.664
  538   HG11  VAL  75          HG11      VAL  75   6.087   5.241  10.185
  539   HG12  VAL  75          HG12      VAL  75   5.327   4.750   8.672
  540   HG13  VAL  75          HG13      VAL  75   7.053   5.108   8.717
  541   HG21  VAL  75          HG23      VAL  75   8.632   3.544   9.698
  542   HG22  VAL  75          HG21      VAL  75   8.080   2.055  10.464
  543   HG23  VAL  75          HG22      VAL  75   7.809   3.606  11.258
  544    H    ASN  76           HN       ASN  76   3.129   3.321  11.374
  545    HA   ASN  76           HA       ASN  76   1.469   2.482   9.232
  546    HB2  ASN  76           HB2      ASN  76  -0.326   3.627  10.424
  547    HB3  ASN  76           HB1      ASN  76   0.666   2.719  11.562
  548   HD21  ASN  76          HD21      ASN  76   2.001   3.828  12.994
  549   HD22  ASN  76          HD22      ASN  76   1.797   5.512  13.318
  550    H    VAL  77           HN       VAL  77   0.191   3.850   7.815
  551    HA   VAL  77           HA       VAL  77   1.360   6.508   7.343
  552    HB   VAL  77           HB       VAL  77   1.172   6.101   4.883
  553   HG11  VAL  77          HG11      VAL  77   3.063   4.319   6.412
  554   HG12  VAL  77          HG12      VAL  77   3.325   6.013   5.998
  555   HG13  VAL  77          HG13      VAL  77   3.248   4.796   4.725
  556   HG21  VAL  77          HG23      VAL  77  -0.380   4.232   4.924
  557   HG22  VAL  77          HG21      VAL  77   0.814   3.235   5.755
  558   HG23  VAL  77          HG22      VAL  77   1.111   3.773   4.102
  559    H    GLN  78           HN       GLN  78  -1.034   5.970   8.704
  560    HA   GLN  78           HA       GLN  78  -3.085   6.790   6.760
  561    HB2  GLN  78           HB2      GLN  78  -3.421   5.570   9.506
  562    HB3  GLN  78           HB1      GLN  78  -4.735   6.045   8.439
  563    HG2  GLN  78           HG2      GLN  78  -2.674   3.934   7.852
  564    HG3  GLN  78           HG1      GLN  78  -4.331   3.642   8.378
  565   HE21  GLN  78          HE21      GLN  78  -6.026   4.013   6.950
  566   HE22  GLN  78          HE22      GLN  78  -5.775   4.164   5.248
  567    H    GLY  79           HN       GLY  79  -1.162   8.645   7.794
  568    HA2  GLY  79           HA2      GLY  79  -2.864  10.755   8.537
  569    HA3  GLY  79           HA1      GLY  79  -2.102  10.125   9.988
  570    H    MET  80           HN       MET  80  -0.422  10.059   6.933
  571    HA   MET  80           HA       MET  80   1.172  12.387   7.767
  572    HB2  MET  80           HB2      MET  80   2.246   9.757   6.734
  573    HB3  MET  80           HB1      MET  80   3.211  11.206   6.985
  574    HG2  MET  80           HG2      MET  80   2.568  11.134   9.388
  575    HG3  MET  80           HG1      MET  80   1.789   9.583   9.079
  576    HE1  MET  80           HE3      MET  80   4.862   7.395   7.949
  577    HE2  MET  80           HE1      MET  80   3.871   8.386   6.879
  578    HE3  MET  80           HE2      MET  80   3.112   7.448   8.164
  579    H    ALA  81           HN       ALA  81   2.235  13.520   6.072
  580    HA   ALA  81           HA       ALA  81   0.694  13.842   3.748
  581    HB1  ALA  81           HB3      ALA  81   3.521  14.757   4.265
  582    HB2  ALA  81           HB1      ALA  81   2.053  15.636   4.693
  583    HB3  ALA  81           HB2      ALA  81   2.452  15.360   2.997
  584    H    GLN  82           HN       GLN  82   1.203  13.440   1.553
  585    HA   GLN  82           HA       GLN  82   1.958  10.875   0.908
  586    HB2  GLN  82           HB2      GLN  82   0.730  12.417  -0.588
  587    HB3  GLN  82           HB1      GLN  82   2.217  13.312  -0.862
  588    HG2  GLN  82           HG2      GLN  82   3.225  11.314  -1.858
  589    HG3  GLN  82           HG1      GLN  82   1.715  10.439  -1.605
  590   HE21  GLN  82          HE21      GLN  82   1.431  10.053  -3.790
  591   HE22  GLN  82          HE22      GLN  82   0.981  11.296  -4.902
  592    H    SER  83           HN       SER  83   3.962  13.797   0.496
  593    HA   SER  83           HA       SER  83   6.278  12.589  -0.404
  594    HG   SER  83           HG       SER  83   5.244  14.633  -1.099
  595    HB2  SER  83           HB2      SER  83   6.038  15.019   1.385
  596    HB3  SER  83           HB1      SER  83   7.466  14.579   0.449
  597    H    ASP  84           HN       ASP  84   5.183  13.072   2.923
  598    HA   ASP  84           HA       ASP  84   7.499  12.240   4.246
  599    HB2  ASP  84           HB2      ASP  84   5.561  13.338   5.344
  600    HB3  ASP  84           HB1      ASP  84   4.637  11.851   5.151
  601    H    VAL  85           HN       VAL  85   4.723  10.373   3.080
  602    HA   VAL  85           HA       VAL  85   5.460   7.880   4.121
  603    HB   VAL  85           HB       VAL  85   4.009   8.333   1.512
  604   HG11  VAL  85          HG11      VAL  85   3.945   6.057   3.489
  605   HG12  VAL  85          HG12      VAL  85   4.672   6.030   1.882
  606   HG13  VAL  85          HG13      VAL  85   2.924   6.196   2.058
  607   HG21  VAL  85          HG23      VAL  85   2.924   9.673   3.185
  608   HG22  VAL  85          HG21      VAL  85   2.944   8.334   4.333
  609   HG23  VAL  85          HG22      VAL  85   1.940   8.240   2.886
  610    H    VAL  86           HN       VAL  86   6.404   9.548   1.173
  611    HA   VAL  86           HA       VAL  86   7.695   7.394  -0.103
  612    HB   VAL  86           HB       VAL  86   8.388  10.326  -0.337
  613   HG11  VAL  86          HG11      VAL  86   8.803   8.033  -2.251
  614   HG12  VAL  86          HG12      VAL  86  10.059   8.837  -1.310
  615   HG13  VAL  86          HG13      VAL  86   9.192   9.724  -2.564
  616   HG21  VAL  86          HG23      VAL  86   6.019  10.014  -0.717
  617   HG22  VAL  86          HG21      VAL  86   6.345   8.693  -1.839
  618   HG23  VAL  86          HG22      VAL  86   6.831  10.338  -2.248
  619    H    GLU  87           HN       GLU  87   8.853   9.838   2.180
  620    HA   GLU  87           HA       GLU  87  11.582   9.241   2.077
  621    HB2  GLU  87           HB2      GLU  87   9.953  10.209   4.433
  622    HB3  GLU  87           HB1      GLU  87  11.706  10.270   4.319
  623    HG2  GLU  87           HG2      GLU  87  11.500  11.757   2.368
  624    HG3  GLU  87           HG1      GLU  87   9.749  11.737   2.567
  625    H    VAL  88           HN       VAL  88   9.066   7.993   4.253
  626    HA   VAL  88           HA       VAL  88  10.585   6.309   5.825
  627    HB   VAL  88           HB       VAL  88   7.757   5.960   4.832
  628   HG11  VAL  88          HG11      VAL  88   8.576   3.773   5.424
  629   HG12  VAL  88          HG12      VAL  88   7.489   4.345   6.692
  630   HG13  VAL  88          HG13      VAL  88   9.233   4.391   6.941
  631   HG21  VAL  88          HG23      VAL  88   8.879   6.922   7.462
  632   HG22  VAL  88          HG21      VAL  88   7.167   6.731   7.084
  633   HG23  VAL  88          HG22      VAL  88   8.134   7.926   6.218
  634    H    LEU  89           HN       LEU  89   8.888   5.444   2.814
  635    HA   LEU  89           HA       LEU  89   9.727   2.801   2.667
  636    HG   LEU  89           HG       LEU  89   7.251   4.545   1.925
  637    HB2  LEU  89           HB2      LEU  89   9.187   4.679   0.366
  638    HB3  LEU  89           HB1      LEU  89   9.199   2.928   0.281
  639   HD11  LEU  89          HD11      LEU  89   5.607   3.932   0.221
  640   HD12  LEU  89          HD12      LEU  89   6.882   3.181  -0.737
  641   HD13  LEU  89          HD13      LEU  89   6.903   4.921  -0.452
  642   HD21  LEU  89          HD23      LEU  89   7.666   2.307   2.813
  643   HD22  LEU  89          HD21      LEU  89   7.319   1.609   1.231
  644   HD23  LEU  89          HD22      LEU  89   6.044   2.431   2.132
  645    H    ARG  90           HN       ARG  90  11.377   5.748   1.710
  646    HA   ARG  90           HA       ARG  90  13.500   4.334   0.355
  647    HE   ARG  90           HE       ARG  90  12.167   8.913   0.200
  648    HB2  ARG  90           HB2      ARG  90  13.200   7.241   1.122
  649    HB3  ARG  90           HB1      ARG  90  14.548   6.595   0.196
  650    HG2  ARG  90           HG2      ARG  90  12.972   5.871  -1.549
  651    HG3  ARG  90           HG1      ARG  90  11.653   6.595  -0.630
  652    HD2  ARG  90           HD2      ARG  90  14.046   8.045  -1.755
  653    HD3  ARG  90           HD1      ARG  90  12.406   8.089  -2.401
  654   HH11  ARG  90          HH11      ARG  90  13.981   9.962  -2.586
  655   HH12  ARG  90          HH12      ARG  90  13.998  11.627  -2.107
  656   HH21  ARG  90          HH21      ARG  90  12.187  11.101   0.837
  657   HH22  ARG  90          HH22      ARG  90  12.980  12.273  -0.161
  658    H    ASN  91           HN       ASN  91  12.775   5.145   3.565
  659    HA   ASN  91           HA       ASN  91  15.562   5.184   4.418
  660    HB2  ASN  91           HB2      ASN  91  12.986   5.485   5.973
  661    HB3  ASN  91           HB1      ASN  91  14.593   5.560   6.689
  662   HD21  ASN  91          HD21      ASN  91  12.501   7.581   6.591
  663   HD22  ASN  91          HD22      ASN  91  13.198   8.956   5.811
  664    H    ALA  92           HN       ALA  92  13.050   2.947   3.969
  665    HA   ALA  92           HA       ALA  92  13.441   1.107   6.017
  666    HB1  ALA  92           HB3      ALA  92  12.470  -0.552   4.507
  667    HB2  ALA  92           HB1      ALA  92  12.701   0.547   3.148
  668    HB3  ALA  92           HB2      ALA  92  11.584   0.971   4.445
  669    H    GLY  93           HN       GLY  93  14.485   0.211   2.752
  670    HA2  GLY  93           HA2      GLY  93  16.393  -0.828   2.003
  671    HA3  GLY  93           HA1      GLY  93  17.243   0.020   3.285
  672    H    ASN  94           HN       ASN  94  14.623  -2.044   4.155
  673    HA   ASN  94           HA       ASN  94  16.355  -4.322   4.695
  674    HB2  ASN  94           HB2      ASN  94  16.002  -4.365   7.042
  675    HB3  ASN  94           HB1      ASN  94  16.450  -2.703   6.672
  676   HD21  ASN  94          HD21      ASN  94  14.285  -1.474   5.892
  677   HD22  ASN  94          HD22      ASN  94  13.018  -1.560   7.058
  678    HA   PRO  95           HA       PRO  95  12.749  -6.838   4.062
  679    HB2  PRO  95           HB2      PRO  95  12.951  -7.937   6.818
  680    HB3  PRO  95           HB1      PRO  95  12.913  -8.786   5.269
  681    HG2  PRO  95           HG2      PRO  95  15.184  -8.558   6.639
  682    HG3  PRO  95           HG1      PRO  95  15.169  -8.434   4.870
  683    HD2  PRO  95           HD2      PRO  95  15.392  -6.271   6.922
  684    HD3  PRO  95           HD1      PRO  95  16.200  -6.422   5.348
  685    H    VAL  96           HN       VAL  96  11.246  -5.123   4.039
  686    HA   VAL  96           HA       VAL  96   9.900  -4.534   6.581
  687    HB   VAL  96           HB       VAL  96   8.824  -2.657   5.238
  688   HG11  VAL  96          HG11      VAL  96  10.592  -2.282   6.870
  689   HG12  VAL  96          HG12      VAL  96  10.777  -1.203   5.488
  690   HG13  VAL  96          HG13      VAL  96  11.812  -2.622   5.644
  691   HG21  VAL  96          HG23      VAL  96  10.001  -1.922   3.233
  692   HG22  VAL  96          HG21      VAL  96   9.334  -3.539   3.008
  693   HG23  VAL  96          HG22      VAL  96  11.056  -3.332   3.322
  694    H    ARG  97           HN       ARG  97   7.669  -4.607   6.772
  695    HA   ARG  97           HA       ARG  97   6.355  -6.458   4.925
  696    HE   ARG  97           HE       ARG  97   2.357  -8.657   6.970
  697    HB2  ARG  97           HB2      ARG  97   6.410  -7.045   7.331
  698    HB3  ARG  97           HB1      ARG  97   5.534  -5.567   7.698
  699    HG2  ARG  97           HG2      ARG  97   3.616  -6.362   6.447
  700    HG3  ARG  97           HG1      ARG  97   4.496  -7.825   5.997
  701    HD2  ARG  97           HD2      ARG  97   4.662  -8.452   8.352
  702    HD3  ARG  97           HD1      ARG  97   3.801  -6.983   8.809
  703   HH11  ARG  97          HH11      ARG  97   3.071  -8.020  10.319
  704   HH12  ARG  97          HH12      ARG  97   1.611  -8.746  10.903
  705   HH21  ARG  97          HH21      ARG  97   0.431  -9.615   7.728
  706   HH22  ARG  97          HH22      ARG  97   0.110  -9.655   9.430
  707    H    LEU  98           HN       LEU  98   4.396  -5.960   3.956
  708    HA   LEU  98           HA       LEU  98   3.614  -3.125   4.107
  709    HG   LEU  98           HG       LEU  98   5.636  -4.805   2.088
  710    HB2  LEU  98           HB2      LEU  98   3.186  -4.869   1.703
  711    HB3  LEU  98           HB1      LEU  98   3.146  -3.120   1.802
  712   HD11  LEU  98          HD11      LEU  98   6.225  -3.960  -0.124
  713   HD12  LEU  98          HD12      LEU  98   4.665  -3.145  -0.236
  714   HD13  LEU  98          HD13      LEU  98   4.738  -4.907  -0.176
  715   HD21  LEU  98          HD23      LEU  98   5.231  -1.821   1.917
  716   HD22  LEU  98          HD21      LEU  98   6.794  -2.636   1.832
  717   HD23  LEU  98          HD22      LEU  98   5.828  -2.732   3.306
  718    H    LEU  99           HN       LEU  99   1.842  -3.109   5.374
  719    HA   LEU  99           HA       LEU  99  -0.203  -5.163   5.061
  720    HG   LEU  99           HG       LEU  99  -2.361  -3.479   6.617
  721    HB2  LEU  99           HB2      LEU  99   0.393  -4.499   7.326
  722    HB3  LEU  99           HB1      LEU  99   0.018  -2.826   6.963
  723   HD11  LEU  99          HD11      LEU  99  -2.062  -5.807   6.049
  724   HD12  LEU  99          HD12      LEU  99  -3.088  -5.668   7.478
  725   HD13  LEU  99          HD13      LEU  99  -1.397  -6.141   7.648
  726   HD21  LEU  99          HD23      LEU  99  -2.868  -3.783   8.998
  727   HD22  LEU  99          HD21      LEU  99  -1.635  -2.549   8.740
  728   HD23  LEU  99          HD22      LEU  99  -1.171  -4.155   9.305
  729    H    LEU 100           HN       LEU 100  -1.577  -4.879   3.404
  730    HA   LEU 100           HA       LEU 100  -2.874  -2.276   3.135
  731    HG   LEU 100           HG       LEU 100  -0.194  -4.107   1.570
  732    HB2  LEU 100           HB2      LEU 100  -2.640  -2.649   0.564
  733    HB3  LEU 100           HB1      LEU 100  -1.350  -1.888   1.475
  734   HD11  LEU 100          HD11      LEU 100  -2.316  -4.902  -0.418
  735   HD12  LEU 100          HD12      LEU 100  -2.132  -5.542   1.216
  736   HD13  LEU 100          HD13      LEU 100  -0.886  -5.844   0.006
  737   HD21  LEU 100          HD23      LEU 100  -0.780  -2.954  -1.152
  738   HD22  LEU 100          HD21      LEU 100   0.556  -4.044  -0.778
  739   HD23  LEU 100          HD22      LEU 100   0.490  -2.444  -0.040
  740    H    ILE 101           HN       ILE 101  -4.712  -2.371   1.548
  741    HA   ILE 101           HA       ILE 101  -6.051  -4.994   1.703
  742    HB   ILE 101           HB       ILE 101  -7.081  -3.330   3.202
  743   HG12  ILE 101          HG12      ILE 101  -8.785  -4.004   0.789
  744   HG13  ILE 101          HG11      ILE 101  -8.472  -5.074   2.152
  745   HG21  ILE 101          HG21      ILE 101  -7.570  -1.766   0.673
  746   HG22  ILE 101          HG22      ILE 101  -6.478  -1.317   1.985
  747   HG23  ILE 101          HG23      ILE 101  -8.218  -1.374   2.266
  748   HD11  ILE 101          HD13      ILE 101  -9.939  -2.450   2.271
  749   HD12  ILE 101          HD11      ILE 101  -9.630  -3.523   3.636
  750   HD13  ILE 101          HD12      ILE 101 -10.666  -4.057   2.313
  751    H    ARG 102           HN       ARG 102  -7.172  -5.701  -0.093
  752    HA   ARG 102           HA       ARG 102  -7.675  -4.041  -2.360
  753    HE   ARG 102           HE       ARG 102  -6.296  -6.415  -5.224
  754    HB2  ARG 102           HB2      ARG 102  -5.077  -5.018  -2.206
  755    HB3  ARG 102           HB1      ARG 102  -5.882  -6.138  -3.294
  756    HG2  ARG 102           HG2      ARG 102  -5.874  -3.147  -3.629
  757    HG3  ARG 102           HG1      ARG 102  -4.764  -4.251  -4.439
  758    HD2  ARG 102           HD2      ARG 102  -7.768  -4.318  -4.684
  759    HD3  ARG 102           HD1      ARG 102  -6.674  -3.592  -5.856
  760   HH11  ARG 102          HH11      ARG 102  -7.461  -3.981  -7.430
  761   HH12  ARG 102          HH12      ARG 102  -7.537  -5.061  -8.783
  762   HH21  ARG 102          HH21      ARG 102  -6.397  -7.843  -7.001
  763   HH22  ARG 102          HH22      ARG 102  -6.936  -7.254  -8.538
  764    H    ARG 103           HN       ARG 103  -9.271  -4.896  -3.547
  765    HA   ARG 103           HA       ARG 103 -10.615  -7.203  -2.707
  766    HE   ARG 103           HE       ARG 103 -13.922  -8.356  -6.542
  767    HB2  ARG 103           HB2      ARG 103 -11.790  -5.432  -3.858
  768    HB3  ARG 103           HB1      ARG 103 -10.794  -5.643  -5.291
  769    HG2  ARG 103           HG2      ARG 103 -11.753  -7.898  -5.587
  770    HG3  ARG 103           HG1      ARG 103 -12.804  -7.600  -4.202
  771    HD2  ARG 103           HD2      ARG 103 -13.875  -5.773  -5.341
  772    HD3  ARG 103           HD1      ARG 103 -12.739  -5.893  -6.683
  773   HH11  ARG 103          HH11      ARG 103 -15.055  -5.081  -6.907
  774   HH12  ARG 103          HH12      ARG 103 -16.438  -5.529  -7.848
  775   HH21  ARG 103          HH21      ARG 103 -15.740  -8.953  -7.781
  776   HH22  ARG 103          HH22      ARG 103 -16.828  -7.729  -8.344
  777    H    LEU 104           HN       LEU 104 -10.843  -9.234  -3.608
  778    HA   LEU 104           HA       LEU 104  -8.492 -10.205  -5.019
  779    HG   LEU 104           HG       LEU 104  -9.530 -10.308  -2.244
  780    HB2  LEU 104           HB2      LEU 104 -10.816 -11.832  -4.014
  781    HB3  LEU 104           HB1      LEU 104  -9.184 -12.378  -4.352
  782   HD11  LEU 104          HD11      LEU 104 -11.316 -11.838  -1.699
  783   HD12  LEU 104          HD12      LEU 104  -9.981 -12.051  -0.566
  784   HD13  LEU 104          HD13      LEU 104 -10.226 -13.216  -1.867
  785   HD21  LEU 104          HD23      LEU 104  -7.767 -12.738  -2.524
  786   HD22  LEU 104          HD21      LEU 104  -7.681 -11.540  -1.231
  787   HD23  LEU 104          HD22      LEU 104  -7.309 -11.076  -2.892
  788    HA   PRO 105           HA       PRO 105 -10.689 -10.505  -8.879
  789    HB2  PRO 105           HB2      PRO 105  -8.974 -11.968 -10.293
  790    HB3  PRO 105           HB1      PRO 105  -8.510 -10.359  -9.718
  791    HG2  PRO 105           HG2      PRO 105  -7.894 -13.040  -8.518
  792    HG3  PRO 105           HG1      PRO 105  -6.783 -11.692  -8.840
  793    HD2  PRO 105           HD2      PRO 105  -7.886 -12.162  -6.394
  794    HD3  PRO 105           HD1      PRO 105  -7.457 -10.537  -6.961
  795    H    LEU 106           HN       LEU 106 -12.064 -11.975  -7.244
  796    HA   LEU 106           HA       LEU 106 -12.058 -14.739  -7.405
  797    HG   LEU 106           HG       LEU 106 -12.769 -12.723  -5.275
  798    HB2  LEU 106           HB2      LEU 106 -14.406 -12.860  -7.156
  799    HB3  LEU 106           HB1      LEU 106 -14.498 -14.592  -6.898
  800   HD11  LEU 106          HD11      LEU 106 -15.138 -12.253  -4.927
  801   HD12  LEU 106          HD12      LEU 106 -14.424 -13.018  -3.507
  802   HD13  LEU 106          HD13      LEU 106 -15.435 -13.961  -4.601
  803   HD21  LEU 106          HD23      LEU 106 -11.943 -15.024  -5.373
  804   HD22  LEU 106          HD21      LEU 106 -13.524 -15.614  -4.861
  805   HD23  LEU 106          HD22      LEU 106 -12.554 -14.628  -3.765
  806    H    LEU 107           HN       LEU 107 -12.012 -15.927  -9.182
  807    HA   LEU 107           HA       LEU 107 -13.175 -15.026 -11.658
  808    HG   LEU 107           HG       LEU 107 -10.305 -15.700 -10.837
  809    HB2  LEU 107           HB2      LEU 107 -11.869 -17.648 -10.937
  810    HB3  LEU 107           HB1      LEU 107 -12.317 -17.151 -12.558
  811   HD11  LEU 107          HD11      LEU 107  -9.538 -17.950 -11.413
  812   HD12  LEU 107          HD12      LEU 107  -8.611 -16.708 -12.254
  813   HD13  LEU 107          HD13      LEU 107  -9.853 -17.616 -13.115
  814   HD21  LEU 107          HD23      LEU 107 -10.975 -15.457 -13.768
  815   HD22  LEU 107          HD21      LEU 107  -9.710 -14.572 -12.914
  816   HD23  LEU 107          HD22      LEU 107 -11.405 -14.295 -12.512
  817    H    GLU 108           HN       GLU 108 -14.743 -16.238 -12.887
  818    HA   GLU 108           HA       GLU 108 -16.453 -18.027 -11.315
  819    HB2  GLU 108           HB2      GLU 108 -18.453 -16.844 -12.355
  820    HB3  GLU 108           HB1      GLU 108 -17.616 -15.993 -11.066
  821    HG2  GLU 108           HG2      GLU 108 -16.436 -14.642 -12.732
  822    HG3  GLU 108           HG1      GLU 108 -17.298 -15.486 -14.017